A0A5K4FCF0_SCHMA Loading...

Pecanex-like protein

AlphaFold DB , UniProt , Accession A0A5K4FCF0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 785 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	28.1	Very low	29.4	Very low	239 Å²	239	167.8 Å²	167.8	100%	1.177	86%	0.856	S	S	*	*				0	61.7	0	-152.4	179.9	-177.4	0	0	110.5
2	V	33.9	Very low	29	Very low	134 Å²	134	169.6 Å²	169.6	81%	0.812	86%	0.858	S	S	*	*			trans	-141.6	97.1	159.3	179.2	0	0	0	0	104.5	T4	V2-T4 PolarHBondContact O-N 2.8Å
3	D	30.6	Very low	28.8	Very low	155 Å²	155	172.7 Å²	172.7	83%	0.829	86%	0.862	S	S	*	*			trans	-61.9	118.8	176.5	-74.8	-43.4	0	0	0	109.8	N5	D3-N5 PolarHBondContact O-N 2.99Å
4	T	35.8	Very low	28.8	Very low	131 Å²	131	167.9 Å²	167.9	80%	0.804	85%	0.849	S	S	*	*			trans	-82.6	12.6	179.4	46.3	0	0	0	0	113.9	V2	V2-T4 PolarHBondContact O-N 2.8Å
5	N	31.7	Very low	28.7	Very low	147 Å²	147	168.9 Å²	168.9	79%	0.786	86%	0.857	S	S	*	*			trans	-116	24.4	-165.6	-82.4	1.6	0	0	0	116.1	D3	D3-N5 PolarHBondContact O-N 2.99Å
6	R	26	Very low	28.5	Very low	233 Å²	233	168.9 Å²	168.9	88%	0.879	85%	0.849	S	S	*	*	S	Bend	trans	-128.9	117.5	169.6	-72	-171.3	-179.8	-177.4	0.7	112.7
7	N	27.8	Very low	28.3	Very low	138 Å²	138	169.9 Å²	169.9	74%	0.738	85%	0.85	S	S	*	*	S	Bend	trans	104.6	36	159.1	-56.5	0.5	0	0	0	118.5
8	Y	28.4	Very low	28	Very low	240 Å²	240	164.6 Å²	164.6	94%	0.941	85%	0.845	S	S	*	*	S	Bend	trans	-91.2	11.5	161.2	-107.6	-81.8	0	0	0	114.5
9	T	28.8	Very low	27.9	Very low	129 Å²	129	167.2 Å²	167.2	79%	0.791	85%	0.85	S	S	*	*	S	Bend	trans	-135.2	28	-165.3	54.2	0	0	0	0	116.9
10	E	26.1	Very low	27.7	Very low	177 Å²	177	169.8 Å²	169.8	83%	0.827	85%	0.848	S	S	*	*	S	Bend	trans	-125.7	12.8	178.6	-110.2	180	-175.2	0	0	117.5
11	C	26.3	Very low	27.5	Very low	123 Å²	123	170.9 Å²	170.9	83%	0.831	85%	0.848	S	S	*	*	S	Bend	trans	-127.1	42.9	170.7	-74.9	0	0	0	0	113
12	H	24.4	Very low	27.4	Very low	189 Å²	189	164.6 Å²	164.6	88%	0.875	83%	0.828	S	S	*	*			trans	-142.7	90.5	162.7	-79.4	-73.9	0	0	0	109.8
13	K	26	Very low	27.1	Very low	210 Å²	210	165.1 Å²	165.1	91%	0.913	83%	0.826	S	S	*	*			trans	-127.9	134.5	154.6	-87	-175.6	178.9	173.9	0	109.7
14	P	28.8	Very low	27	Very low	105 Å²	105	163.5 Å²	163.5	68%	0.682	81%	0.813	S	S	*	*			trans	-111.7	130.8	-148.6	31.7	-14.8	0	0	0	112.4	K16	P14-K16 PolarHBondContact O-N 2.88Å
15	L	27.8	Very low	26.4	Very low	184 Å²	184	166.4 Å²	166.4	96%	0.963	82%	0.815	S	S	*	*			trans	-89.2	81	156.5	-75.8	158.8	0	0	0	106
16	K	25.3	Very low	26.4	Very low	169 Å²	169	164.2 Å²	164.2	74%	0.735	82%	0.818	S	S	*	*				37.9	115.3	88	-91.1	-169.4	180	-177.6	0	114.4	P14	P14-K16 PolarHBondContact O-N 2.88Å
17	Q	25.9	Very low	26.6	Very low	185 Å²	185	158 Å²	158	86%	0.864	81%	0.81	S	S	*	*			trans	86.5	90.5	152	-61.3	179.4	-3	0	0	117.9
18	G	23.1	Very low	26.6	Very low	74 Å²	74	158.3 Å²	158.3	76%	0.763	81%	0.807	S	S	*	*				87.6	94.4	106.3	0	0	0	0	0	117
19	K	26	Very low	26.6	Very low	215 Å²	215	157.5 Å²	157.5	94%	0.935	80%	0.802	S	S	*	*				-170.5	151.6	105.5	-101.3	169	-177.3	176.3	0	110.3
20	R	23.5	Very low	26.7	Very low	218 Å²	218	154.7 Å²	154.7	82%	0.823	79%	0.788	S	S	*	*			trans	-64.3	166.2	-167.4	-67.4	168.9	173.2	172.8	-3.2	113.5
21	F	24	Very low	27	Very low	193 Å²	193	151.7 Å²	151.7	85%	0.846	78%	0.778	S	S	*	*			trans	88.8	121.9	165.4	-57.9	-79.1	0	0	0	114.3
22	S	25.1	Very low	27.4	Very low	107 Å²	107	150.8 Å²	150.8	75%	0.748	77%	0.765	S	S	*	*			cis	-164.7	147	-0.5	46	0	0	0	0	107.6	H24	S22-H24 PolarHBondContact O-N 3.27Å
23	D	27.6	Very low	27.7	Very low	145 Å²	145	149 Å²	149	78%	0.775	76%	0.757	S	S	*	*			trans	-43.2	123.6	-178.8	-52.8	-47.3	0	0	0	113.7
24	H	27.7	Very low	28.3	Very low	121 Å²	121	146.2 Å²	146.2	56%	0.56	75%	0.747	S	S	*	*			trans	153.3	73.1	144.9	-80.6	-39	0	0	0	110.3	S22 K688	S22-H24 PolarHBondContact O-N 3.27Å; H24-K688 VanDerWaalsContact CD2-CE 3.44Å; H24-K688 WeakPolarHBondContact CD2-CE 3.48Å; H24-K688 WeakPolarHBondContact CE1-CE 3.3Å; H24-K688 PolarHBondContact CE1-NZ 3.33Å; H24-K688 VanDerWaalsContact CE1-NZ 3.29Å; H24-K688 WeakPolarHBondContact NE2-CE 3.44Å; H24-K688 PolarHBondContact NE2-NZ 2.84Å
25	F	25.1	Very low	28.5	Very low	192 Å²	192	148.3 Å²	148.3	84%	0.842	75%	0.749	S	S	*	*			trans	-163.9	64.1	149.6	-95.9	-70.5	0	0	0	108.5
26	A	29.9	Very low	28.9	Very low	102 Å²	102	148.1 Å²	148.1	84%	0.843	74%	0.737	S	S	*	*			trans	-131.5	70.5	168.6	0	0	0	0	0	108.1
27	S	30.7	Very low	29.7	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	73%	0.727	S	S	*	*	S	Bend	trans	-157.4	10.2	167	54.2	0	0	0	0	114.8
28	E	28.7	Very low	30.6	Very low	146 Å²	146	140 Å²	140	68%	0.682	71%	0.713	S	S	*	*	S	Bend	trans	-106	6.8	176.9	-103.2	179.8	170.7	0	0	113.7
29	W	28.4	Very low	31.6	Very low	222 Å²	222	139.8 Å²	139.8	84%	0.841	70%	0.7	S	S	*	*	S	Bend	trans	-107.1	3.3	-178.5	-71.8	63.8	0	0	0	114
30	S	31.4	Very low	32.5	Very low	70 Å²	70	133.3 Å²	133.3	49%	0.49	68%	0.68	S	S	.	*	S	Bend	trans	-79.9	-32.3	175.6	56.6	0	0	0	0	113.9	N32 E33	S30-N32 PolarHBondContact O-N 3.45Å; S30-E33 PolarHBondContact O-N 3.14Å; S30-E33 VanDerWaalsContact O-N 3.12Å
31	D	31.6	Very low	34.2	Very low	114 Å²	114	127.5 Å²	127.5	61%	0.61	66%	0.663	S	S	*	*	H	α-helix	trans	-73.5	-18.8	-167.8	-61.5	1	0	0	0	113
32	N	33.6	Very low	35.6	Very low	105 Å²	105	124 Å²	124	56%	0.561	65%	0.649	S	S	*	*	H	α-helix	trans	-79.1	-27.1	174.5	-68.7	-35	0	0	0	112.3	S30 Y36	S30-N32 PolarHBondContact O-N 3.45Å; N32-Y36 WeakPolarHBondContact O-CD2 3.28Å; N32-Y36 PolarHBondContact O-N 2.96Å
33	E	31.8	Very low	37.4	Very low	152 Å²	152	121.9 Å²	121.9	71%	0.71	63%	0.631	S	S	*	*	H	α-helix	trans	-73.3	-37.2	-179.3	-70.2	-173.1	164.2	0	0	111.9	S30 Y36 S37	S30-E33 PolarHBondContact O-N 3.14Å; S30-E33 VanDerWaalsContact O-N 3.12Å; E33-Y36 PolarHBondContact O-N 3.23Å; E33-S37 PolarHBondContact O-N 3.47Å; E33-S37 VanDerWaalsContact O-N 3.14Å
34	E	37.5	Very low	39.2	Very low	151 Å²	151	119 Å²	119	71%	0.706	62%	0.616	S	S	*	*	H	α-helix	trans	-65.8	-40.4	176.5	-111.9	178.2	178.4	0	0	112.4	Y36 S37 D38	E34-Y36 VanDerWaalsContact C-N 3.33Å; E34-Y36 PolarHBondContact O-N 3.44Å; E34-S37 PolarHBondContact O-N 2.9Å; E34-D38 PolarHBondContact O-N 2.83Å
35	M	34.8	Very low	41	Very low	148 Å²	148	118.6 Å²	118.6	73%	0.729	61%	0.613	S	S	*	*	H	α-helix	trans	-64.6	-33.6	178.5	-114.2	-164.3	88.3	0	0	113.4
36	Y	34.8	Very low	42.8	Very low	180 Å²	180	115 Å²	115	71%	0.706	60%	0.599	S	S	*	*	H	α-helix	trans	-78.5	-33	176.7	-85.9	-79.5	0	0	0	112.4	N32 E33 E34 C40	N32-Y36 WeakPolarHBondContact O-CD2 3.28Å; N32-Y36 PolarHBondContact O-N 2.96Å; E33-Y36 PolarHBondContact O-N 3.23Å; E34-Y36 VanDerWaalsContact C-N 3.33Å; E34-Y36 PolarHBondContact O-N 3.44Å; Y36-C40 WeakPolarHBondContact O-CB 3.42Å; Y36-C40 PolarHBondContact O-N 3.15Å; Y36-C40 VanDerWaalsContact O-N 3.08Å
37	S	43.2	Very low	44.7	Very low	76 Å²	76	115.2 Å²	115.2	53%	0.531	58%	0.58	S	S	.	*	H	α-helix	trans	-62.5	-49.7	176.3	-175.7	0	0	0	0	112	E33 E34 C39 C40 E41	E33-S37 PolarHBondContact O-N 3.47Å; E33-S37 VanDerWaalsContact O-N 3.14Å; E34-S37 PolarHBondContact O-N 2.9Å; S37-C39 VanDerWaalsContact C-N 3.33Å; S37-C39 PolarHBondContact O-N 3.06Å; S37-C40 PolarHBondContact O-N 3.19Å; S37-E41 PolarHBondContact O-N 3.41Å
38	D	44.2	Very low	46.6	Very low	107 Å²	107	114 Å²	114	57%	0.572	57%	0.571	S	S	*	*	H	α-helix	trans	-63.4	-38	-179.9	-92.1	0.2	0	0	0	112.4	E34 E41 Q42	E34-D38 PolarHBondContact O-N 2.83Å; D38-E41 PolarHBondContact O-N 3.37Å; D38-Q42 WeakPolarHBondContact O-CB 3.36Å; D38-Q42 PolarHBondContact O-N 3.3Å
39	C	44.4	Very low	48.6	Very low	71 Å²	71	111.4 Å²	111.4	48%	0.48	56%	0.561	S	S	.	*	H	α-helix	trans	-65.1	-44.6	176.6	-171.6	0	0	0	0	111.6	S37 Q42 V43	S37-C39 VanDerWaalsContact C-N 3.33Å; S37-C39 PolarHBondContact O-N 3.06Å; C39-Q42 PolarHBondContact O-N 2.95Å; C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.45Å; C39-V43 PolarHBondContact O-N 3.05Å
40	C	45.3	Very low	50.7	Low	78 Å²	78	104.6 Å²	104.6	53%	0.527	54%	0.536	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176.5	-85.4	0	0	0	0	112.1	Y36 S37 Q42 V43 N44	Y36-C40 WeakPolarHBondContact O-CB 3.42Å; Y36-C40 PolarHBondContact O-N 3.15Å; Y36-C40 VanDerWaalsContact O-N 3.08Å; S37-C40 PolarHBondContact O-N 3.19Å; C40-Q42 VanDerWaalsContact C-N 3.34Å; C40-Q42 PolarHBondContact O-N 3.38Å; C40-V43 PolarHBondContact O-N 3.12Å; C40-N44 WeakPolarHBondContact O-CB 3.42Å; C40-N44 VanDerWaalsContact O-CG 3.28Å; C40-N44 PolarHBondContact O-N 3.22Å; C40-N44 PolarHBondContact O-ND2 3.14Å
41	E	58.1	Low	52.8	Low	96 Å²	96	108.5 Å²	108.5	45%	0.449	54%	0.541	S	S	.	.	H	α-helix	trans	-64.1	-40.5	177.6	-154.8	-156.1	179.7	0	0	111.3	S37 D38 N44 K45	S37-E41 PolarHBondContact O-N 3.41Å; D38-E41 PolarHBondContact O-N 3.37Å; E41-N44 PolarHBondContact O-N 2.8Å; E41-K45 WeakPolarHBondContact O-CG 3.49Å; E41-K45 PolarHBondContact O-N 3.21Å; E41-K45 WeakPolarHBondContact OE1-CE 3.43Å; E41-K45 IonicContact OE1-NZ 3.78Å; E41-K45 PolarHBondContact OE1-NZ 3.28Å; E41-K45 IonicContact OE2-NZ 2.87Å; E41-K45 PolarHBondContact OE2-NZ 2.8Å
42	Q	54.3	Low	54.9	Low	121 Å²	121	107.5 Å²	107.5	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-68.6	-39	179	-156.4	169.3	28.9	0	0	112.4	D38 C39 C40 K45 Q46	D38-Q42 WeakPolarHBondContact O-CB 3.36Å; D38-Q42 PolarHBondContact O-N 3.3Å; C39-Q42 PolarHBondContact O-N 2.95Å; C40-Q42 VanDerWaalsContact C-N 3.34Å; C40-Q42 PolarHBondContact O-N 3.38Å; Q42-K45 PolarHBondContact O-N 2.84Å; Q42-Q46 WeakPolarHBondContact O-CG 3.38Å; Q42-Q46 PolarHBondContact O-N 3.43Å
43	V	61.8	Low	56.8	Low	61 Å²	61	105.6 Å²	105.6	37%	0.37	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-40.2	172.8	171.4	0	0	0	0	111	C39 C40 Q46 K47	C39-V43 VanDerWaalsContact O-CG2 3.29Å; C39-V43 WeakPolarHBondContact O-CG2 3.45Å; C39-V43 PolarHBondContact O-N 3.05Å; C40-V43 PolarHBondContact O-N 3.12Å; V43-Q46 PolarHBondContact O-N 3.43Å; V43-K47 HydrophobicContact CG1-CD 4.37Å; V43-K47 WeakPolarHBondContact O-CG 3.38Å; V43-K47 PolarHBondContact O-N 3.48Å
44	N	65	Low	59	Low	86 Å²	86	103.5 Å²	103.5	46%	0.46	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-43.9	177.1	-74.6	-18.2	0	0	0	112	C40 E41 Q46 K47 C48	C40-N44 WeakPolarHBondContact O-CB 3.42Å; C40-N44 VanDerWaalsContact O-CG 3.28Å; C40-N44 PolarHBondContact O-N 3.22Å; C40-N44 PolarHBondContact O-ND2 3.14Å; E41-N44 PolarHBondContact O-N 2.8Å; N44-Q46 VanDerWaalsContact C-N 3.29Å; N44-Q46 PolarHBondContact O-N 2.95Å; N44-K47 PolarHBondContact O-N 3Å; N44-K47 VanDerWaalsContact O-N 3.17Å; N44-C48 PolarHBondContact O-N 2.85Å; N44-C48 PolarHBondContact O-SG 3.37Å; N44-C48 VanDerWaalsContact O-SG 3.39Å
45	K	66.3	Low	60.9	Low	111 Å²	111	101.9 Å²	101.9	48%	0.483	50%	0.504	S	S	.	.	H	α-helix	trans	-57.4	-41.8	173.5	-75.5	171.7	-178.4	161.4	0	111.6	E41 Q42 C48 L49	E41-K45 WeakPolarHBondContact O-CG 3.49Å; E41-K45 PolarHBondContact O-N 3.21Å; E41-K45 WeakPolarHBondContact OE1-CE 3.43Å; E41-K45 IonicContact OE1-NZ 3.78Å; E41-K45 PolarHBondContact OE1-NZ 3.28Å; E41-K45 IonicContact OE2-NZ 2.87Å; E41-K45 PolarHBondContact OE2-NZ 2.8Å; Q42-K45 PolarHBondContact O-N 2.84Å; K45-C48 PolarHBondContact O-N 3.04Å; K45-L49 WeakPolarHBondContact O-CG 3.33Å; K45-L49 PolarHBondContact O-N 2.94Å
46	Q	63.2	Low	62.9	Low	118 Å²	118	96.4 Å²	96.4	55%	0.551	48%	0.478	S	S	*	.	H	α-helix	trans	-66.9	-40	175.6	-73.6	-179	3.1	0	0	113.2	Q42 V43 N44 L49 Y50	Q42-Q46 WeakPolarHBondContact O-CG 3.38Å; Q42-Q46 PolarHBondContact O-N 3.43Å; V43-Q46 PolarHBondContact O-N 3.43Å; N44-Q46 VanDerWaalsContact C-N 3.29Å; N44-Q46 PolarHBondContact O-N 2.95Å; Q46-L49 PolarHBondContact O-N 3.08Å; Q46-Y50 PolarHBondContact O-N 3.03Å
47	K	69.4	Low	65	Low	106 Å²	106	89.3 Å²	89.3	46%	0.461	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173.9	-75.4	176.2	-178.2	174	0	111.4	V43 N44 L49 Y50 Y51	V43-K47 HydrophobicContact CG1-CD 4.37Å; V43-K47 WeakPolarHBondContact O-CG 3.38Å; V43-K47 PolarHBondContact O-N 3.48Å; N44-K47 PolarHBondContact O-N 3Å; N44-K47 VanDerWaalsContact O-N 3.17Å; K47-L49 PolarHBondContact O-N 3.43Å; K47-Y50 WeakPolarHBondContact O-CB 3.19Å; K47-Y50 PolarHBondContact O-N 3.36Å; K47-Y51 WeakPolarHBondContact O-CD2 3.46Å; K47-Y51 PolarHBondContact O-N 3.26Å
48	C	70.5	Confident	66.7	Low	74 Å²	74	90.4 Å²	90.4	50%	0.5	45%	0.451	S	S	.	.	H	α-helix	trans	-59.6	-46.7	176.1	-71.6	0	0	0	0	111.6	N44 K45 Y50 Y51 I52	N44-C48 PolarHBondContact O-N 2.85Å; N44-C48 PolarHBondContact O-SG 3.37Å; N44-C48 VanDerWaalsContact O-SG 3.39Å; K45-C48 PolarHBondContact O-N 3.04Å; C48-Y50 VanDerWaalsContact C-N 3.3Å; C48-Y50 PolarHBondContact O-N 3.25Å; C48-Y51 PolarHBondContact O-N 2.8Å; C48-I52 VanDerWaalsContact O-CG1 3.26Å; C48-I52 WeakPolarHBondContact O-CG1 3.19Å; C48-I52 PolarHBondContact O-N 3.34Å
49	L	70	Confident	68.3	Low	92 Å²	92	89.7 Å²	89.7	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-58	-42.4	174.8	-80.5	162.6	0	0	0	112.1	K45 Q46 K47 I52 Y53	K45-L49 WeakPolarHBondContact O-CG 3.33Å; K45-L49 PolarHBondContact O-N 2.94Å; Q46-L49 PolarHBondContact O-N 3.08Å; K47-L49 PolarHBondContact O-N 3.43Å; L49-I52 PolarHBondContact O-N 3.26Å; L49-Y53 HydrophobicContact CB-CE2 4.48Å; L49-Y53 HydrophobicContact CD2-CE2 4.38Å; L49-Y53 WeakPolarHBondContact O-CD2 3.45Å; L49-Y53 PolarHBondContact O-N 2.89Å
50	Y	72.7	Confident	70	Confident	79 Å²	79	86.8 Å²	86.8	31%	0.31	43%	0.426	S	S	.	.	H	α-helix	trans	-61	-44.8	175.8	176.2	-92.1	0	0	0	112.7	Q46 K47 C48 I52 Y53 K54 M163	Q46-Y50 PolarHBondContact O-N 3.03Å; K47-Y50 WeakPolarHBondContact O-CB 3.19Å; K47-Y50 PolarHBondContact O-N 3.36Å; C48-Y50 VanDerWaalsContact C-N 3.3Å; C48-Y50 PolarHBondContact O-N 3.25Å; Y50-I52 VanDerWaalsContact C-N 3.34Å; Y50-Y53 PolarHBondContact O-N 3.46Å; Y50-K54 WeakPolarHBondContact O-CB 3.48Å; Y50-K54 PolarHBondContact O-N 3.41Å; Y50-M163 HydrophobicContact CD2-CE 3.7Å; Y50-M163 HydrophobicContact CD2-SD 3.88Å; Y50-M163 HydrophobicContact CE2-CE 3.21Å; Y50-M163 HydrophobicContact CE2-SD 4.02Å
51	Y	75.6	Confident	71.7	Confident	152 Å²	152	87.1 Å²	87.1	60%	0.596	42%	0.422	S	S	*	.	H	α-helix	trans	-64.8	-38.7	176	-74.4	-64.3	0	0	0	112.2	K47 C48 K54 L55	K47-Y51 WeakPolarHBondContact O-CD2 3.46Å; K47-Y51 PolarHBondContact O-N 3.26Å; C48-Y51 PolarHBondContact O-N 2.8Å; Y51-K54 PolarHBondContact O-N 3.29Å; Y51-L55 WeakPolarHBondContact O-CB 3.12Å; Y51-L55 PolarHBondContact O-N 2.94Å
52	I	76.4	Confident	72.9	Confident	93 Å²	93	87 Å²	87	48%	0.477	42%	0.424	S	S	.	.	H	α-helix	trans	-61.5	-46.8	174.7	-68.6	165.6	0	0	0	110.5	C48 L49 Y50 K54 L55 L56	C48-I52 VanDerWaalsContact O-CG1 3.26Å; C48-I52 WeakPolarHBondContact O-CG1 3.19Å; C48-I52 PolarHBondContact O-N 3.34Å; L49-I52 PolarHBondContact O-N 3.26Å; Y50-I52 VanDerWaalsContact C-N 3.34Å; I52-K54 PolarHBondContact O-N 2.97Å; I52-L55 PolarHBondContact O-N 2.68Å; I52-L56 HydrophobicContact CG2-CD1 4.34Å; I52-L56 PolarHBondContact O-N 3.12Å
53	Y	74.2	Confident	74.1	Confident	65 Å²	65	81.7 Å²	81.7	26%	0.255	40%	0.399	S	S	.	.	H	α-helix	trans	-64.1	-39.2	176.8	-76.8	-63.1	0	0	0	112.5	L49 Y50 L56 I57 L159	L49-Y53 HydrophobicContact CB-CE2 4.48Å; L49-Y53 HydrophobicContact CD2-CE2 4.38Å; L49-Y53 WeakPolarHBondContact O-CD2 3.45Å; L49-Y53 PolarHBondContact O-N 2.89Å; Y50-Y53 PolarHBondContact O-N 3.46Å; Y53-L56 WeakPolarHBondContact O-CB 3.27Å; Y53-L56 PolarHBondContact O-N 3.32Å; Y53-I57 WeakPolarHBondContact O-CG1 3.5Å; Y53-I57 PolarHBondContact O-N 3.48Å; Y53-L159 HydrophobicContact CD1-CD2 3.84Å; Y53-L159 HydrophobicContact CE1-CD2 4.18Å
54	K	76.8	Confident	75	Confident	108 Å²	108	81 Å²	81	47%	0.47	39%	0.393	S	S	.	.	H	α-helix	trans	-64.1	-41	175.4	-170.2	-179.6	179	-174.1	0	111.7	Y50 Y51 I52 I57 L58	Y50-K54 WeakPolarHBondContact O-CB 3.48Å; Y50-K54 PolarHBondContact O-N 3.41Å; Y51-K54 PolarHBondContact O-N 3.29Å; I52-K54 PolarHBondContact O-N 2.97Å; K54-I57 PolarHBondContact O-N 3.43Å; K54-L58 HydrophobicContact CG-CD1 4.5Å; K54-L58 WeakPolarHBondContact O-CG 3.37Å; K54-L58 PolarHBondContact O-N 2.81Å; K54-L58 VanDerWaalsContact O-N 3.1Å
55	L	78.2	Confident	75.8	Confident	117 Å²	117	79.3 Å²	79.3	61%	0.613	39%	0.388	S	S	*	.	H	α-helix	trans	-65.4	-41.2	175.9	-171.7	72.4	0	0	0	111.3	Y51 I52 I57 L58 L59	Y51-L55 WeakPolarHBondContact O-CB 3.12Å; Y51-L55 PolarHBondContact O-N 2.94Å; I52-L55 PolarHBondContact O-N 2.68Å; L55-I57 VanDerWaalsContact C-N 3.35Å; L55-I57 PolarHBondContact O-N 3.28Å; L55-L58 PolarHBondContact O-N 2.8Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 PolarHBondContact O-N 3.28Å
56	L	77.2	Confident	76.6	Confident	33 Å²	33	77.8 Å²	77.8	17%	0.173	38%	0.384	C	S	.	.	H	α-helix	trans	-57	-48.6	174.4	-122.7	92.6	0	0	0	111.6	I52 Y53 L58 L59 E60 L159 F211	I52-L56 HydrophobicContact CG2-CD1 4.34Å; I52-L56 PolarHBondContact O-N 3.12Å; Y53-L56 WeakPolarHBondContact O-CB 3.27Å; Y53-L56 PolarHBondContact O-N 3.32Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 2.85Å; L56-L59 PolarHBondContact O-N 2.95Å; L56-L59 VanDerWaalsContact O-N 3.16Å; L56-E60 PolarHBondContact O-N 2.77Å; L56-L159 HydrophobicContact CD2-CD2 4.44Å; L56-F211 HydrophobicContact CD1-CE1 4.41Å; L56-F211 HydrophobicContact CD1-CE2 4.36Å; L56-F211 HydrophobicContact CD1-CZ 3.55Å; L56-F211 HydrophobicContact CD2-CE2 4.22Å; L56-F211 HydrophobicContact CD2-CZ 3.92Å; L56-F211 HydrophobicContact CG-CZ 3.93Å
57	I	77.4	Confident	77.5	Confident	32 Å²	32	72.7 Å²	72.7	16%	0.164	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-43.5	179.4	-72.8	165.1	0	0	0	110.8	Y53 K54 L55 L59 E60 I61 F156 L159	Y53-I57 WeakPolarHBondContact O-CG1 3.5Å; Y53-I57 PolarHBondContact O-N 3.48Å; K54-I57 PolarHBondContact O-N 3.43Å; L55-I57 VanDerWaalsContact C-N 3.35Å; L55-I57 PolarHBondContact O-N 3.28Å; I57-L59 VanDerWaalsContact C-N 3.34Å; I57-E60 PolarHBondContact O-N 3.19Å; I57-I61 HydrophobicContact CG2-CD1 3.95Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.35Å; I57-I61 PolarHBondContact O-N 3.28Å; I57-F156 HydrophobicContact CG2-CE1 4.02Å; I57-L159 HydrophobicContact CG1-CD1 3.96Å
58	L	79.2	Confident	78.1	Confident	99 Å²	99	71.3 Å²	71.3	52%	0.518	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-40.3	176.8	-76.8	164.1	0	0	0	111.9	K54 L55 L56 I61 L62	K54-L58 HydrophobicContact CG-CD1 4.5Å; K54-L58 WeakPolarHBondContact O-CG 3.37Å; K54-L58 PolarHBondContact O-N 2.81Å; K54-L58 VanDerWaalsContact O-N 3.1Å; L55-L58 PolarHBondContact O-N 2.8Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 2.85Å; L58-I61 PolarHBondContact O-N 3.11Å; L58-L62 WeakPolarHBondContact O-CB 3.04Å; L58-L62 PolarHBondContact O-N 3.06Å
59	L	78.6	Confident	78.7	Confident	92 Å²	92	72.2 Å²	72.2	48%	0.482	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-40.6	178.3	-163.2	127.1	0	0	0	111.5	L55 L56 I57 L62 T63	L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 PolarHBondContact O-N 3.28Å; L56-L59 PolarHBondContact O-N 2.95Å; L56-L59 VanDerWaalsContact O-N 3.16Å; I57-L59 VanDerWaalsContact C-N 3.34Å; L59-L62 PolarHBondContact O-N 2.97Å; L59-T63 HydrophobicContact CD2-CG2 4.45Å; L59-T63 WeakPolarHBondContact O-CG2 3.34Å; L59-T63 PolarHBondContact O-N 3.4Å; L59-T63 PolarHBondContact O-OG1 3.15Å
60	E	80.4	Confident	79.4	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-47.8	173.6	-74.4	-169.1	148.8	0	0	111.5	L56 I57 L62 T63 I64 R155 L159	L56-E60 PolarHBondContact O-N 2.77Å; I57-E60 PolarHBondContact O-N 3.19Å; E60-L62 VanDerWaalsContact C-N 3.25Å; E60-L62 PolarHBondContact O-N 3.24Å; E60-T63 WeakPolarHBondContact CA-OG1 3.2Å; E60-T63 PolarHBondContact O-N 2.8Å; E60-T63 VanDerWaalsContact O-N 3.15Å; E60-T63 PolarHBondContact O-OG1 3.12Å; E60-I64 VanDerWaalsContact O-CG1 3.29Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 3.06Å; E60-R155 WeakPolarHBondContact OE1-CD 3.29Å; E60-R155 IonicContact OE1-NH1 3.24Å; E60-R155 PolarHBondContact OE1-NH1 3.22Å; E60-L159 WeakPolarHBondContact OE2-CD1 2.87Å
61	I	80.4	Confident	79.9	Confident	84 Å²	84	64.2 Å²	64.2	43%	0.431	32%	0.318	S	S	.	.	H	α-helix	trans	-58.2	-40.9	176.8	-67.1	166.4	0	0	0	111.1	I57 L58 I64 S65 F156	I57-I61 HydrophobicContact CG2-CD1 3.95Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.35Å; I57-I61 PolarHBondContact O-N 3.28Å; L58-I61 PolarHBondContact O-N 3.11Å; I61-I64 PolarHBondContact O-N 3.46Å; I61-S65 PolarHBondContact O-N 2.86Å; I61-S65 PolarHBondContact O-OG 2.93Å; I61-F156 HydrophobicContact CD1-CZ 4.48Å; I61-F156 HydrophobicContact CG1-CZ 3.94Å
62	L	82.4	Confident	80.2	Confident	95 Å²	95	61.3 Å²	61.3	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-66.9	-39.8	177.8	-177.1	149.3	0	0	0	112.2	L58 L59 E60 I64 S65 I66	L58-L62 WeakPolarHBondContact O-CB 3.04Å; L58-L62 PolarHBondContact O-N 3.06Å; L59-L62 PolarHBondContact O-N 2.97Å; E60-L62 VanDerWaalsContact C-N 3.25Å; E60-L62 PolarHBondContact O-N 3.24Å; L62-I64 PolarHBondContact O-N 3.42Å; L62-S65 WeakPolarHBondContact CA-OG 3.22Å; L62-S65 PolarHBondContact O-N 2.71Å; L62-S65 PolarHBondContact O-OG 3.21Å; L62-I66 HydrophobicContact CD2-CD1 3.42Å; L62-I66 VanDerWaalsContact CD2-CD1 3.42Å; L62-I66 HydrophobicContact CD2-CG1 4.34Å; L62-I66 HydrophobicContact CG-CD1 4.13Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.43Å; L62-I66 PolarHBondContact O-N 3.23Å
63	T	79.9	Confident	80.4	Confident	8 Å²	8	61.1 Å²	61.1	5%	0.049	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-38.1	175.3	58.2	0	0	0	0	112.4	L59 E60 T67 V218	L59-T63 HydrophobicContact CD2-CG2 4.45Å; L59-T63 WeakPolarHBondContact O-CG2 3.34Å; L59-T63 PolarHBondContact O-N 3.4Å; L59-T63 PolarHBondContact O-OG1 3.15Å; E60-T63 WeakPolarHBondContact CA-OG1 3.2Å; E60-T63 PolarHBondContact O-N 2.8Å; E60-T63 VanDerWaalsContact O-N 3.15Å; E60-T63 PolarHBondContact O-OG1 3.12Å; T63-T67 WeakPolarHBondContact O-CB 3.37Å; T63-T67 VanDerWaalsContact O-CG2 3.3Å; T63-T67 WeakPolarHBondContact O-CG2 3.47Å; T63-T67 PolarHBondContact O-N 3.48Å; T63-T67 PolarHBondContact O-OG1 3.02Å; T63-V218 HydrophobicContact CG2-CG2 3.99Å
64	I	80.8	Confident	80.7	Confident	48 Å²	48	58 Å²	58	25%	0.246	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-45.2	175.5	-63.7	164.6	0	0	0	110.5	E60 I61 L62 T67 F68 Y152 F156	E60-I64 VanDerWaalsContact O-CG1 3.29Å; E60-I64 WeakPolarHBondContact O-CG1 3.41Å; E60-I64 PolarHBondContact O-N 3.06Å; I61-I64 PolarHBondContact O-N 3.46Å; L62-I64 PolarHBondContact O-N 3.42Å; I64-T67 WeakPolarHBondContact CA-OG1 3.41Å; I64-T67 PolarHBondContact O-OG1 3.05Å; I64-F68 VanDerWaalsContact O-CB 3.32Å; I64-F68 WeakPolarHBondContact O-CB 3.43Å; I64-F68 PolarHBondContact O-N 3.42Å; I64-Y152 HydrophobicContact CD1-CD1 3.59Å; I64-Y152 HydrophobicContact CD1-CD2 3.59Å; I64-Y152 HydrophobicContact CD1-CE1 3.91Å; I64-Y152 HydrophobicContact CD1-CE2 3.96Å; I64-Y152 HydrophobicContact CD1-CG 3.42Å; I64-Y152 VanDerWaalsContact CD1-CG 3.42Å; I64-Y152 HydrophobicContact CG1-CD1 3.98Å; I64-Y152 HydrophobicContact CG1-CD2 3.58Å; I64-Y152 HydrophobicContact CG1-CE1 3.78Å; I64-Y152 HydrophobicContact CG1-CE2 3.42Å; I64-Y152 VanDerWaalsContact CG1-CE2 3.42Å; I64-Y152 HydrophobicContact CG1-CG 3.89Å; I64-Y152 VanDerWaalsContact CG1-CZ 3.5Å; I64-F156 HydrophobicContact CD1-CE2 4.45Å
65	S	82.5	Confident	80.7	Confident	50 Å²	50	55.4 Å²	55.4	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-66.8	-41.1	-178.7	65.5	0	0	0	0	111.9	I61 L62 F68 L69	I61-S65 PolarHBondContact O-N 2.86Å; I61-S65 PolarHBondContact O-OG 2.93Å; L62-S65 WeakPolarHBondContact CA-OG 3.22Å; L62-S65 PolarHBondContact O-N 2.71Å; L62-S65 PolarHBondContact O-OG 3.21Å; S65-F68 PolarHBondContact O-N 2.63Å; S65-L69 VanDerWaalsContact O-CB 3.25Å; S65-L69 WeakPolarHBondContact O-CB 3.33Å; S65-L69 VanDerWaalsContact O-CG 3.25Å; S65-L69 WeakPolarHBondContact O-CG 3.39Å; S65-L69 PolarHBondContact O-N 3.04Å
66	I	83.3	Confident	80.6	Confident	78 Å²	78	51.8 Å²	51.8	40%	0.4	27%	0.274	S	S	.	.	H	α-helix	trans	-65	-47.8	177.4	-68.7	175.3	0	0	0	111.3	L62 F68 L69 S70	L62-I66 HydrophobicContact CD2-CD1 3.42Å; L62-I66 VanDerWaalsContact CD2-CD1 3.42Å; L62-I66 HydrophobicContact CD2-CG1 4.34Å; L62-I66 HydrophobicContact CG-CD1 4.13Å; L62-I66 VanDerWaalsContact O-CG1 3.31Å; L62-I66 WeakPolarHBondContact O-CG1 3.43Å; L62-I66 PolarHBondContact O-N 3.23Å; I66-F68 VanDerWaalsContact C-N 3.29Å; I66-F68 PolarHBondContact O-N 3.11Å; I66-L69 PolarHBondContact O-N 3.32Å; I66-S70 WeakPolarHBondContact O-CB 3.4Å; I66-S70 PolarHBondContact O-N 3.36Å; I66-S70 PolarHBondContact O-OG 3.48Å; I66-S70 VanDerWaalsContact O-OG 3.08Å
67	T	80.9	Confident	80.4	Confident	11 Å²	11	51.8 Å²	51.8	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-38	179.7	50	0	0	0	0	111.8	T63 I64 S70 P71 T221	T63-T67 WeakPolarHBondContact O-CB 3.37Å; T63-T67 VanDerWaalsContact O-CG2 3.3Å; T63-T67 WeakPolarHBondContact O-CG2 3.47Å; T63-T67 PolarHBondContact O-N 3.48Å; T63-T67 PolarHBondContact O-OG1 3.02Å; I64-T67 WeakPolarHBondContact CA-OG1 3.41Å; I64-T67 PolarHBondContact O-OG1 3.05Å; T67-S70 PolarHBondContact O-OG 3.15Å; T67-P71 WeakPolarHBondContact O-CD 2.95Å; T67-T221 HydrophobicContact CG2-CG2 3.69Å
68	F	82	Confident	79.8	Confident	77 Å²	77	50.9 Å²	50.9	34%	0.338	27%	0.27	S	S	.	.	H	α-helix	trans	-75.7	-39.3	178.4	-170.5	-97.8	0	0	0	113.8	I64 S65 I66 P71 F72 I141 F145	I64-F68 VanDerWaalsContact O-CB 3.32Å; I64-F68 WeakPolarHBondContact O-CB 3.43Å; I64-F68 PolarHBondContact O-N 3.42Å; S65-F68 PolarHBondContact O-N 2.63Å; I66-F68 VanDerWaalsContact C-N 3.29Å; I66-F68 PolarHBondContact O-N 3.11Å; F68-P71 WeakPolarHBondContact O-CD 2.97Å; F68-F72 HydrophobicContact CD1-CE2 4.39Å; F68-F72 AromaticContact CE1-CE2 3.94Å; F68-F72 HydrophobicContact CE1-CE2 3.94Å; F68-F72 HydrophobicContact CZ-CE2 4.13Å; F68-F72 WeakPolarHBondContact O-CD2 3.33Å; F68-I141 HydrophobicContact CD2-CG2 4.44Å; F68-I141 HydrophobicContact CE2-CG2 3.7Å; F68-I141 HydrophobicContact CZ-CG2 4.21Å; F68-F145 HydrophobicContact CE2-CB 4.36Å; F68-F145 HydrophobicContact CE2-CD2 4.24Å
69	L	83.6	Confident	79.1	Confident	93 Å²	93	51.4 Å²	51.4	49%	0.487	27%	0.273	S	S	.	.	H	α-helix	trans	-80	-26.8	-177.6	-69.7	172.3	0	0	0	113.2	S65 I66 F72 L73	S65-L69 VanDerWaalsContact O-CB 3.25Å; S65-L69 WeakPolarHBondContact O-CB 3.33Å; S65-L69 VanDerWaalsContact O-CG 3.25Å; S65-L69 WeakPolarHBondContact O-CG 3.39Å; S65-L69 PolarHBondContact O-N 3.04Å; I66-L69 PolarHBondContact O-N 3.32Å; L69-F72 PolarHBondContact O-N 2.94Å; L69-L73 WeakPolarHBondContact O-CG 3.27Å; L69-L73 PolarHBondContact O-N 3.33Å
70	S	84.5	Confident	78.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-55.1	-44.9	-177.3	56.7	0	0	0	0	116	I66 T67 F72 L73 I74 F306	I66-S70 WeakPolarHBondContact O-CB 3.4Å; I66-S70 PolarHBondContact O-N 3.36Å; I66-S70 PolarHBondContact O-OG 3.48Å; I66-S70 VanDerWaalsContact O-OG 3.08Å; T67-S70 PolarHBondContact O-OG 3.15Å; S70-F72 VanDerWaalsContact C-N 3.3Å; S70-F72 PolarHBondContact O-N 3.24Å; S70-L73 PolarHBondContact O-N 2.96Å; S70-I74 VanDerWaalsContact O-CG1 3.3Å; S70-I74 WeakPolarHBondContact O-CG1 3.46Å; S70-I74 PolarHBondContact O-N 3.29Å; S70-F306 VanDerWaalsContact OG-CE1 3.23Å; S70-F306 WeakPolarHBondContact OG-CE1 3.3Å; S70-F306 WeakPolarHBondContact OG-CZ 3.24Å
71	P	82.9	Confident	76.8	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.013	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-35.6	177.6	24.5	-34.5	0	0	0	112.3	T67 F68 L75 I141 F306 V307	T67-P71 WeakPolarHBondContact O-CD 2.95Å; F68-P71 WeakPolarHBondContact O-CD 2.97Å; P71-L75 WeakPolarHBondContact O-CG 3.36Å; P71-L75 PolarHBondContact O-N 3.06Å; P71-L75 VanDerWaalsContact O-N 3.17Å; P71-I141 HydrophobicContact CB-CD1 4.37Å; P71-I141 HydrophobicContact CG-CD1 4.18Å; P71-F306 HydrophobicContact CB-CD1 4.28Å; P71-F306 HydrophobicContact CG-CD1 4.45Å; P71-F306 HydrophobicContact CG-CE1 4.37Å; P71-V307 HydrophobicContact CB-CG2 4.2Å; P71-V307 HydrophobicContact CG-CG2 4.39Å
72	F	82.1	Confident	75.2	Confident	92 Å²	92	55.6 Å²	55.6	40%	0.404	30%	0.296	S	S	.	.	H	α-helix	trans	-68.6	-39	175.7	-63.7	-75	0	0	0	112	F68 L69 S70 L75 A76 I141	F68-F72 HydrophobicContact CD1-CE2 4.39Å; F68-F72 AromaticContact CE1-CE2 3.94Å; F68-F72 HydrophobicContact CE1-CE2 3.94Å; F68-F72 HydrophobicContact CZ-CE2 4.13Å; F68-F72 WeakPolarHBondContact O-CD2 3.33Å; L69-F72 PolarHBondContact O-N 2.94Å; S70-F72 VanDerWaalsContact C-N 3.3Å; S70-F72 PolarHBondContact O-N 3.24Å; F72-L75 PolarHBondContact O-N 3.4Å; F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 3.19Å; F72-I141 HydrophobicContact CE1-CD1 4.44Å; F72-I141 HydrophobicContact CE2-CD1 4.25Å; F72-I141 HydrophobicContact CE2-CG2 4.44Å; F72-I141 HydrophobicContact CZ-CD1 3.95Å; F72-I141 HydrophobicContact CZ-CG2 4.35Å
73	L	82.3	Confident	73.5	Confident	89 Å²	89	54 Å²	54	47%	0.466	29%	0.293	S	S	.	.	H	α-helix	trans	-66.9	-42.1	176.8	-68.7	173.9	0	0	0	111.9	L69 S70 L75 A76 L77 W225	L69-L73 WeakPolarHBondContact O-CG 3.27Å; L69-L73 PolarHBondContact O-N 3.33Å; S70-L73 PolarHBondContact O-N 2.96Å; L73-L75 VanDerWaalsContact C-N 3.25Å; L73-L75 PolarHBondContact O-N 3.01Å; L73-A76 PolarHBondContact O-N 3Å; L73-L77 WeakPolarHBondContact O-CB 3.31Å; L73-L77 VanDerWaalsContact O-CD1 3.28Å; L73-L77 WeakPolarHBondContact O-CD1 3.42Å; L73-L77 WeakPolarHBondContact O-CG 3.31Å; L73-L77 PolarHBondContact O-N 3.36Å; L73-W225 HydrophobicContact CB-CH2 3.76Å; L73-W225 HydrophobicContact CB-CZ2 4.05Å; L73-W225 HydrophobicContact CD1-CH2 4.35Å; L73-W225 HydrophobicContact CD1-CZ2 4.18Å
74	I	80.2	Confident	71.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.2	-39.5	175.1	-70.4	166.7	0	0	0	110.8	S70 P78 W225 F228 A299	S70-I74 VanDerWaalsContact O-CG1 3.3Å; S70-I74 WeakPolarHBondContact O-CG1 3.46Å; S70-I74 PolarHBondContact O-N 3.29Å; I74-P78 WeakPolarHBondContact O-CD 3.48Å; I74-W225 HydrophobicContact CG1-CH2 4.35Å; I74-W225 HydrophobicContact CG1-CZ2 4.46Å; I74-F228 HydrophobicContact CG1-CG 4.49Å; I74-F228 HydrophobicContact CG2-CD2 3.77Å; I74-F228 HydrophobicContact CG2-CE2 3.84Å; I74-F228 HydrophobicContact CG2-CG 4.44Å; I74-A299 HydrophobicContact CG2-CB 4.42Å
75	L	77.2	Confident	69.4	Low	52 Å²	52	69.8 Å²	69.8	27%	0.272	35%	0.349	S	S	.	.	H	α-helix	trans	-75.9	-31.9	176.5	-74	174.4	0	0	0	114.3	P71 F72 L73 P78 L137 L300	P71-L75 WeakPolarHBondContact O-CG 3.36Å; P71-L75 PolarHBondContact O-N 3.06Å; P71-L75 VanDerWaalsContact O-N 3.17Å; F72-L75 PolarHBondContact O-N 3.4Å; L73-L75 VanDerWaalsContact C-N 3.25Å; L73-L75 PolarHBondContact O-N 3.01Å; L75-P78 WeakPolarHBondContact O-CD 3.4Å; L75-L137 HydrophobicContact CD1-CD2 3.47Å; L75-L137 VanDerWaalsContact CD1-CD2 3.47Å; L75-L300 HydrophobicContact CD2-CB 4.21Å
76	A	76.1	Confident	67.2	Low	42 Å²	42	72.8 Å²	72.8	35%	0.347	36%	0.355	S	S	.	.	H	α-helix	trans	-78.8	-33	-178.3	0	0	0	0	0	112.7	F72 L73 N79 I80	F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 3.19Å; L73-A76 PolarHBondContact O-N 3Å; A76-N79 WeakPolarHBondContact O-CB 3.44Å; A76-N79 PolarHBondContact O-N 3.46Å; A76-I80 PolarHBondContact O-N 3.45Å
77	L	71.8	Confident	64.9	Low	33 Å²	33	73.9 Å²	73.9	17%	0.173	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-56.7	-41.2	-174.8	-82.3	158.6	0	0	0	114.6	L73 N79 I80 W225 F228	L73-L77 WeakPolarHBondContact O-CB 3.31Å; L73-L77 VanDerWaalsContact O-CD1 3.28Å; L73-L77 WeakPolarHBondContact O-CD1 3.42Å; L73-L77 WeakPolarHBondContact O-CG 3.31Å; L73-L77 PolarHBondContact O-N 3.36Å; L77-N79 PolarHBondContact O-N 2.9Å; L77-I80 PolarHBondContact O-N 3.1Å; L77-I80 VanDerWaalsContact O-N 3.16Å; L77-W225 HydrophobicContact CD1-CH2 3.84Å; L77-W225 HydrophobicContact CD1-CZ3 3.62Å; L77-F228 HydrophobicContact CB-CE1 4.02Å; L77-F228 HydrophobicContact CB-CZ 3.88Å; L77-F228 HydrophobicContact CD1-CD1 4.42Å; L77-F228 HydrophobicContact CD1-CE1 3.64Å; L77-F228 HydrophobicContact CD1-CZ 4.24Å; L77-F228 HydrophobicContact CG-CE1 4.42Å
78	P	65.1	Low	62.6	Low	12 Å²	12	80.7 Å²	80.7	8%	0.078	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-60.7	-25	174.6	-25.2	34.3	0	0	0	114.3	I74 L75 L292 L295 K296 A299	I74-P78 WeakPolarHBondContact O-CD 3.48Å; L75-P78 WeakPolarHBondContact O-CD 3.4Å; P78-L292 HydrophobicContact CB-CD1 4.48Å; P78-L292 WeakPolarHBondContact O-CD1 3.47Å; P78-L295 HydrophobicContact CB-CD2 4.14Å; P78-L295 HydrophobicContact CB-CG 4.35Å; P78-L295 HydrophobicContact CG-CD2 4.46Å; P78-L295 HydrophobicContact CG-CG 4.35Å; P78-K296 HydrophobicContact CB-CG 4.32Å; P78-A299 HydrophobicContact CG-CB 3.97Å
79	N	64.9	Low	60.2	Low	110 Å²	110	83.1 Å²	83.1	59%	0.588	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-85.4	-15.9	179.6	-65.8	-30.6	0	0	0	113	A76 L77 H81 K296	A76-N79 WeakPolarHBondContact O-CB 3.44Å; A76-N79 PolarHBondContact O-N 3.46Å; L77-N79 PolarHBondContact O-N 2.9Å; N79-H81 PolarHBondContact O-N 3.36Å; N79-K296 VanDerWaalsContact OD1-CE 3.24Å; N79-K296 WeakPolarHBondContact OD1-CE 3.46Å
80	I	62.8	Low	57.6	Low	74 Å²	74	84 Å²	84	38%	0.379	44%	0.435	S	S	.	.	S	Bend	trans	-81.6	110.8	178.4	-59.5	171	0	0	0	107.5	A76 L77 W84	A76-I80 PolarHBondContact O-N 3.45Å; L77-I80 PolarHBondContact O-N 3.1Å; L77-I80 VanDerWaalsContact O-N 3.16Å; I80-W84 HydrophobicContact CG2-CB 4.4Å
81	H	46.9	Very low	54.8	Low	131 Å²	131	89.4 Å²	89.4	61%	0.606	47%	0.473	S	S	*	.			trans	-48.5	130.5	179	-171.3	-89.6	0	0	0	110.8	N79 S83 W84	N79-H81 PolarHBondContact O-N 3.36Å; H81-S83 PolarHBondContact CE1-OG 3.39Å; H81-S83 WeakPolarHBondContact ND1-CB 3.41Å; H81-S83 PolarHBondContact ND1-N 3.14Å; H81-S83 PolarHBondContact ND1-OG 3.02Å; H81-S83 PolarHBondContact O-N 3.47Å; H81-W84 PolarHBondContact O-N 2.91Å
82	P	48.3	Very low	52.3	Low	70 Å²	70	94.3 Å²	94.3	46%	0.455	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.5	-170.7	19.1	-30.6	0	0	0	114.8
83	S	45.6	Very low	49.6	Very low	60 Å²	60	94.6 Å²	94.6	42%	0.42	53%	0.527	S	S	.	.	H	α-helix	trans	-72	-24.8	178.2	67.8	0	0	0	0	114.9	H81 W85 S87	H81-S83 PolarHBondContact CE1-OG 3.39Å; H81-S83 WeakPolarHBondContact ND1-CB 3.41Å; H81-S83 PolarHBondContact ND1-N 3.14Å; H81-S83 PolarHBondContact ND1-OG 3.02Å; H81-S83 PolarHBondContact O-N 3.47Å; S83-W85 VanDerWaalsContact C-N 3.32Å; S83-W85 PolarHBondContact O-N 3.02Å; S83-S87 PolarHBondContact O-N 3.36Å
84	W	39.7	Very low	47	Very low	206 Å²	206	94.3 Å²	94.3	78%	0.78	54%	0.537	S	S	*	.	H	α-helix	trans	-73.3	-20.3	-174.7	-94.9	38.4	0	0	0	114.3	I80 H81	I80-W84 HydrophobicContact CG2-CB 4.4Å; H81-W84 PolarHBondContact O-N 2.91Å
85	W	35.2	Very low	44.3	Very low	182 Å²	182	100.1 Å²	100.1	69%	0.689	57%	0.573	S	S	*	*	H	α-helix	trans	-97	-19.5	179.7	-97.1	54.2	0	0	0	114.4	S83	S83-W85 VanDerWaalsContact C-N 3.32Å; S83-W85 PolarHBondContact O-N 3.02Å
86	F	36.5	Very low	41.7	Very low	113 Å²	113	100.1 Å²	100.1	50%	0.496	58%	0.578	S	S	.	*	H	α-helix	trans	-115.8	2.7	-177.2	-83.3	-81	0	0	0	115.3	L88 L89	F86-L88 PolarHBondContact O-N 2.92Å; F86-L88 VanDerWaalsContact O-N 3.07Å; F86-L89 HydrophobicContact CD1-CB 4.12Å; F86-L89 CarbonylContact O-C 3.35Å; F86-L89 PolarHBondContact O-N 2.82Å
87	S	33.6	Very low	39.5	Very low	102 Å²	102	103.9 Å²	103.9	71%	0.713	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-6.6	165.7	57.7	0	0	0	0	113.8	S83	S83-S87 PolarHBondContact O-N 3.36Å
88	L	33.7	Very low	37.5	Very low	154 Å²	154	107 Å²	107	81%	0.806	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-18.6	168.3	-98.7	115.5	0	0	0	114.2	F86	F86-L88 PolarHBondContact O-N 2.92Å; F86-L88 VanDerWaalsContact O-N 3.07Å
89	L	31.7	Very low	35.6	Very low	127 Å²	127	111.2 Å²	111.2	67%	0.665	65%	0.648	S	S	*	*	S	Bend	trans	-138.2	81	-176.4	-100.1	86.9	0	0	0	109.8	F86	F86-L89 HydrophobicContact CD1-CB 4.12Å; F86-L89 CarbonylContact O-C 3.35Å; F86-L89 PolarHBondContact O-N 2.82Å
90	S	28	Very low	33.9	Very low	112 Å²	112	113.6 Å²	113.6	78%	0.783	66%	0.659	S	S	*	*			trans	168.4	118.7	130.6	-167.9	0	0	0	0	110.3
91	S	25.9	Very low	32.2	Very low	114 Å²	114	115.3 Å²	115.3	80%	0.797	68%	0.678	S	S	*	*			trans	-97.3	121.1	168.9	52.3	0	0	0	0	109.5
92	S	30.7	Very low	31.4	Very low	105 Å²	105	114.5 Å²	114.5	73%	0.734	68%	0.684	S	S	*	*			trans	173.7	116	152.5	34.6	0	0	0	0	106.9
93	A	26	Very low	30.4	Very low	98 Å²	98	122.2 Å²	122.2	81%	0.81	70%	0.704	S	S	*	*				81.3	119.5	61.4	0	0	0	0	0	113.6
94	A	26.6	Very low	29.5	Very low	84 Å²	84	128.6 Å²	128.6	69%	0.694	72%	0.724	S	S	*	*			trans	103.8	115.4	143.8	0	0	0	0	0	119.9
95	T	24	Very low	28.9	Very low	121 Å²	121	125.7 Å²	125.7	74%	0.742	73%	0.729	S	S	*	*				54.4	111	128.6	51.8	0	0	0	0	119.6
96	S	22.6	Very low	28.7	Very low	53 Å²	53	125.5 Å²	125.5	37%	0.371	74%	0.738	S	S	.	*				88.1	133.6	56.4	72.3	0	0	0	0	115.7
97	T	29.2	Very low	28.3	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	75%	0.752	S	S	*	*			trans	99.3	154.8	155.2	78	0	0	0	0	118
98	P	30	Very low	28.5	Very low	99 Å²	99	129.3 Å²	129.3	64%	0.643	75%	0.749	S	S	*	*				-143.4	-156.4	-101	34.5	-7.1	0	0	0	113.6
99	S	26.4	Very low	28.6	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	74%	0.74	S	S	*	*			trans	102.5	103.9	163.6	80.5	0	0	0	0	115.7
100	I	28	Very low	28.9	Very low	160 Å²	160	125.6 Å²	125.6	82%	0.821	75%	0.746	S	S	*	*				90.4	110.1	79	-72.8	158.1	0	0	0	113
101	S	27.6	Very low	29.4	Very low	109 Å²	109	127.4 Å²	127.4	76%	0.762	74%	0.74	S	S	*	*				144.5	150.1	119.9	62.8	0	0	0	0	114.4
102	P	30.6	Very low	30.2	Very low	115 Å²	115	127 Å²	127	75%	0.747	73%	0.728	S	S	*	*			trans	-112.5	159.6	-154.2	38.9	-27	0	0	0	113.5
103	R	26.5	Very low	30.6	Very low	232 Å²	232	127.8 Å²	127.8	88%	0.875	72%	0.723	S	S	*	*			trans	-179.8	143.5	140.1	-106.9	170	-172	-169.3	3.5	116.2
104	K	28.3	Very low	31.3	Very low	193 Å²	193	126 Å²	126	84%	0.839	71%	0.708	S	S	*	*			trans	75.5	98.4	147.8	-81.8	-176.2	173.5	-176.6	0	119.9
105	V	27	Very low	32.1	Very low	145 Å²	145	126.8 Å²	126.8	88%	0.879	70%	0.701	S	S	*	*			trans	-70	133.8	161	176.1	0	0	0	0	110.2
106	M	29.6	Very low	33.3	Very low	179 Å²	179	122.2 Å²	122.2	88%	0.882	67%	0.674	S	S	*	*			trans	-133.1	137.9	169.3	-150.3	171.9	-178	0	0	109.8
107	H	27.6	Very low	34.4	Very low	172 Å²	172	123.2 Å²	123.2	80%	0.796	68%	0.678	S	S	*	*			trans	-65.4	125.2	-168.5	-75.4	-104	0	0	0	114.2
108	I	38	Very low	35.3	Very low	123 Å²	123	122.3 Å²	122.3	63%	0.631	67%	0.668	S	S	*	*			trans	-132.7	81.3	160	-55.8	176.5	0	0	0	107.8	K111	I108-K111 HydrophobicContact CG2-CB 3.85Å
109	S	36.7	Very low	36.3	Very low	91 Å²	91	120.2 Å²	120.2	64%	0.636	66%	0.655	S	S	*	*			trans	-102.5	-10.4	174.2	56.3	0	0	0	0	114
110	S	38.3	Very low	37.3	Very low	112 Å²	112	123.4 Å²	123.4	78%	0.783	65%	0.652	S	S	*	*	S	Bend	trans	-88.1	-18.8	-178.8	59.6	0	0	0	0	114.7
111	K	37.7	Very low	38.4	Very low	149 Å²	149	124.2 Å²	124.2	65%	0.648	64%	0.644	S	S	*	*	S	Bend	trans	-83.6	-12.1	178.1	-121	174.2	-176.8	177.8	0	114.1	I108	I108-K111 HydrophobicContact CG2-CB 3.85Å
112	I	43.1	Very low	39.6	Very low	106 Å²	106	123.8 Å²	123.8	54%	0.544	63%	0.632	S	S	.	*	H	α-helix	trans	-76.1	-34.1	-173	-60.6	175.7	0	0	0	111.8	S116	I112-S116 VanDerWaalsContact O-CB 3.28Å; I112-S116 WeakPolarHBondContact O-CB 3.37Å; I112-S116 PolarHBondContact O-N 2.95Å; I112-S116 PolarHBondContact O-OG 3.48Å
113	N	38.6	Very low	41.3	Very low	121 Å²	121	122.7 Å²	122.7	65%	0.647	62%	0.62	S	S	*	*	H	α-helix	trans	-76.4	-36.9	-176.3	-88.6	-7.8	0	0	0	114.5	S116 V117	N113-S116 PolarHBondContact O-N 2.94Å; N113-S116 PolarHBondContact O-OG 3.2Å; N113-S116 VanDerWaalsContact O-OG 3.14Å; N113-V117 PolarHBondContact O-N 3.38Å
114	A	42.1	Very low	43.5	Very low	60 Å²	60	120.7 Å²	120.7	50%	0.496	61%	0.612	S	S	.	*	H	α-helix	trans	-68.2	-40.9	175.4	0	0	0	0	0	111.2	I118	A114-I118 WeakPolarHBondContact O-CD1 3.36Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.46Å; A114-I118 PolarHBondContact O-N 2.97Å
115	N	43.2	Very low	45.8	Very low	101 Å²	101	119.8 Å²	119.8	54%	0.54	60%	0.603	S	S	.	*	H	α-helix	trans	-67.7	-33.9	176.3	-70.9	-3.1	0	0	0	112.2	S119	N115-S119 WeakPolarHBondContact O-CB 3.24Å; N115-S119 PolarHBondContact O-N 3.49Å; N115-S119 PolarHBondContact O-OG 2.88Å
116	S	49.2	Very low	47.9	Very low	26 Å²	26	116 Å²	116	18%	0.182	58%	0.581	C	S	.	*	H	α-helix	trans	-74.5	-27	-178.8	76.3	0	0	0	0	114.6	I112 N113 S119 R120	I112-S116 VanDerWaalsContact O-CB 3.28Å; I112-S116 WeakPolarHBondContact O-CB 3.37Å; I112-S116 PolarHBondContact O-N 2.95Å; I112-S116 PolarHBondContact O-OG 3.48Å; N113-S116 PolarHBondContact O-N 2.94Å; N113-S116 PolarHBondContact O-OG 3.2Å; N113-S116 VanDerWaalsContact O-OG 3.14Å; S116-S119 WeakPolarHBondContact CA-OG 3.38Å; S116-S119 PolarHBondContact O-OG 3.19Å; S116-S119 VanDerWaalsContact O-OG 3.12Å; S116-R120 WeakPolarHBondContact O-CB 3.23Å; S116-R120 WeakPolarHBondContact O-CG 3.26Å; S116-R120 PolarHBondContact O-N 3.4Å; S116-R120 VanDerWaalsContact O-N 3.14Å; S116-R120 PolarHBondContact O-NE 3.44Å
117	V	45.5	Very low	50.3	Low	73 Å²	73	112.8 Å²	112.8	44%	0.442	56%	0.564	S	S	.	*	H	α-helix	trans	-79.6	-40	173.7	176.9	0	0	0	0	110.6	N113 R121	N113-V117 PolarHBondContact O-N 3.38Å; V117-R121 PolarHBondContact O-N 3.23Å
118	I	48.2	Very low	53	Low	103 Å²	103	108.5 Å²	108.5	53%	0.528	55%	0.549	S	S	.	.	H	α-helix	trans	-67.1	-41.9	175.1	-65	168.7	0	0	0	110.3	A114 R121 M122	A114-I118 WeakPolarHBondContact O-CD1 3.36Å; A114-I118 VanDerWaalsContact O-CG1 3.3Å; A114-I118 WeakPolarHBondContact O-CG1 3.46Å; A114-I118 PolarHBondContact O-N 2.97Å; I118-R121 PolarHBondContact O-N 2.99Å; I118-M122 WeakPolarHBondContact O-CB 3.41Å; I118-M122 WeakPolarHBondContact O-CG 3.42Å; I118-M122 PolarHBondContact O-N 3.42Å
119	S	50.6	Low	55.1	Low	54 Å²	54	107.3 Å²	107.3	38%	0.378	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-49.5	175.2	74.2	0	0	0	0	110.9	N115 S116 R121 M122 D123	N115-S119 WeakPolarHBondContact O-CB 3.24Å; N115-S119 PolarHBondContact O-N 3.49Å; N115-S119 PolarHBondContact O-OG 2.88Å; S116-S119 WeakPolarHBondContact CA-OG 3.38Å; S116-S119 PolarHBondContact O-OG 3.19Å; S116-S119 VanDerWaalsContact O-OG 3.12Å; S119-R121 VanDerWaalsContact C-N 3.29Å; S119-R121 PolarHBondContact O-N 2.77Å; S119-M122 CarbonylContact O-C 3.58Å; S119-M122 WeakPolarHBondContact O-CA 3.35Å; S119-M122 PolarHBondContact O-N 2.91Å; S119-D123 PolarHBondContact O-N 2.92Å
120	R	48.2	Very low	57.3	Low	167 Å²	167	105.4 Å²	105.4	63%	0.63	52%	0.517	S	S	*	.	H	α-helix	trans	-60.3	-35.4	177.8	-84.4	-170.2	-90.8	-175.4	-10.2	113.7	S116 R124	S116-R120 WeakPolarHBondContact O-CB 3.23Å; S116-R120 WeakPolarHBondContact O-CG 3.26Å; S116-R120 PolarHBondContact O-N 3.4Å; S116-R120 VanDerWaalsContact O-N 3.14Å; S116-R120 PolarHBondContact O-NE 3.44Å; R120-R124 PolarHBondContact O-N 2.89Å
121	R	50.9	Low	59.5	Low	177 Å²	177	105.2 Å²	105.2	67%	0.668	50%	0.503	S	S	*	.	H	α-helix	trans	-70.8	-37.3	174.1	-81.7	-174.5	-177.5	166.1	1.6	112.3	V117 I118 S119 R125	V117-R121 PolarHBondContact O-N 3.23Å; I118-R121 PolarHBondContact O-N 2.99Å; S119-R121 VanDerWaalsContact C-N 3.29Å; S119-R121 PolarHBondContact O-N 2.77Å; R121-R125 PolarHBondContact O-N 3.43Å
122	M	52.9	Low	62	Low	101 Å²	101	102.3 Å²	102.3	50%	0.498	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-43.2	174.6	-78.1	-66.6	172.2	0	0	111.1	I118 S119 R124 R125 T126	I118-M122 WeakPolarHBondContact O-CB 3.41Å; I118-M122 WeakPolarHBondContact O-CG 3.42Å; I118-M122 PolarHBondContact O-N 3.42Å; S119-M122 CarbonylContact O-C 3.58Å; S119-M122 WeakPolarHBondContact O-CA 3.35Å; S119-M122 PolarHBondContact O-N 2.91Å; M122-R124 PolarHBondContact O-N 3.42Å; M122-R125 PolarHBondContact O-N 3.3Å; M122-R125 VanDerWaalsContact O-N 3.15Å; M122-T126 PolarHBondContact O-N 3.42Å; M122-T126 PolarHBondContact O-OG1 3.4Å
123	D	65.1	Low	64.1	Low	92 Å²	92	99.3 Å²	99.3	49%	0.492	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-46.9	179.4	-66.8	-25.5	0	0	0	111.7	S119 R125 T126 E127	S119-D123 PolarHBondContact O-N 2.92Å; D123-R125 PolarHBondContact O-N 3.39Å; D123-T126 WeakPolarHBondContact CA-OG1 3.44Å; D123-T126 PolarHBondContact O-N 2.89Å; D123-T126 PolarHBondContact O-OG1 3.36Å; D123-E127 WeakPolarHBondContact O-CB 3.45Å; D123-E127 PolarHBondContact O-N 3.02Å
124	R	72	Confident	66.3	Low	189 Å²	189	97.6 Å²	97.6	71%	0.713	47%	0.471	S	S	*	.	H	α-helix	trans	-62.9	-37.8	176.4	-76.5	-167.7	-171.9	169.5	1.9	113.4	R120 M122 T126 E127 V128	R120-R124 PolarHBondContact O-N 2.89Å; M122-R124 PolarHBondContact O-N 3.42Å; R124-T126 VanDerWaalsContact C-N 3.34Å; R124-E127 PolarHBondContact O-N 2.92Å; R124-V128 WeakPolarHBondContact O-CG2 3.43Å; R124-V128 PolarHBondContact O-N 3.27Å
125	R	77	Confident	68.6	Low	174 Å²	174	100 Å²	100	66%	0.657	47%	0.474	S	S	*	.	H	α-helix	trans	-66.4	-40.5	176.7	-75.1	-178	-173.6	175.4	1.1	111	R121 M122 D123 Y129	R121-R125 PolarHBondContact O-N 3.43Å; M122-R125 PolarHBondContact O-N 3.3Å; M122-R125 VanDerWaalsContact O-N 3.15Å; D123-R125 PolarHBondContact O-N 3.39Å; R125-Y129 WeakPolarHBondContact O-CB 3.17Å; R125-Y129 PolarHBondContact O-N 3.05Å
126	T	72.3	Confident	70.8	Confident	66 Å²	66	97.8 Å²	97.8	41%	0.405	46%	0.461	S	S	.	.	H	α-helix	trans	-65.9	-42.1	175.8	52.8	0	0	0	0	111.4	M122 D123 R124 Y129 Y130	M122-T126 PolarHBondContact O-N 3.42Å; M122-T126 PolarHBondContact O-OG1 3.4Å; D123-T126 WeakPolarHBondContact CA-OG1 3.44Å; D123-T126 PolarHBondContact O-N 2.89Å; D123-T126 PolarHBondContact O-OG1 3.36Å; R124-T126 VanDerWaalsContact C-N 3.34Å; T126-Y129 WeakPolarHBondContact O-CB 3.37Å; T126-Y129 PolarHBondContact O-N 3.07Å; T126-Y130 WeakPolarHBondContact O-CD2 3.29Å; T126-Y130 PolarHBondContact O-N 2.98Å
127	E	79	Confident	72.7	Confident	112 Å²	112	96.8 Å²	96.8	52%	0.523	45%	0.453	S	S	.	.	H	α-helix	trans	-59.3	-50.5	177.6	-172.8	174.3	-157.8	0	0	111.8	D123 R124 Y129 Y130 E131	D123-E127 WeakPolarHBondContact O-CB 3.45Å; D123-E127 PolarHBondContact O-N 3.02Å; R124-E127 PolarHBondContact O-N 2.92Å; E127-Y129 VanDerWaalsContact C-N 3.3Å; E127-Y129 PolarHBondContact O-N 2.88Å; E127-Y130 WeakPolarHBondContact O-CB 3.36Å; E127-Y130 PolarHBondContact O-N 2.61Å; E127-Y130 VanDerWaalsContact O-N 3.14Å; E127-E131 WeakPolarHBondContact O-CG 3.5Å; E127-E131 PolarHBondContact O-N 2.91Å
128	V	83.8	Confident	74.8	Confident	81 Å²	81	96.8 Å²	96.8	49%	0.491	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-38.1	176.5	175.8	0	0	0	0	111.5	R124 E131 V132	R124-V128 WeakPolarHBondContact O-CG2 3.43Å; R124-V128 PolarHBondContact O-N 3.27Å; V128-E131 PolarHBondContact O-N 3.43Å; V128-V132 HydrophobicContact CG1-CG2 4.34Å; V128-V132 VanDerWaalsContact O-CG2 3.32Å; V128-V132 WeakPolarHBondContact O-CG2 3.49Å; V128-V132 PolarHBondContact O-N 3.36Å
129	Y	82.7	Confident	76.8	Confident	98 Å²	98	95.4 Å²	95.4	38%	0.384	45%	0.452	S	S	.	.	H	α-helix	trans	-60.1	-46.1	174.5	177.1	-94.6	0	0	0	111.5	R125 T126 E127 K133 D301	R125-Y129 WeakPolarHBondContact O-CB 3.17Å; R125-Y129 PolarHBondContact O-N 3.05Å; T126-Y129 WeakPolarHBondContact O-CB 3.37Å; T126-Y129 PolarHBondContact O-N 3.07Å; E127-Y129 VanDerWaalsContact C-N 3.3Å; E127-Y129 PolarHBondContact O-N 2.88Å; Y129-K133 HydrophobicContact CD1-CG 4.32Å; Y129-K133 HydrophobicContact CD2-CG 4.47Å; Y129-K133 HydrophobicContact CE1-CG 3.92Å; Y129-K133 HydrophobicContact CE2-CG 4.09Å; Y129-K133 VanDerWaalsContact O-CB 3.31Å; Y129-K133 WeakPolarHBondContact O-CB 3.32Å; Y129-K133 VanDerWaalsContact O-CG 3.31Å; Y129-K133 WeakPolarHBondContact O-CG 3.49Å; Y129-K133 PolarHBondContact O-N 3.36Å; Y129-K133 WeakPolarHBondContact OH-CE 3.3Å; Y129-D301 PolarHBondContact OH-OD1 2.86Å
130	Y	82.6	Confident	78.8	Confident	52 Å²	52	94.5 Å²	94.5	20%	0.204	44%	0.441	C	S	.	.	H	α-helix	trans	-62	-45.1	176.3	-76.5	-69.2	0	0	0	111.9	T126 E127 K133 I134 S293 T297 L300	T126-Y130 WeakPolarHBondContact O-CD2 3.29Å; T126-Y130 PolarHBondContact O-N 2.98Å; E127-Y130 WeakPolarHBondContact O-CB 3.36Å; E127-Y130 PolarHBondContact O-N 2.61Å; E127-Y130 VanDerWaalsContact O-N 3.14Å; Y130-K133 PolarHBondContact O-N 2.67Å; Y130-I134 WeakPolarHBondContact O-CB 3.29Å; Y130-I134 WeakPolarHBondContact O-CD1 3.32Å; Y130-I134 WeakPolarHBondContact O-CG1 3.5Å; Y130-I134 PolarHBondContact O-N 2.85Å; Y130-S293 PolarHBondContact OH-O 2.72Å; Y130-T297 HydrophobicContact CE1-CG2 4.17Å; Y130-T297 WeakPolarHBondContact OH-CG2 3.29Å; Y130-T297 PolarHBondContact OH-N 3.23Å; Y130-L300 HydrophobicContact CD1-CD1 3.78Å; Y130-L300 HydrophobicContact CE1-CD1 4.37Å
131	E	85.9	Confident	80.7	Confident	107 Å²	107	87.2 Å²	87.2	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-59.6	-49.5	178.9	-71.9	-177.6	161.6	0	0	112	E127 V128 K133 I134 I135	E127-E131 WeakPolarHBondContact O-CG 3.5Å; E127-E131 PolarHBondContact O-N 2.91Å; V128-E131 PolarHBondContact O-N 3.43Å; E131-K133 VanDerWaalsContact C-N 3.33Å; E131-K133 PolarHBondContact O-N 3.14Å; E131-I134 PolarHBondContact O-N 3.26Å; E131-I135 VanDerWaalsContact O-CG1 3.29Å; E131-I135 WeakPolarHBondContact O-CG1 3.43Å; E131-I135 PolarHBondContact O-N 3.2Å
132	V	88.4	Confident	82.6	Confident	88 Å²	88	84.8 Å²	84.8	53%	0.533	41%	0.409	S	S	.	.	H	α-helix	trans	-62.2	-43.2	179.4	173.4	0	0	0	0	110.8	V128 I135 E136	V128-V132 HydrophobicContact CG1-CG2 4.34Å; V128-V132 VanDerWaalsContact O-CG2 3.32Å; V128-V132 WeakPolarHBondContact O-CG2 3.49Å; V128-V132 PolarHBondContact O-N 3.36Å; V132-I135 PolarHBondContact O-N 3.32Å; V132-E136 WeakPolarHBondContact O-CB 3.45Å; V132-E136 PolarHBondContact O-N 3.03Å
133	K	87.2	Confident	84.4	Confident	44 Å²	44	84 Å²	84	19%	0.191	41%	0.407	C	S	.	.	H	α-helix	trans	-68.3	-36.7	179.7	-78.9	-76.5	170.5	-162.9	0	113.3	Y129 Y130 E131 E136 L137 L300 V304	Y129-K133 HydrophobicContact CD1-CG 4.32Å; Y129-K133 HydrophobicContact CD2-CG 4.47Å; Y129-K133 HydrophobicContact CE1-CG 3.92Å; Y129-K133 HydrophobicContact CE2-CG 4.09Å; Y129-K133 VanDerWaalsContact O-CB 3.31Å; Y129-K133 WeakPolarHBondContact O-CB 3.32Å; Y129-K133 VanDerWaalsContact O-CG 3.31Å; Y129-K133 WeakPolarHBondContact O-CG 3.49Å; Y129-K133 PolarHBondContact O-N 3.36Å; Y129-K133 WeakPolarHBondContact OH-CE 3.3Å; Y130-K133 PolarHBondContact O-N 2.67Å; E131-K133 VanDerWaalsContact C-N 3.33Å; E131-K133 PolarHBondContact O-N 3.14Å; K133-E136 WeakPolarHBondContact CD-OE2 3.24Å; K133-E136 IonicContact NZ-OE1 3.98Å; K133-E136 IonicContact NZ-OE2 2.82Å; K133-E136 PolarHBondContact NZ-OE2 2.9Å; K133-E136 WeakPolarHBondContact O-CB 3.22Å; K133-E136 PolarHBondContact O-N 3.43Å; K133-L137 WeakPolarHBondContact O-CB 3.37Å; K133-L137 PolarHBondContact O-N 3.43Å; K133-L300 HydrophobicContact CB-CD1 3.86Å; K133-L300 HydrophobicContact CB-CD2 3.4Å; K133-L300 VanDerWaalsContact CB-CD2 3.4Å; K133-L300 HydrophobicContact CB-CG 4.2Å; K133-L300 HydrophobicContact CD-CD2 3.85Å; K133-L300 HydrophobicContact CG-CD2 3.73Å; K133-V304 HydrophobicContact CD-CG2 4.48Å
134	I	86.5	Confident	85.5	Confident	84 Å²	84	80.1 Å²	80.1	43%	0.431	39%	0.386	S	S	.	.	H	α-helix	trans	-66.3	-41.1	174.9	-70.8	166.1	0	0	0	110.1	Y130 E131 L137 C138 L300	Y130-I134 WeakPolarHBondContact O-CB 3.29Å; Y130-I134 WeakPolarHBondContact O-CD1 3.32Å; Y130-I134 WeakPolarHBondContact O-CG1 3.5Å; Y130-I134 PolarHBondContact O-N 2.85Å; E131-I134 PolarHBondContact O-N 3.26Å; I134-L137 PolarHBondContact O-N 3.47Å; I134-C138 WeakPolarHBondContact O-CB 3.46Å; I134-C138 PolarHBondContact O-N 2.96Å; I134-C138 PolarHBondContact O-SG 3.36Å; I134-L300 HydrophobicContact CG1-CD1 3.98Å
135	I	88.8	Confident	86.3	Confident	110 Å²	110	76 Å²	76	56%	0.564	37%	0.373	S	S	*	.	H	α-helix	trans	-64.3	-43.9	174.7	-65.7	165.2	0	0	0	110.6	E131 V132 L137 C138 T139	E131-I135 VanDerWaalsContact O-CG1 3.29Å; E131-I135 WeakPolarHBondContact O-CG1 3.43Å; E131-I135 PolarHBondContact O-N 3.2Å; V132-I135 PolarHBondContact O-N 3.32Å; I135-L137 VanDerWaalsContact C-N 3.3Å; I135-L137 PolarHBondContact O-N 3.21Å; I135-C138 PolarHBondContact O-N 3Å; I135-T139 HydrophobicContact CG2-CG2 4.43Å; I135-T139 WeakPolarHBondContact O-CG2 3.45Å; I135-T139 PolarHBondContact O-N 2.87Å; I135-T139 PolarHBondContact O-OG1 3.26Å
136	E	90.4	Very high	86.8	Confident	56 Å²	56	71.8 Å²	71.8	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-56.5	-44.9	173.5	-176.3	-174.6	175.8	0	0	111.1	V132 K133 T139 K140	V132-E136 WeakPolarHBondContact O-CB 3.45Å; V132-E136 PolarHBondContact O-N 3.03Å; K133-E136 WeakPolarHBondContact CD-OE2 3.24Å; K133-E136 IonicContact NZ-OE1 3.98Å; K133-E136 IonicContact NZ-OE2 2.82Å; K133-E136 PolarHBondContact NZ-OE2 2.9Å; K133-E136 WeakPolarHBondContact O-CB 3.22Å; K133-E136 PolarHBondContact O-N 3.43Å; E136-T139 PolarHBondContact O-OG1 3.16Å; E136-K140 HydrophobicContact CG-CD 4.18Å; E136-K140 WeakPolarHBondContact O-CB 3.2Å; E136-K140 VanDerWaalsContact O-CG 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.49Å; E136-K140 PolarHBondContact O-N 3.48Å; E136-K140 VanDerWaalsContact O-N 3.09Å; E136-K140 WeakPolarHBondContact OE1-CE 3.43Å; E136-K140 IonicContact OE1-NZ 3.55Å; E136-K140 PolarHBondContact OE1-NZ 2.94Å
137	L	88.9	Confident	87.6	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-49.1	177.4	-176.8	68.8	0	0	0	111.7	L75 K133 I134 I135 T139 K140 I141 V304 V307	L75-L137 HydrophobicContact CD1-CD2 3.47Å; L75-L137 VanDerWaalsContact CD1-CD2 3.47Å; K133-L137 WeakPolarHBondContact O-CB 3.37Å; K133-L137 PolarHBondContact O-N 3.43Å; I134-L137 PolarHBondContact O-N 3.47Å; I135-L137 VanDerWaalsContact C-N 3.3Å; I135-L137 PolarHBondContact O-N 3.21Å; L137-T139 VanDerWaalsContact C-N 3.35Å; L137-T139 PolarHBondContact O-N 2.98Å; L137-K140 PolarHBondContact O-N 3.34Å; L137-I141 HydrophobicContact CD1-CD1 4.07Å; L137-I141 HydrophobicContact CD1-CG1 4.31Å; L137-I141 HydrophobicContact CD2-CD1 4.3Å; L137-I141 HydrophobicContact CG-CD1 3.76Å; L137-I141 HydrophobicContact CG-CG1 4.33Å; L137-I141 WeakPolarHBondContact O-CB 3.28Å; L137-I141 VanDerWaalsContact O-CG1 3.29Å; L137-I141 WeakPolarHBondContact O-CG1 3.36Å; L137-I141 PolarHBondContact O-N 3.17Å; L137-V304 HydrophobicContact CB-CG2 4.2Å; L137-V304 HydrophobicContact CD1-CG2 4.07Å; L137-V307 HydrophobicContact CD1-CB 4.37Å; L137-V307 HydrophobicContact CD1-CG2 3.74Å
138	C	89.4	Confident	87.8	Confident	72 Å²	72	65.1 Å²	65.1	49%	0.486	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-43.4	179.9	-74.4	0	0	0	0	112.2	I134 I135 I141 F142	I134-C138 WeakPolarHBondContact O-CB 3.46Å; I134-C138 PolarHBondContact O-N 2.96Å; I134-C138 PolarHBondContact O-SG 3.36Å; I135-C138 PolarHBondContact O-N 3Å; C138-I141 PolarHBondContact O-N 3.17Å; C138-F142 WeakPolarHBondContact O-CB 3.27Å; C138-F142 PolarHBondContact O-N 3.25Å
139	T	91.2	Very high	87.8	Confident	75 Å²	75	63.6 Å²	63.6	46%	0.46	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-40.9	177.3	53.5	0	0	0	0	111.8	I135 E136 L137 F142 L143	I135-T139 HydrophobicContact CG2-CG2 4.43Å; I135-T139 WeakPolarHBondContact O-CG2 3.45Å; I135-T139 PolarHBondContact O-N 2.87Å; I135-T139 PolarHBondContact O-OG1 3.26Å; E136-T139 PolarHBondContact O-OG1 3.16Å; L137-T139 VanDerWaalsContact C-N 3.35Å; L137-T139 PolarHBondContact O-N 2.98Å; T139-F142 PolarHBondContact O-N 3.09Å; T139-L143 WeakPolarHBondContact O-CG 3.46Å; T139-L143 PolarHBondContact O-N 3.28Å
140	K	91.6	Very high	87.9	Confident	35 Å²	35	63.6 Å²	63.6	15%	0.152	32%	0.324	C	S	.	.	H	α-helix	trans	-70.6	-38.1	176.4	-69.9	176.7	-179.4	-179.6	0	113.2	E136 L137 F142 L143 L144 V307 N308	E136-K140 HydrophobicContact CG-CD 4.18Å; E136-K140 WeakPolarHBondContact O-CB 3.2Å; E136-K140 VanDerWaalsContact O-CG 3.26Å; E136-K140 WeakPolarHBondContact O-CG 3.49Å; E136-K140 PolarHBondContact O-N 3.48Å; E136-K140 VanDerWaalsContact O-N 3.09Å; E136-K140 WeakPolarHBondContact OE1-CE 3.43Å; E136-K140 IonicContact OE1-NZ 3.55Å; E136-K140 PolarHBondContact OE1-NZ 2.94Å; L137-K140 PolarHBondContact O-N 3.34Å; K140-F142 VanDerWaalsContact C-N 3.29Å; K140-F142 PolarHBondContact O-N 3.48Å; K140-L143 PolarHBondContact O-N 3.4Å; K140-L144 WeakPolarHBondContact O-CB 3.45Å; K140-L144 PolarHBondContact O-N 3.15Å; K140-V307 HydrophobicContact CB-CG1 3.57Å; K140-N308 VanDerWaalsContact CD-OD1 3.29Å; K140-N308 WeakPolarHBondContact CD-OD1 3.49Å; K140-N308 VanDerWaalsContact CE-OD1 3.27Å; K140-N308 WeakPolarHBondContact CE-OD1 3.24Å; K140-N308 PolarHBondContact NZ-OD1 3.41Å
141	I	89.1	Confident	87.9	Confident	13 Å²	13	61.2 Å²	61.2	7%	0.067	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-41.4	173.1	-72	173.6	0	0	0	110	F68 P71 F72 L137 C138 L144 F145 V307	F68-I141 HydrophobicContact CD2-CG2 4.44Å; F68-I141 HydrophobicContact CE2-CG2 3.7Å; F68-I141 HydrophobicContact CZ-CG2 4.21Å; P71-I141 HydrophobicContact CB-CD1 4.37Å; P71-I141 HydrophobicContact CG-CD1 4.18Å; F72-I141 HydrophobicContact CE1-CD1 4.44Å; F72-I141 HydrophobicContact CE2-CD1 4.25Å; F72-I141 HydrophobicContact CE2-CG2 4.44Å; F72-I141 HydrophobicContact CZ-CD1 3.95Å; F72-I141 HydrophobicContact CZ-CG2 4.35Å; L137-I141 HydrophobicContact CD1-CD1 4.07Å; L137-I141 HydrophobicContact CD1-CG1 4.31Å; L137-I141 HydrophobicContact CD2-CD1 4.3Å; L137-I141 HydrophobicContact CG-CD1 3.76Å; L137-I141 HydrophobicContact CG-CG1 4.33Å; L137-I141 WeakPolarHBondContact O-CB 3.28Å; L137-I141 VanDerWaalsContact O-CG1 3.29Å; L137-I141 WeakPolarHBondContact O-CG1 3.36Å; L137-I141 PolarHBondContact O-N 3.17Å; C138-I141 PolarHBondContact O-N 3.17Å; I141-L144 PolarHBondContact O-N 2.96Å; I141-F145 WeakPolarHBondContact O-CB 3.34Å; I141-F145 PolarHBondContact O-N 2.75Å; I141-V307 HydrophobicContact CG1-CG1 4.35Å; I141-V307 HydrophobicContact CG1-CG2 3.83Å
142	F	89.7	Confident	87.7	Confident	127 Å²	127	56.4 Å²	56.4	56%	0.557	29%	0.292	S	S	*	.	H	α-helix	trans	-62	-44.7	175.3	-179.4	-101.5	0	0	0	112.1	C138 T139 K140 F145 L146	C138-F142 WeakPolarHBondContact O-CB 3.27Å; C138-F142 PolarHBondContact O-N 3.25Å; T139-F142 PolarHBondContact O-N 3.09Å; K140-F142 VanDerWaalsContact C-N 3.29Å; K140-F142 PolarHBondContact O-N 3.48Å; F142-F145 WeakPolarHBondContact O-CB 3.26Å; F142-F145 PolarHBondContact O-N 3.31Å; F142-L146 HydrophobicContact CD1-CD1 4.08Å; F142-L146 HydrophobicContact CE1-CD1 3.52Å; F142-L146 HydrophobicContact CE1-CG 4.18Å; F142-L146 HydrophobicContact CZ-CD1 3.96Å; F142-L146 HydrophobicContact CZ-CD2 4.42Å; F142-L146 HydrophobicContact CZ-CG 4.28Å; F142-L146 PolarHBondContact O-N 3.08Å
143	L	90	Very high	87.2	Confident	85 Å²	85	55 Å²	55	45%	0.445	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-42.5	174.7	-71	174.4	0	0	0	112.4	T139 K140 F145 L146 C147 L311	T139-L143 WeakPolarHBondContact O-CG 3.46Å; T139-L143 PolarHBondContact O-N 3.28Å; K140-L143 PolarHBondContact O-N 3.4Å; L143-F145 VanDerWaalsContact C-N 3.27Å; L143-F145 PolarHBondContact O-N 3.32Å; L143-L146 PolarHBondContact O-N 2.95Å; L143-C147 PolarHBondContact O-N 3.23Å; L143-C147 PolarHBondContact O-SG 2.88Å; L143-L311 HydrophobicContact CB-CD1 3.95Å
144	L	89.3	Confident	86.6	Confident	9 Å²	9	55.2 Å²	55.2	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-39.9	175.2	179.8	64.9	0	0	0	111.2	K140 I141 C147 S148 V307 H310 L311 Q314	K140-L144 WeakPolarHBondContact O-CB 3.45Å; K140-L144 PolarHBondContact O-N 3.15Å; I141-L144 PolarHBondContact O-N 2.96Å; L144-C147 PolarHBondContact O-N 2.87Å; L144-S148 WeakPolarHBondContact O-CB 3.29Å; L144-S148 PolarHBondContact O-N 3Å; L144-S148 PolarHBondContact O-OG 3.39Å; L144-V307 HydrophobicContact CB-CG1 4.49Å; L144-V307 HydrophobicContact CD2-CG1 4.33Å; L144-H310 HydrophobicContact CD1-CB 4.02Å; L144-H310 HydrophobicContact CD2-CB 4.17Å; L144-L311 HydrophobicContact CB-CD1 4.32Å; L144-Q314 HydrophobicContact CD1-CG 3.93Å
145	F	88.1	Confident	86.1	Confident	104 Å²	104	51.5 Å²	51.5	46%	0.456	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-44.1	175	178.7	-98.6	0	0	0	111.8	F68 I141 F142 L143 S149	F68-F145 HydrophobicContact CE2-CB 4.36Å; F68-F145 HydrophobicContact CE2-CD2 4.24Å; I141-F145 WeakPolarHBondContact O-CB 3.34Å; I141-F145 PolarHBondContact O-N 2.75Å; F142-F145 WeakPolarHBondContact O-CB 3.26Å; F142-F145 PolarHBondContact O-N 3.31Å; L143-F145 VanDerWaalsContact C-N 3.27Å; L143-F145 PolarHBondContact O-N 3.32Å; F145-S149 WeakPolarHBondContact O-CB 3.46Å; F145-S149 PolarHBondContact O-N 3.42Å; F145-S149 PolarHBondContact O-OG 3.03Å
146	L	88.9	Confident	85.4	Confident	85 Å²	85	48.9 Å²	48.9	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-45.7	176.9	-69	178.2	0	0	0	112.2	F142 L143 Y150	F142-L146 HydrophobicContact CD1-CD1 4.08Å; F142-L146 HydrophobicContact CE1-CD1 3.52Å; F142-L146 HydrophobicContact CE1-CG 4.18Å; F142-L146 HydrophobicContact CZ-CD1 3.96Å; F142-L146 HydrophobicContact CZ-CD2 4.42Å; F142-L146 HydrophobicContact CZ-CG 4.28Å; F142-L146 PolarHBondContact O-N 3.08Å; L143-L146 PolarHBondContact O-N 2.95Å; L146-Y150 PolarHBondContact O-N 3.09Å
147	C	87.5	Confident	84.5	Confident	25 Å²	25	54 Å²	54	17%	0.169	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-46.6	178	-71.5	0	0	0	0	111.8	L143 L144 Y150 I151 Q314 I318	L143-C147 PolarHBondContact O-N 3.23Å; L143-C147 PolarHBondContact O-SG 2.88Å; L144-C147 PolarHBondContact O-N 2.87Å; C147-Y150 WeakPolarHBondContact O-CB 3.34Å; C147-Y150 PolarHBondContact O-N 3.41Å; C147-I151 WeakPolarHBondContact O-CG1 3.37Å; C147-I151 PolarHBondContact O-N 3.3Å; C147-I151 VanDerWaalsContact O-N 3.1Å; C147-Q314 HydrophobicContact CB-CB 4.22Å; C147-I318 HydrophobicContact CB-CD1 4.03Å
148	S	84.7	Confident	83.4	Confident	13 Å²	13	57.8 Å²	57.8	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-47.5	177.5	-57.1	0	0	0	0	110.7	L144 Y150 I151 Y152	L144-S148 WeakPolarHBondContact O-CB 3.29Å; L144-S148 PolarHBondContact O-N 3Å; L144-S148 PolarHBondContact O-OG 3.39Å; S148-Y150 PolarHBondContact O-N 3.29Å; S148-I151 PolarHBondContact O-N 3.2Å; S148-I151 VanDerWaalsContact O-N 3.14Å; S148-Y152 WeakPolarHBondContact O-CD2 3.3Å; S148-Y152 PolarHBondContact O-N 3.46Å
149	S	83.9	Confident	82.5	Confident	48 Å²	48	55.2 Å²	55.2	34%	0.336	28%	0.281	S	S	.	.	H	α-helix	trans	-55	-41.3	176.7	-62.7	0	0	0	0	111.8	F145 A153	F145-S149 WeakPolarHBondContact O-CB 3.46Å; F145-S149 PolarHBondContact O-N 3.42Å; F145-S149 PolarHBondContact O-OG 3.03Å; S149-A153 WeakPolarHBondContact O-CB 3.48Å; S149-A153 PolarHBondContact O-N 2.82Å
150	Y	84.7	Confident	81.3	Confident	99 Å²	99	56.6 Å²	56.6	39%	0.388	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-51.9	176.1	179.7	-101.7	0	0	0	112.4	L146 C147 S148 A153 T154 I318 K322	L146-Y150 PolarHBondContact O-N 3.09Å; C147-Y150 WeakPolarHBondContact O-CB 3.34Å; C147-Y150 PolarHBondContact O-N 3.41Å; S148-Y150 PolarHBondContact O-N 3.29Å; Y150-A153 PolarHBondContact O-N 3.37Å; Y150-T154 WeakPolarHBondContact O-CG2 3.25Å; Y150-T154 PolarHBondContact O-N 2.66Å; Y150-T154 VanDerWaalsContact O-N 3.11Å; Y150-I318 HydrophobicContact CD1-CD1 4.23Å; Y150-I318 HydrophobicContact CD1-CG1 4.14Å; Y150-I318 HydrophobicContact CE1-CG2 4.41Å; Y150-K322 VanDerWaalsContact OH-CE 3.31Å; Y150-K322 WeakPolarHBondContact OH-CE 3.04Å; Y150-K322 PolarHBondContact OH-NZ 2.79Å; Y150-K322 VanDerWaalsContact OH-NZ 3.08Å
151	I	82.6	Confident	79.9	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-51.4	-178.2	-64.1	163.9	0	0	0	110	C147 S148 A153 T154 R155 Q314 A317 I318	C147-I151 WeakPolarHBondContact O-CG1 3.37Å; C147-I151 PolarHBondContact O-N 3.3Å; C147-I151 VanDerWaalsContact O-N 3.1Å; S148-I151 PolarHBondContact O-N 3.2Å; S148-I151 VanDerWaalsContact O-N 3.14Å; I151-A153 PolarHBondContact O-N 2.99Å; I151-T154 PolarHBondContact O-N 3.36Å; I151-T154 VanDerWaalsContact O-N 3.14Å; I151-T154 PolarHBondContact O-OG1 2.93Å; I151-R155 WeakPolarHBondContact O-CG 3.44Å; I151-R155 PolarHBondContact O-N 3.41Å; I151-Q314 HydrophobicContact CD1-CB 3.89Å; I151-Q314 HydrophobicContact CD1-CG 4.35Å; I151-A317 HydrophobicContact CD1-CB 4.36Å; I151-I318 HydrophobicContact CD1-CD1 4.01Å; I151-I318 HydrophobicContact CD1-CG1 3.69Å; I151-I318 HydrophobicContact CG1-CD1 4.06Å; I151-I318 HydrophobicContact CG1-CG1 3.57Å
152	Y	80.6	Confident	78.5	Confident	6 Å²	6	60.9 Å²	60.9	2%	0.024	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-36	-178.4	-69.1	-71.5	0	0	0	112	I64 S148 T154 R155 F156	I64-Y152 HydrophobicContact CD1-CD1 3.59Å; I64-Y152 HydrophobicContact CD1-CD2 3.59Å; I64-Y152 HydrophobicContact CD1-CE1 3.91Å; I64-Y152 HydrophobicContact CD1-CE2 3.96Å; I64-Y152 HydrophobicContact CD1-CG 3.42Å; I64-Y152 VanDerWaalsContact CD1-CG 3.42Å; I64-Y152 HydrophobicContact CG1-CD1 3.98Å; I64-Y152 HydrophobicContact CG1-CD2 3.58Å; I64-Y152 HydrophobicContact CG1-CE1 3.78Å; I64-Y152 HydrophobicContact CG1-CE2 3.42Å; I64-Y152 VanDerWaalsContact CG1-CE2 3.42Å; I64-Y152 HydrophobicContact CG1-CG 3.89Å; I64-Y152 VanDerWaalsContact CG1-CZ 3.5Å; S148-Y152 WeakPolarHBondContact O-CD2 3.3Å; S148-Y152 PolarHBondContact O-N 3.46Å; Y152-T154 VanDerWaalsContact C-N 3.28Å; Y152-T154 PolarHBondContact O-N 3.42Å; Y152-R155 PolarHBondContact O-N 2.82Å; Y152-R155 VanDerWaalsContact O-N 3.13Å; Y152-F156 WeakPolarHBondContact O-CB 3.29Å; Y152-F156 WeakPolarHBondContact O-CD2 3.38Å; Y152-F156 PolarHBondContact O-N 2.98Å
153	A	78.6	Confident	77.1	Confident	60 Å²	60	57.4 Å²	57.4	50%	0.496	29%	0.291	S	S	.	.	H	α-helix	trans	-59.8	-38.6	172.6	0	0	0	0	0	112.2	S149 Y150 I151 K157	S149-A153 WeakPolarHBondContact O-CB 3.48Å; S149-A153 PolarHBondContact O-N 2.82Å; Y150-A153 PolarHBondContact O-N 3.37Å; I151-A153 PolarHBondContact O-N 2.99Å; A153-K157 WeakPolarHBondContact O-CB 3.23Å; A153-K157 PolarHBondContact O-N 3.43Å
154	T	74.2	Confident	75.4	Confident	48 Å²	48	61.1 Å²	61.1	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-41.5	174.2	61.9	0	0	0	0	112.1	Y150 I151 Y152 K157 E158	Y150-T154 WeakPolarHBondContact O-CG2 3.25Å; Y150-T154 PolarHBondContact O-N 2.66Å; Y150-T154 VanDerWaalsContact O-N 3.11Å; I151-T154 PolarHBondContact O-N 3.36Å; I151-T154 VanDerWaalsContact O-N 3.14Å; I151-T154 PolarHBondContact O-OG1 2.93Å; Y152-T154 VanDerWaalsContact C-N 3.28Å; Y152-T154 PolarHBondContact O-N 3.42Å; T154-K157 PolarHBondContact O-N 3.04Å; T154-E158 PolarHBondContact O-N 3.48Å; T154-E158 VanDerWaalsContact O-N 3.15Å
155	R	75	Confident	73.4	Confident	5 Å²	5	64.7 Å²	64.7	2%	0.019	33%	0.325	C	S	.	.	H	α-helix	trans	-66.6	-46	176.4	-65.4	-176.1	-179.7	-176.1	6.4	113	E60 I151 Y152 K157 E158 L159 N210 D214	E60-R155 WeakPolarHBondContact OE1-CD 3.29Å; E60-R155 IonicContact OE1-NH1 3.24Å; E60-R155 PolarHBondContact OE1-NH1 3.22Å; I151-R155 WeakPolarHBondContact O-CG 3.44Å; I151-R155 PolarHBondContact O-N 3.41Å; Y152-R155 PolarHBondContact O-N 2.82Å; Y152-R155 VanDerWaalsContact O-N 3.13Å; R155-K157 VanDerWaalsContact C-N 3.26Å; R155-K157 PolarHBondContact O-N 3.35Å; R155-E158 WeakPolarHBondContact O-CB 3.4Å; R155-E158 PolarHBondContact O-N 2.95Å; R155-E158 VanDerWaalsContact O-N 3.08Å; R155-L159 WeakPolarHBondContact O-CG 3.38Å; R155-L159 PolarHBondContact O-N 3.37Å; R155-N210 PolarHBondContact NE-OD1 3.18Å; R155-N210 PolarHBondContact NH2-O 3.25Å; R155-D214 IonicContact CZ-OD1 2.75Å; R155-D214 VanDerWaalsContact CZ-OD1 3.24Å; R155-D214 IonicContact CZ-OD2 2.61Å; R155-D214 IonicContact NH1-OD1 2.62Å; R155-D214 PolarHBondContact NH1-OD1 3.33Å; R155-D214 IonicContact NH1-OD2 3.79Å; R155-D214 PolarHBondContact NH1-OD2 3.33Å; R155-D214 IonicContact NH2-OD1 3.51Å; R155-D214 PolarHBondContact NH2-OD1 2.9Å; R155-D214 IonicContact NH2-OD2 2.71Å
156	F	74.5	Confident	71.1	Confident	56 Å²	56	67 Å²	67	25%	0.246	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-40.6	174.7	-83.4	-65.7	0	0	0	111.3	I57 I61 I64 Y152 E158 L159 L160	I57-F156 HydrophobicContact CG2-CE1 4.02Å; I61-F156 HydrophobicContact CD1-CZ 4.48Å; I61-F156 HydrophobicContact CG1-CZ 3.94Å; I64-F156 HydrophobicContact CD1-CE2 4.45Å; Y152-F156 WeakPolarHBondContact O-CB 3.29Å; Y152-F156 WeakPolarHBondContact O-CD2 3.38Å; Y152-F156 PolarHBondContact O-N 2.98Å; F156-E158 PolarHBondContact O-N 3.46Å; F156-L159 PolarHBondContact O-N 3.08Å; F156-L160 WeakPolarHBondContact O-CB 3.21Å; F156-L160 WeakPolarHBondContact O-CG 3.28Å; F156-L160 PolarHBondContact O-N 2.92Å
157	K	72.3	Confident	68.4	Low	162 Å²	162	71.3 Å²	71.3	70%	0.704	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-42.4	175.3	-173	-179.8	179.7	-179.9	0	112	A153 T154 R155 F161	A153-K157 WeakPolarHBondContact O-CB 3.23Å; A153-K157 PolarHBondContact O-N 3.43Å; T154-K157 PolarHBondContact O-N 3.04Å; R155-K157 VanDerWaalsContact C-N 3.26Å; R155-K157 PolarHBondContact O-N 3.35Å; K157-F161 WeakPolarHBondContact O-CB 3.23Å; K157-F161 PolarHBondContact O-N 3.49Å
158	E	66.5	Low	65.7	Low	86 Å²	86	74.8 Å²	74.8	40%	0.402	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-45.2	176.1	-71.4	-175.5	-178.2	0	0	112.1	T154 R155 F156 F161 C162 S206	T154-E158 PolarHBondContact O-N 3.48Å; T154-E158 VanDerWaalsContact O-N 3.15Å; R155-E158 WeakPolarHBondContact O-CB 3.4Å; R155-E158 PolarHBondContact O-N 2.95Å; R155-E158 VanDerWaalsContact O-N 3.08Å; F156-E158 PolarHBondContact O-N 3.46Å; E158-F161 PolarHBondContact O-N 2.99Å; E158-C162 PolarHBondContact O-N 3.27Å; E158-C162 PolarHBondContact O-SG 3.4Å; E158-S206 PolarHBondContact OE2-OG 3.26Å
159	L	69.3	Low	63.1	Low	18 Å²	18	82.9 Å²	82.9	9%	0.094	40%	0.402	C	S	.	.	H	α-helix	trans	-66.8	-42.6	178	-70.7	170	0	0	0	112.3	Y53 L56 I57 E60 R155 F156 F161 C162 M163	Y53-L159 HydrophobicContact CD1-CD2 3.84Å; Y53-L159 HydrophobicContact CE1-CD2 4.18Å; L56-L159 HydrophobicContact CD2-CD2 4.44Å; I57-L159 HydrophobicContact CG1-CD1 3.96Å; E60-L159 WeakPolarHBondContact OE2-CD1 2.87Å; R155-L159 WeakPolarHBondContact O-CG 3.38Å; R155-L159 PolarHBondContact O-N 3.37Å; F156-L159 PolarHBondContact O-N 3.08Å; L159-F161 VanDerWaalsContact C-N 3.33Å; L159-F161 PolarHBondContact O-N 3.44Å; L159-C162 WeakPolarHBondContact O-CB 3.43Å; L159-C162 PolarHBondContact O-N 2.97Å; L159-M163 VanDerWaalsContact O-CG 3.31Å; L159-M163 WeakPolarHBondContact O-CG 3.49Å; L159-M163 PolarHBondContact O-N 3.36Å
160	L	66.3	Low	60.5	Low	104 Å²	104	87.7 Å²	87.7	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-36.1	176.2	-75.1	172.2	0	0	0	111.8	F156 C162 M163 H164	F156-L160 WeakPolarHBondContact O-CB 3.21Å; F156-L160 WeakPolarHBondContact O-CG 3.28Å; F156-L160 PolarHBondContact O-N 2.92Å; L160-C162 VanDerWaalsContact C-N 3.32Å; L160-C162 PolarHBondContact O-N 3.27Å; L160-M163 PolarHBondContact O-N 3.47Å; L160-M163 VanDerWaalsContact O-N 3.17Å; L160-H164 WeakPolarHBondContact O-CB 3.47Å; L160-H164 PolarHBondContact O-N 3.46Å
161	F	61.3	Low	57.6	Low	119 Å²	119	86.9 Å²	86.9	52%	0.522	43%	0.431	S	S	.	.	H	α-helix	trans	-61.3	-41.1	173.5	-177.5	-99.9	0	0	0	111.7	K157 E158 L159 M163 H164 N165	K157-F161 WeakPolarHBondContact O-CB 3.23Å; K157-F161 PolarHBondContact O-N 3.49Å; E158-F161 PolarHBondContact O-N 2.99Å; L159-F161 VanDerWaalsContact C-N 3.33Å; L159-F161 PolarHBondContact O-N 3.44Å; F161-M163 VanDerWaalsContact C-N 3.31Å; F161-M163 PolarHBondContact O-N 2.96Å; F161-H164 PolarHBondContact O-N 2.89Å; F161-N165 WeakPolarHBondContact CE1-ND2 3.44Å; F161-N165 WeakPolarHBondContact CZ-ND2 3.36Å; F161-N165 PolarHBondContact O-N 3.06Å; F161-N165 VanDerWaalsContact O-N 3.09Å
162	C	60.6	Low	55	Low	18 Å²	18	94.9 Å²	94.9	12%	0.122	46%	0.463	C	S	.	.	H	α-helix	trans	-60.4	-40.9	172.6	-69.5	0	0	0	0	112.3	E158 L159 L160 W198 M203	E158-C162 PolarHBondContact O-N 3.27Å; E158-C162 PolarHBondContact O-SG 3.4Å; L159-C162 WeakPolarHBondContact O-CB 3.43Å; L159-C162 PolarHBondContact O-N 2.97Å; L160-C162 VanDerWaalsContact C-N 3.32Å; L160-C162 PolarHBondContact O-N 3.27Å; C162-W198 HydrophobicContact CB-CZ2 4.4Å; C162-M203 WeakPolarHBondContact SG-CE 3.28Å
163	M	60.3	Low	52.5	Low	54 Å²	54	99.4 Å²	99.4	27%	0.266	50%	0.495	S	S	.	.	H	α-helix	trans	-72.2	-38.7	-179.8	-66	-75.2	-79	0	0	112.4	Y50 L159 L160 F161 R166	Y50-M163 HydrophobicContact CD2-CE 3.7Å; Y50-M163 HydrophobicContact CD2-SD 3.88Å; Y50-M163 HydrophobicContact CE2-CE 3.21Å; Y50-M163 HydrophobicContact CE2-SD 4.02Å; L159-M163 VanDerWaalsContact O-CG 3.31Å; L159-M163 WeakPolarHBondContact O-CG 3.49Å; L159-M163 PolarHBondContact O-N 3.36Å; L160-M163 PolarHBondContact O-N 3.47Å; L160-M163 VanDerWaalsContact O-N 3.17Å; F161-M163 VanDerWaalsContact C-N 3.31Å; F161-M163 PolarHBondContact O-N 2.96Å; M163-R166 WeakPolarHBondContact O-CB 3.22Å; M163-R166 PolarHBondContact O-N 2.99Å
164	H	53.5	Low	50	Low	164 Å²	164	107.5 Å²	107.5	76%	0.759	51%	0.512	S	S	*	.	H	α-helix	trans	-79.5	-28.6	-175.2	-162.9	61.4	0	0	0	113.3	L160 F161 R166	L160-H164 WeakPolarHBondContact O-CB 3.47Å; L160-H164 PolarHBondContact O-N 3.46Å; F161-H164 PolarHBondContact O-N 2.89Å; H164-R166 PolarHBondContact O-N 2.84Å
165	N	47.7	Very low	47.8	Very low	83 Å²	83	110.8 Å²	110.8	44%	0.444	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	6.1	170.6	-83.7	-15.6	0	0	0	114.2	F161 K167	F161-N165 WeakPolarHBondContact CE1-ND2 3.44Å; F161-N165 WeakPolarHBondContact CZ-ND2 3.36Å; F161-N165 PolarHBondContact O-N 3.06Å; F161-N165 VanDerWaalsContact O-N 3.09Å; N165-K167 PolarHBondContact O-N 3.34Å
166	R	40.9	Very low	45.7	Very low	153 Å²	153	115 Å²	115	58%	0.577	56%	0.558	S	S	*	*			trans	-66.9	68.6	156.7	-158.9	-178.1	-168.2	-177.2	3.9	109.6	M163 H164 P168	M163-R166 WeakPolarHBondContact O-CB 3.22Å; M163-R166 PolarHBondContact O-N 2.99Å; H164-R166 PolarHBondContact O-N 2.84Å; R166-P168 WeakPolarHBondContact O-CD 3.45Å; R166-P168 VanDerWaalsContact O-N 3.14Å
167	K	31.7	Very low	43.5	Very low	176 Å²	176	115.6 Å²	115.6	77%	0.765	58%	0.58	S	S	*	*			trans	-55.1	122.1	157.3	-79.5	-168.9	178.7	-177.2	0	106.3	N165 F169	N165-K167 PolarHBondContact O-N 3.34Å; K167-F169 PolarHBondContact O-N 2.89Å
168	P	30.7	Very low	41.3	Very low	97 Å²	97	117.2 Å²	117.2	63%	0.63	58%	0.583	S	S	*	*			trans	-67.2	113.3	-178.8	27.3	-31	0	0	0	107.2	R166 I170	R166-P168 WeakPolarHBondContact O-CD 3.45Å; R166-P168 VanDerWaalsContact O-N 3.14Å; P168-I170 HydrophobicContact CB-CB 4.33Å; P168-I170 HydrophobicContact CB-CD1 4.19Å; P168-I170 HydrophobicContact CB-CG1 4.1Å; P168-I170 PolarHBondContact O-N 2.91Å
169	F	30.5	Very low	39.5	Very low	184 Å²	184	121.9 Å²	121.9	81%	0.807	60%	0.602	S	S	*	*			trans	-68.6	65.2	155	-84.4	-90.8	0	0	0	108	K167 Y172	K167-F169 PolarHBondContact O-N 2.89Å; F169-Y172 HydrophobicContact CD1-CD2 4.42Å; F169-Y172 HydrophobicContact CD1-CE2 4.13Å; F169-Y172 HydrophobicContact CE1-CE2 4.36Å
170	I	28.3	Very low	37.8	Very low	148 Å²	148	132.1 Å²	132.1	76%	0.759	64%	0.639	S	S	*	*			trans	-123.9	69.7	168.5	-55.5	173	0	0	0	105.9	P168	P168-I170 HydrophobicContact CB-CB 4.33Å; P168-I170 HydrophobicContact CB-CD1 4.19Å; P168-I170 HydrophobicContact CB-CG1 4.1Å; P168-I170 PolarHBondContact O-N 2.91Å
171	S	23.2	Very low	36	Very low	82 Å²	82	137.2 Å²	137.2	57%	0.573	65%	0.653	S	S	*	*			trans	-164.2	43	155.7	68.1	0	0	0	0	111.7	S173	S171-S173 VanDerWaalsContact C-N 3.3Å
172	Y	28.6	Very low	34.5	Very low	170 Å²	170	137.9 Å²	137.9	67%	0.667	66%	0.657	S	S	*	*			trans	-84.6	-5.3	162.7	-97.9	-80.4	0	0	0	112.7	F169 R174 L175	F169-Y172 HydrophobicContact CD1-CD2 4.42Å; F169-Y172 HydrophobicContact CD1-CE2 4.13Å; F169-Y172 HydrophobicContact CE1-CE2 4.36Å; Y172-R174 PolarHBondContact O-N 2.84Å; Y172-L175 HydrophobicContact CD1-CD1 4.45Å; Y172-L175 HydrophobicContact CE1-CD1 4.31Å; Y172-L175 PolarHBondContact O-N 2.79Å
173	S	27.7	Very low	33.3	Very low	100 Å²	100	146.6 Å²	146.6	70%	0.699	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-12.6	172.1	55.1	0	0	0	0	114.1	S171 S176	S171-S173 VanDerWaalsContact C-N 3.3Å; S173-S176 PolarHBondContact O-OG 3.49Å
174	R	26.2	Very low	31.9	Very low	230 Å²	230	149.2 Å²	149.2	87%	0.868	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-7.1	175.3	-85.8	-171.4	165.2	151.2	-2	114.9	Y172	Y172-R174 PolarHBondContact O-N 2.84Å
175	L	29	Very low	30.8	Very low	118 Å²	118	149.3 Å²	149.3	62%	0.618	72%	0.721	S	S	*	*	S	Bend	trans	-101.7	-8.6	178.8	-90	145.9	0	0	0	114.5	Y172 G177 Y178	Y172-L175 HydrophobicContact CD1-CD1 4.45Å; Y172-L175 HydrophobicContact CE1-CD1 4.31Å; Y172-L175 PolarHBondContact O-N 2.79Å; L175-G177 PolarHBondContact O-N 2.95Å; L175-Y178 PolarHBondContact O-N 3.36Å
176	S	30.7	Very low	29.9	Very low	93 Å²	93	151.1 Å²	151.1	65%	0.65	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-10.5	170.5	59.8	0	0	0	0	113.6	S173	S173-S176 PolarHBondContact O-OG 3.49Å
177	G	27.8	Very low	29.4	Very low	68 Å²	68	148.4 Å²	148.4	70%	0.701	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-11.7	173.2	0	0	0	0	0	114.9	L175	L175-G177 PolarHBondContact O-N 2.95Å
178	Y	27	Very low	29.4	Very low	197 Å²	197	149.7 Å²	149.7	77%	0.773	74%	0.744	S	S	*	*			trans	-106.3	46.8	179.7	-127.5	-95.9	0	0	0	111.3	L175	L175-Y178 PolarHBondContact O-N 3.36Å
179	K	28.5	Very low	29.3	Very low	183 Å²	183	150.4 Å²	150.4	80%	0.796	75%	0.746	S	S	*	*			trans	-74.1	127.4	159.7	-89.5	-173.6	175.7	-178.4	0	108.2
180	R	33.3	Very low	29.1	Very low	233 Å²	233	147.1 Å²	147.1	88%	0.879	74%	0.741	S	S	*	*	S	Bend	trans	90.5	74.5	175.3	-58.2	-174.9	-109.7	-173.4	-6.8	115.2
181	Y	28.6	Very low	29	Very low	211 Å²	211	144.7 Å²	144.7	83%	0.827	74%	0.737	S	S	*	*	S	Bend		-171.1	137.7	121.8	-120.2	-97.5	0	0	0	108.2
182	Q	29.2	Very low	29.3	Very low	134 Å²	134	145.6 Å²	145.6	63%	0.626	74%	0.744	S	S	*	*			trans	77.1	65.5	178.2	-57.4	-173.9	-14.8	0	0	117.5
183	Q	36.4	Very low	29.2	Very low	200 Å²	200	143.6 Å²	143.6	94%	0.935	74%	0.743	S	S	*	*	S	Bend	trans	-95.2	22.9	163.3	-151.6	164.4	0.3	0	0	113
184	S	31.2	Very low	29.1	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	74%	0.741	S	S	*	*	S	Bend	trans	-126.5	-5.4	-179.6	58.6	0	0	0	0	117.2
185	E	28.8	Very low	28.9	Very low	165 Å²	165	140.8 Å²	140.8	77%	0.771	74%	0.736	S	S	*	*	S	Bend	trans	-122.5	-7.6	176.2	-95.6	-173.5	156.5	0	0	116.1
186	M	29.2	Very low	28.7	Very low	122 Å²	122	141.5 Å²	141.5	60%	0.601	74%	0.739	S	S	*	*	S	Bend	trans	-96	1.8	174.9	-69.5	-156.8	-178.8	0	0	115	K188 T189 V190	M186-K188 PolarHBondContact O-N 3.25Å; M186-T189 PolarHBondContact O-N 3.03Å; M186-V190 WeakPolarHBondContact O-CG2 3.39Å
187	A	31.2	Very low	28.4	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	4.3	178.5	0	0	0	0	0	114.8
188	K	30.9	Very low	28.3	Very low	203 Å²	203	141.7 Å²	141.7	88%	0.883	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	4.4	175.3	-74	-174.5	178.2	177.8	0	115.3	M186	M186-K188 PolarHBondContact O-N 3.25Å
189	T	29.3	Very low	28.4	Very low	112 Å²	112	135.8 Å²	135.8	69%	0.687	70%	0.702	S	S	*	*	S	Bend	trans	-136.9	25.4	-179.2	56.5	0	0	0	0	114.5	M186	M186-T189 PolarHBondContact O-N 3.03Å
190	V	26.9	Very low	28.6	Very low	116 Å²	116	132.2 Å²	132.2	70%	0.703	69%	0.688	S	S	*	*			trans	-117.9	83.8	178.4	-175.7	0	0	0	0	110.3	M186	M186-V190 WeakPolarHBondContact O-CG2 3.39Å
191	S	25.7	Very low	28.9	Very low	96 Å²	96	125.3 Å²	125.3	67%	0.671	68%	0.676	S	S	*	*			trans	-176.7	46.7	145.6	57.5	0	0	0	0	110.2	I193	S191-I193 PolarHBondContact O-N 3.47Å
192	S	28.2	Very low	29.4	Very low	102 Å²	102	122.1 Å²	122.1	71%	0.713	67%	0.666	S	S	*	*			trans	-73.1	79.4	154.5	66.6	0	0	0	0	107	V194	S192-V194 PolarHBondContact O-N 3.38Å
193	I	26.6	Very low	30.1	Very low	128 Å²	128	117.9 Å²	117.9	66%	0.656	65%	0.646	S	S	*	*			trans	-57.3	93.1	151.7	-64.3	170	0	0	0	103.2	S191 H195	S191-I193 PolarHBondContact O-N 3.47Å; I193-H195 PolarHBondContact O-N 3.01Å
194	V	25.9	Very low	30.7	Very low	106 Å²	106	114.5 Å²	114.5	64%	0.642	63%	0.629	S	S	*	*			trans	-63.9	92.2	169.2	175.9	0	0	0	0	103.3	S192 L196	S192-V194 PolarHBondContact O-N 3.38Å; V194-L196 HydrophobicContact CG1-CD1 4.45Å; V194-L196 PolarHBondContact O-N 2.95Å
195	H	23.5	Very low	31.5	Very low	164 Å²	164	114.2 Å²	114.2	76%	0.759	62%	0.615	S	S	*	*			trans	-54.1	96.8	157.9	-104.8	-87.2	0	0	0	104	I193 S197	I193-H195 PolarHBondContact O-N 3.01Å; H195-S197 PolarHBondContact O-N 2.9Å
196	L	24.2	Very low	33.2	Very low	133 Å²	133	107.6 Å²	107.6	70%	0.696	59%	0.587	S	S	*	*			trans	-63.9	87	174.9	-159.8	80	0	0	0	104.1	V194 W198	V194-L196 HydrophobicContact CG1-CD1 4.45Å; V194-L196 PolarHBondContact O-N 2.95Å; L196-W198 HydrophobicContact CD2-CE3 4.44Å; L196-W198 PolarHBondContact O-N 3.43Å
197	S	23.7	Very low	34.9	Very low	74 Å²	74	104.8 Å²	104.8	52%	0.517	57%	0.574	S	S	.	*			trans	-69.9	82.9	172.6	40.9	0	0	0	0	105.1	H195	H195-S197 PolarHBondContact O-N 2.9Å
198	W	26.4	Very low	36.6	Very low	92 Å²	92	104.4 Å²	104.4	35%	0.348	56%	0.562	S	S	.	*			trans	-42.6	147.3	160.1	-155.9	-87.6	0	0	0	107.7	C162 L196 Q200 M203	C162-W198 HydrophobicContact CB-CZ2 4.4Å; L196-W198 HydrophobicContact CD2-CE3 4.44Å; L196-W198 PolarHBondContact O-N 3.43Å; W198-Q200 HydrophobicContact CB-CG 4.18Å; W198-Q200 WeakPolarHBondContact O-CG 3.48Å; W198-Q200 PolarHBondContact O-N 2.9Å; W198-M203 PolarHBondContact NE1-SD 3.45Å
199	P	28.8	Very low	38.7	Very low	73 Å²	73	97.5 Å²	97.5	47%	0.474	53%	0.532	S	S	.	.			trans	-66.3	76	173.4	27.3	-33.3	0	0	0	109.3	S201 M203	P199-S201 VanDerWaalsContact C-N 3.28Å; P199-S201 PolarHBondContact O-N 2.89Å; P199-M203 HydrophobicContact CG-SD 4.39Å
200	Q	32.5	Very low	40.8	Very low	108 Å²	108	93.2 Å²	93.2	51%	0.505	51%	0.505	S	S	.	.	H	α-helix	trans	-69.8	-26.8	-167.7	-80.2	-175.9	-9.2	0	0	111.3	W198 K204	W198-Q200 HydrophobicContact CB-CG 4.18Å; W198-Q200 WeakPolarHBondContact O-CG 3.48Å; W198-Q200 PolarHBondContact O-N 2.9Å; Q200-K204 VanDerWaalsContact O-CB 3.25Å; Q200-K204 WeakPolarHBondContact O-CB 3.25Å; Q200-K204 WeakPolarHBondContact O-CG 3.35Å; Q200-K204 PolarHBondContact O-N 3.47Å
201	S	40.6	Very low	43.2	Very low	88 Å²	88	91.6 Å²	91.6	62%	0.615	49%	0.489	S	S	*	.	H	α-helix	trans	-75.3	-50	-173.6	57.6	0	0	0	0	112.8	P199	P199-S201 VanDerWaalsContact C-N 3.28Å; P199-S201 PolarHBondContact O-N 2.89Å
202	K	39.1	Very low	45.8	Very low	143 Å²	143	92.9 Å²	92.9	62%	0.622	48%	0.483	S	S	*	.	H	α-helix	trans	-67.8	-38.9	-179.4	-73.2	-171.7	176.4	-176.2	0	112.2	S206	K202-S206 PolarHBondContact O-N 3.28Å
203	M	44	Very low	48.3	Very low	45 Å²	45	88.4 Å²	88.4	22%	0.222	45%	0.451	C	S	.	.	H	α-helix	trans	-80.8	-35.3	-174.2	-61	-166.1	75.3	0	0	114.2	C162 W198 P199 Q205 S206 L207	C162-M203 WeakPolarHBondContact SG-CE 3.28Å; W198-M203 PolarHBondContact NE1-SD 3.45Å; P199-M203 HydrophobicContact CG-SD 4.39Å; M203-Q205 VanDerWaalsContact C-N 3.3Å; M203-Q205 PolarHBondContact O-N 2.92Å; M203-S206 PolarHBondContact O-N 3.37Å; M203-S206 PolarHBondContact O-OG 3.18Å; M203-S206 VanDerWaalsContact O-OG 3.1Å; M203-L207 WeakPolarHBondContact O-CB 3.34Å; M203-L207 PolarHBondContact O-N 3.03Å
204	K	47.2	Very low	51	Low	129 Å²	129	82.9 Å²	82.9	56%	0.561	42%	0.422	S	S	*	.	H	α-helix	trans	-65	-36.1	177.6	-76.1	-179.7	177.5	-178.2	0	112	Q200 T208	Q200-K204 VanDerWaalsContact O-CB 3.25Å; Q200-K204 WeakPolarHBondContact O-CB 3.25Å; Q200-K204 WeakPolarHBondContact O-CG 3.35Å; Q200-K204 PolarHBondContact O-N 3.47Å; K204-T208 WeakPolarHBondContact O-CG2 3.37Å; K204-T208 PolarHBondContact O-N 3.5Å; K204-T208 PolarHBondContact O-OG1 2.99Å
205	Q	49.5	Very low	53.8	Low	105 Å²	105	80.8 Å²	80.8	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-74.3	-33.1	178	-73.7	-174.4	-8	0	0	113.4	M203 T208 F209	M203-Q205 VanDerWaalsContact C-N 3.3Å; M203-Q205 PolarHBondContact O-N 2.92Å; Q205-T208 WeakPolarHBondContact CA-OG1 3.25Å; Q205-T208 PolarHBondContact O-OG1 3.02Å; Q205-T208 VanDerWaalsContact O-OG1 3.09Å; Q205-F209 WeakPolarHBondContact O-CB 3.39Å; Q205-F209 PolarHBondContact O-N 2.87Å
206	S	64.1	Low	56.8	Low	25 Å²	25	75.5 Å²	75.5	18%	0.175	39%	0.39	C	S	.	.	H	α-helix	trans	-68.9	-41	175.6	65.8	0	0	0	0	111	E158 K202 M203 F209 N210	E158-S206 PolarHBondContact OE2-OG 3.26Å; K202-S206 PolarHBondContact O-N 3.28Å; M203-S206 PolarHBondContact O-N 3.37Å; M203-S206 PolarHBondContact O-OG 3.18Å; M203-S206 VanDerWaalsContact O-OG 3.1Å; S206-F209 PolarHBondContact O-N 2.93Å; S206-N210 WeakPolarHBondContact O-CB 3.25Å; S206-N210 PolarHBondContact O-N 3.35Å; S206-N210 PolarHBondContact O-ND2 2.72Å
207	L	64.2	Low	59.8	Low	63 Å²	63	69.2 Å²	69.2	33%	0.33	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-44.8	-179.6	-176.2	140	0	0	0	112.4	M203 F209 N210 F211	M203-L207 WeakPolarHBondContact O-CB 3.34Å; M203-L207 PolarHBondContact O-N 3.03Å; L207-F209 PolarHBondContact O-N 3.39Å; L207-N210 PolarHBondContact O-N 3.04Å; L207-F211 HydrophobicContact CD2-CD2 3.66Å; L207-F211 HydrophobicContact CD2-CE2 3.48Å; L207-F211 VanDerWaalsContact CD2-CE2 3.48Å; L207-F211 HydrophobicContact CG-CD2 4.01Å; L207-F211 HydrophobicContact CG-CE2 3.8Å; L207-F211 WeakPolarHBondContact O-CD2 3.5Å; L207-F211 PolarHBondContact O-N 2.92Å
208	T	67.9	Low	62.9	Low	88 Å²	88	69 Å²	69	54%	0.54	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-41.8	176	43.1	0	0	0	0	112.7	K204 Q205 F211 F212	K204-T208 WeakPolarHBondContact O-CG2 3.37Å; K204-T208 PolarHBondContact O-N 3.5Å; K204-T208 PolarHBondContact O-OG1 2.99Å; Q205-T208 WeakPolarHBondContact CA-OG1 3.25Å; Q205-T208 PolarHBondContact O-OG1 3.02Å; Q205-T208 VanDerWaalsContact O-OG1 3.09Å; T208-F211 PolarHBondContact O-N 3.44Å; T208-F212 PolarHBondContact O-N 2.83Å; T208-F212 VanDerWaalsContact O-N 3.08Å
209	F	73.9	Confident	65.8	Low	57 Å²	57	69.8 Å²	69.8	25%	0.25	36%	0.362	C	S	.	.	H	α-helix	trans	-63.8	-41.2	174.7	-179	-99.7	0	0	0	112.3	Q205 S206 L207 F212 I213 L320 I321	Q205-F209 WeakPolarHBondContact O-CB 3.39Å; Q205-F209 PolarHBondContact O-N 2.87Å; S206-F209 PolarHBondContact O-N 2.93Å; L207-F209 PolarHBondContact O-N 3.39Å; F209-F212 WeakPolarHBondContact O-CB 3.32Å; F209-F212 PolarHBondContact O-N 3.35Å; F209-I213 HydrophobicContact CD1-CG1 4.34Å; F209-I213 HydrophobicContact CE1-CD1 4.36Å; F209-I213 HydrophobicContact CE1-CG1 3.87Å; F209-I213 HydrophobicContact CE2-CD1 4.38Å; F209-I213 HydrophobicContact CE2-CG1 4.48Å; F209-I213 HydrophobicContact CZ-CD1 3.94Å; F209-I213 HydrophobicContact CZ-CG1 3.95Å; F209-I213 WeakPolarHBondContact O-CG1 3.34Å; F209-I213 PolarHBondContact O-N 2.75Å; F209-L320 HydrophobicContact CE2-CB 4.32Å; F209-L320 HydrophobicContact CE2-CD1 3.95Å; F209-L320 HydrophobicContact CZ-CB 3.69Å; F209-L320 HydrophobicContact CZ-CD1 3.79Å; F209-L320 HydrophobicContact CZ-CG 4.4Å; F209-I321 HydrophobicContact CE1-CG1 4.04Å
210	N	73.9	Confident	68.8	Low	23 Å²	23	67.5 Å²	67.5	12%	0.123	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-44.6	176.9	-70.6	-25.5	0	0	0	111.7	R155 S206 L207 F212 I213 D214	R155-N210 PolarHBondContact NE-OD1 3.18Å; R155-N210 PolarHBondContact NH2-O 3.25Å; S206-N210 WeakPolarHBondContact O-CB 3.25Å; S206-N210 PolarHBondContact O-N 3.35Å; S206-N210 PolarHBondContact O-ND2 2.72Å; L207-N210 PolarHBondContact O-N 3.04Å; N210-F212 VanDerWaalsContact C-N 3.28Å; N210-F212 PolarHBondContact O-N 3.46Å; N210-I213 PolarHBondContact O-N 2.86Å; N210-D214 VanDerWaalsContact O-CG 3.3Å; N210-D214 PolarHBondContact O-N 3.5Å
211	F	76.4	Confident	71.5	Confident	82 Å²	82	62.8 Å²	62.8	36%	0.36	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-38.1	173.9	-87.8	-67.4	0	0	0	113.1	L56 L207 T208 D214 S215	L56-F211 HydrophobicContact CD1-CE1 4.41Å; L56-F211 HydrophobicContact CD1-CE2 4.36Å; L56-F211 HydrophobicContact CD1-CZ 3.55Å; L56-F211 HydrophobicContact CD2-CE2 4.22Å; L56-F211 HydrophobicContact CD2-CZ 3.92Å; L56-F211 HydrophobicContact CG-CZ 3.93Å; L207-F211 HydrophobicContact CD2-CD2 3.66Å; L207-F211 HydrophobicContact CD2-CE2 3.48Å; L207-F211 VanDerWaalsContact CD2-CE2 3.48Å; L207-F211 HydrophobicContact CG-CD2 4.01Å; L207-F211 HydrophobicContact CG-CE2 3.8Å; L207-F211 WeakPolarHBondContact O-CD2 3.5Å; L207-F211 PolarHBondContact O-N 2.92Å; T208-F211 PolarHBondContact O-N 3.44Å; F211-D214 PolarHBondContact O-N 3.31Å; F211-S215 WeakPolarHBondContact O-CB 3.3Å; F211-S215 PolarHBondContact O-N 3.18Å; F211-S215 PolarHBondContact O-OG 2.7Å
212	F	80.2	Confident	73.8	Confident	122 Å²	122	64.7 Å²	64.7	54%	0.535	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-45.7	177.2	177.9	-102.6	0	0	0	111.8	T208 F209 N210 D214 S215 I216	T208-F212 PolarHBondContact O-N 2.83Å; T208-F212 VanDerWaalsContact O-N 3.08Å; F209-F212 WeakPolarHBondContact O-CB 3.32Å; F209-F212 PolarHBondContact O-N 3.35Å; N210-F212 VanDerWaalsContact C-N 3.28Å; N210-F212 PolarHBondContact O-N 3.46Å; F212-D214 VanDerWaalsContact C-N 3.34Å; F212-D214 PolarHBondContact O-N 3.48Å; F212-S215 PolarHBondContact O-N 3.39Å; F212-I216 HydrophobicContact CD1-CD1 3.79Å; F212-I216 HydrophobicContact CD2-CD1 4.48Å; F212-I216 HydrophobicContact CE1-CD1 3.24Å; F212-I216 HydrophobicContact CE1-CG1 4.4Å; F212-I216 HydrophobicContact CE2-CD1 4.02Å; F212-I216 HydrophobicContact CG-CD1 4.39Å; F212-I216 HydrophobicContact CZ-CD1 3.39Å; F212-I216 HydrophobicContact CZ-CG1 4.33Å; F212-I216 WeakPolarHBondContact O-CG1 3.45Å; F212-I216 PolarHBondContact O-N 3.1Å
213	I	82.2	Confident	76.2	Confident	8 Å²	8	60.4 Å²	60.4	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-60.7	-45.1	175.4	-63.5	-58.8	0	0	0	110.5	F209 N210 S215 I216 T217 A317	F209-I213 HydrophobicContact CD1-CG1 4.34Å; F209-I213 HydrophobicContact CE1-CD1 4.36Å; F209-I213 HydrophobicContact CE1-CG1 3.87Å; F209-I213 HydrophobicContact CE2-CD1 4.38Å; F209-I213 HydrophobicContact CE2-CG1 4.48Å; F209-I213 HydrophobicContact CZ-CD1 3.94Å; F209-I213 HydrophobicContact CZ-CG1 3.95Å; F209-I213 WeakPolarHBondContact O-CG1 3.34Å; F209-I213 PolarHBondContact O-N 2.75Å; N210-I213 PolarHBondContact O-N 2.86Å; I213-S215 PolarHBondContact O-N 2.85Å; I213-I216 PolarHBondContact O-N 3.47Å; I213-T217 HydrophobicContact CG2-CG2 4.45Å; I213-T217 WeakPolarHBondContact O-CG2 3.31Å; I213-T217 PolarHBondContact O-N 3.32Å; I213-T217 PolarHBondContact O-OG1 2.86Å; I213-A317 HydrophobicContact CD1-CB 4Å; I213-A317 HydrophobicContact CG1-CB 4.22Å; I213-A317 HydrophobicContact CG2-CB 4.22Å
214	D	82	Confident	78.3	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.064	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-41.8	179.6	-65.3	-11.7	0	0	0	111.7	R155 N210 F211 F212 I216 T217 V218	R155-D214 IonicContact CZ-OD1 2.75Å; R155-D214 VanDerWaalsContact CZ-OD1 3.24Å; R155-D214 IonicContact CZ-OD2 2.61Å; R155-D214 IonicContact NH1-OD1 2.62Å; R155-D214 PolarHBondContact NH1-OD1 3.33Å; R155-D214 IonicContact NH1-OD2 3.79Å; R155-D214 PolarHBondContact NH1-OD2 3.33Å; R155-D214 IonicContact NH2-OD1 3.51Å; R155-D214 PolarHBondContact NH2-OD1 2.9Å; R155-D214 IonicContact NH2-OD2 2.71Å; N210-D214 VanDerWaalsContact O-CG 3.3Å; N210-D214 PolarHBondContact O-N 3.5Å; F211-D214 PolarHBondContact O-N 3.31Å; F212-D214 VanDerWaalsContact C-N 3.34Å; F212-D214 PolarHBondContact O-N 3.48Å; D214-I216 PolarHBondContact O-N 3.31Å; D214-T217 WeakPolarHBondContact CA-OG1 3.43Å; D214-T217 PolarHBondContact O-N 3Å; D214-T217 PolarHBondContact O-OG1 2.8Å; D214-V218 WeakPolarHBondContact O-CG2 3.32Å; D214-V218 PolarHBondContact O-N 2.7Å
215	S	85.1	Confident	80.3	Confident	63 Å²	63	56 Å²	56	44%	0.441	29%	0.289	S	S	.	.	H	α-helix	trans	-60	-45.3	176.1	-56.7	0	0	0	0	111.5	F211 F212 I213 T217 V218 I219	F211-S215 WeakPolarHBondContact O-CB 3.3Å; F211-S215 PolarHBondContact O-N 3.18Å; F211-S215 PolarHBondContact O-OG 2.7Å; F212-S215 PolarHBondContact O-N 3.39Å; I213-S215 PolarHBondContact O-N 2.85Å; S215-T217 PolarHBondContact O-N 3.07Å; S215-V218 PolarHBondContact O-N 3.41Å; S215-I219 WeakPolarHBondContact O-CD1 3.37Å; S215-I219 WeakPolarHBondContact O-CG1 3.39Å; S215-I219 PolarHBondContact O-N 3.01Å
216	I	87.5	Confident	82	Confident	53 Å²	53	55.3 Å²	55.3	27%	0.272	29%	0.288	S	S	.	.	H	α-helix	trans	-61	-46.1	175.3	-71.2	172.6	0	0	0	110.5	F212 I213 D214 V218 I219 V220 I313	F212-I216 HydrophobicContact CD1-CD1 3.79Å; F212-I216 HydrophobicContact CD2-CD1 4.48Å; F212-I216 HydrophobicContact CE1-CD1 3.24Å; F212-I216 HydrophobicContact CE1-CG1 4.4Å; F212-I216 HydrophobicContact CE2-CD1 4.02Å; F212-I216 HydrophobicContact CG-CD1 4.39Å; F212-I216 HydrophobicContact CZ-CD1 3.39Å; F212-I216 HydrophobicContact CZ-CG1 4.33Å; F212-I216 WeakPolarHBondContact O-CG1 3.45Å; F212-I216 PolarHBondContact O-N 3.1Å; I213-I216 PolarHBondContact O-N 3.47Å; D214-I216 PolarHBondContact O-N 3.31Å; I216-V218 VanDerWaalsContact C-N 3.3Å; I216-V218 PolarHBondContact O-N 2.87Å; I216-I219 PolarHBondContact O-N 3.43Å; I216-V220 HydrophobicContact CG2-CG2 4.2Å; I216-V220 WeakPolarHBondContact O-CB 3.46Å; I216-V220 VanDerWaalsContact O-CG2 3.28Å; I216-V220 WeakPolarHBondContact O-CG2 3.35Å; I216-V220 PolarHBondContact O-N 3.02Å; I216-I313 HydrophobicContact CG2-CD1 4.11Å; I216-I313 HydrophobicContact CG2-CG1 4.47Å; I216-I313 HydrophobicContact CG2-CG2 4.35Å
217	T	86.7	Confident	83.1	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-39	-179.7	60.9	0	0	0	0	112.2	I213 D214 S215 T221 I313	I213-T217 HydrophobicContact CG2-CG2 4.45Å; I213-T217 WeakPolarHBondContact O-CG2 3.31Å; I213-T217 PolarHBondContact O-N 3.32Å; I213-T217 PolarHBondContact O-OG1 2.86Å; D214-T217 WeakPolarHBondContact CA-OG1 3.43Å; D214-T217 PolarHBondContact O-N 3Å; D214-T217 PolarHBondContact O-OG1 2.8Å; S215-T217 PolarHBondContact O-N 3.07Å; T217-T221 WeakPolarHBondContact O-CG2 3.44Å; T217-T221 PolarHBondContact O-N 3.39Å; T217-T221 PolarHBondContact O-OG1 3.27Å; T217-I313 HydrophobicContact CG2-CG2 3.93Å
218	V	87.6	Confident	84	Confident	70 Å²	70	55.1 Å²	55.1	42%	0.424	28%	0.284	S	S	.	.	H	α-helix	trans	-69	-41.1	177.1	173.4	0	0	0	0	111.7	T63 D214 S215 I216 V220 T221 F222	T63-V218 HydrophobicContact CG2-CG2 3.99Å; D214-V218 WeakPolarHBondContact O-CG2 3.32Å; D214-V218 PolarHBondContact O-N 2.7Å; S215-V218 PolarHBondContact O-N 3.41Å; I216-V218 VanDerWaalsContact C-N 3.3Å; I216-V218 PolarHBondContact O-N 2.87Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 2.94Å; V218-T221 WeakPolarHBondContact CA-OG1 3.17Å; V218-T221 PolarHBondContact O-N 3.39Å; V218-T221 PolarHBondContact O-OG1 2.82Å; V218-F222 WeakPolarHBondContact O-CB 3.21Å; V218-F222 PolarHBondContact O-N 3.01Å
219	I	89.2	Confident	84.6	Confident	107 Å²	107	55 Å²	55	55%	0.549	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-43.1	177.4	-69.1	164.1	0	0	0	110.7	S215 I216 F222 S223	S215-I219 WeakPolarHBondContact O-CD1 3.37Å; S215-I219 WeakPolarHBondContact O-CG1 3.39Å; S215-I219 PolarHBondContact O-N 3.01Å; I216-I219 PolarHBondContact O-N 3.43Å; I219-F222 PolarHBondContact O-N 3.5Å; I219-S223 WeakPolarHBondContact O-CB 3.32Å; I219-S223 PolarHBondContact O-N 2.81Å; I219-S223 PolarHBondContact O-OG 3.36Å
220	V	90.3	Very high	85	Confident	26 Å²	26	56.2 Å²	56.2	16%	0.158	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-47	178.5	170.9	0	0	0	0	110.4	I216 V218 F222 S223 F224 V309 I313	I216-V220 HydrophobicContact CG2-CG2 4.2Å; I216-V220 WeakPolarHBondContact O-CB 3.46Å; I216-V220 VanDerWaalsContact O-CG2 3.28Å; I216-V220 WeakPolarHBondContact O-CG2 3.35Å; I216-V220 PolarHBondContact O-N 3.02Å; V218-V220 VanDerWaalsContact C-N 3.34Å; V218-V220 PolarHBondContact O-N 2.94Å; V220-F222 VanDerWaalsContact C-N 3.31Å; V220-F222 PolarHBondContact O-N 2.64Å; V220-S223 PolarHBondContact O-N 3.26Å; V220-S223 VanDerWaalsContact O-N 3.15Å; V220-F224 HydrophobicContact CG1-CD2 3.84Å; V220-F224 HydrophobicContact CG1-CE2 3.8Å; V220-F224 WeakPolarHBondContact O-CD2 3.4Å; V220-F224 PolarHBondContact O-N 2.97Å; V220-F224 VanDerWaalsContact O-N 3.08Å; V220-V309 HydrophobicContact CG1-CG1 3.71Å; V220-I313 HydrophobicContact CB-CD1 4.25Å; V220-I313 HydrophobicContact CG1-CD1 4.18Å; V220-I313 HydrophobicContact CG2-CD1 3.87Å
221	T	89	Confident	85.2	Confident	9 Å²	9	59 Å²	59	6%	0.055	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-46.4	176.7	53.6	0	0	0	0	111.7	T67 T217 V218 S223 F224 W225 F306 H310	T67-T221 HydrophobicContact CG2-CG2 3.69Å; T217-T221 WeakPolarHBondContact O-CG2 3.44Å; T217-T221 PolarHBondContact O-N 3.39Å; T217-T221 PolarHBondContact O-OG1 3.27Å; V218-T221 WeakPolarHBondContact CA-OG1 3.17Å; V218-T221 PolarHBondContact O-N 3.39Å; V218-T221 PolarHBondContact O-OG1 2.82Å; T221-S223 VanDerWaalsContact C-N 3.32Å; T221-S223 PolarHBondContact O-N 3.07Å; T221-F224 PolarHBondContact O-N 3.21Å; T221-W225 PolarHBondContact O-N 3.43Å; T221-W225 VanDerWaalsContact O-N 3.09Å; T221-F306 HydrophobicContact CG2-CE2 3.9Å; T221-F306 HydrophobicContact CG2-CZ 3.89Å; T221-H310 VanDerWaalsContact CG2-CE1 3.5Å; T221-H310 WeakPolarHBondContact CG2-CE1 3.35Å; T221-H310 VanDerWaalsContact CG2-NE2 3.29Å; T221-H310 WeakPolarHBondContact CG2-NE2 3.47Å
222	F	89.2	Confident	85.2	Confident	128 Å²	128	57.2 Å²	57.2	56%	0.561	30%	0.298	S	S	*	.	H	α-helix	trans	-60.5	-40.7	178.1	-176.4	-106.4	0	0	0	112.5	V218 I219 V220 F224 W225 L226	V218-F222 WeakPolarHBondContact O-CB 3.21Å; V218-F222 PolarHBondContact O-N 3.01Å; I219-F222 PolarHBondContact O-N 3.5Å; V220-F222 VanDerWaalsContact C-N 3.31Å; V220-F222 PolarHBondContact O-N 2.64Å; F222-F224 PolarHBondContact O-N 2.71Å; F222-W225 PolarHBondContact O-N 3.48Å; F222-L226 HydrophobicContact CD1-CD1 3.95Å; F222-L226 HydrophobicContact CD1-CG 4.34Å; F222-L226 HydrophobicContact CE1-CD1 3.46Å; F222-L226 VanDerWaalsContact CE1-CD1 3.46Å; F222-L226 HydrophobicContact CE1-CD2 4.4Å; F222-L226 HydrophobicContact CE1-CG 3.97Å; F222-L226 HydrophobicContact CZ-CD1 3.99Å; F222-L226 HydrophobicContact CZ-CD2 4.09Å; F222-L226 HydrophobicContact CZ-CG 4.11Å; F222-L226 WeakPolarHBondContact O-CG 3.33Å; F222-L226 PolarHBondContact O-N 3.41Å
223	S	89.5	Confident	84.9	Confident	52 Å²	52	58.2 Å²	58.2	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-43	178.4	-57.6	0	0	0	0	112.1	I219 V220 T221 L226 I227	I219-S223 WeakPolarHBondContact O-CB 3.32Å; I219-S223 PolarHBondContact O-N 2.81Å; I219-S223 PolarHBondContact O-OG 3.36Å; V220-S223 PolarHBondContact O-N 3.26Å; V220-S223 VanDerWaalsContact O-N 3.15Å; T221-S223 VanDerWaalsContact C-N 3.32Å; T221-S223 PolarHBondContact O-N 3.07Å; S223-L226 PolarHBondContact O-N 3.38Å; S223-I227 WeakPolarHBondContact O-CG1 3.03Å; S223-I227 PolarHBondContact O-N 3.45Å
224	F	89.4	Confident	84.4	Confident	26 Å²	26	61.5 Å²	61.5	11%	0.114	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-38.3	175.6	-86.8	-85.4	0	0	0	112.6	V220 T221 F222 L226 I227 F228 L302 D305 F306 V309	V220-F224 HydrophobicContact CG1-CD2 3.84Å; V220-F224 HydrophobicContact CG1-CE2 3.8Å; V220-F224 WeakPolarHBondContact O-CD2 3.4Å; V220-F224 PolarHBondContact O-N 2.97Å; V220-F224 VanDerWaalsContact O-N 3.08Å; T221-F224 PolarHBondContact O-N 3.21Å; F222-F224 PolarHBondContact O-N 2.71Å; F224-L226 VanDerWaalsContact C-N 3.35Å; F224-I227 PolarHBondContact O-N 2.87Å; F224-F228 WeakPolarHBondContact O-CB 3.35Å; F224-F228 PolarHBondContact O-N 3.11Å; F224-L302 HydrophobicContact CD1-CD1 3.68Å; F224-L302 HydrophobicContact CD1-CG 4.09Å; F224-L302 HydrophobicContact CE1-CD1 3.93Å; F224-D305 HydrophobicContact CE1-CB 4.19Å; F224-F306 HydrophobicContact CB-CD2 3.72Å; F224-F306 HydrophobicContact CB-CE2 4.32Å; F224-F306 HydrophobicContact CD1-CB 3.95Å; F224-F306 HydrophobicContact CD1-CD2 4.15Å; F224-F306 AromaticContact CD2-CD2 3.84Å; F224-F306 HydrophobicContact CD2-CD2 3.84Å; F224-F306 HydrophobicContact CE1-CB 4.02Å; F224-F306 HydrophobicContact CE2-CD2 4.5Å; F224-F306 HydrophobicContact CG-CB 4.3Å; F224-F306 AromaticContact CG-CD2 3.65Å; F224-F306 HydrophobicContact CG-CD2 3.65Å; F224-F306 HydrophobicContact CG-CG 4.48Å; F224-F306 HydrophobicContact CZ-CB 4.44Å; F224-V309 HydrophobicContact CE2-CB 4.09Å; F224-V309 HydrophobicContact CE2-CG1 4.29Å; F224-V309 HydrophobicContact CE2-CG2 4.14Å; F224-V309 HydrophobicContact CZ-CB 4.23Å; F224-V309 HydrophobicContact CZ-CG2 3.88Å
225	W	87.6	Confident	83.6	Confident	57 Å²	57	62.4 Å²	62.4	22%	0.216	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-39.8	173.6	-83.6	107.6	0	0	0	112.5	L73 I74 L77 T221 F222 F228 L229	L73-W225 HydrophobicContact CB-CH2 3.76Å; L73-W225 HydrophobicContact CB-CZ2 4.05Å; L73-W225 HydrophobicContact CD1-CH2 4.35Å; L73-W225 HydrophobicContact CD1-CZ2 4.18Å; I74-W225 HydrophobicContact CG1-CH2 4.35Å; I74-W225 HydrophobicContact CG1-CZ2 4.46Å; L77-W225 HydrophobicContact CD1-CH2 3.84Å; L77-W225 HydrophobicContact CD1-CZ3 3.62Å; T221-W225 PolarHBondContact O-N 3.43Å; T221-W225 VanDerWaalsContact O-N 3.09Å; F222-W225 PolarHBondContact O-N 3.48Å; W225-F228 HydrophobicContact CE3-CD1 4.42Å; W225-F228 HydrophobicContact CZ3-CD1 4.35Å; W225-F228 PolarHBondContact O-N 3.26Å; W225-L229 WeakPolarHBondContact O-CB 3.38Å; W225-L229 VanDerWaalsContact O-CG 3.24Å; W225-L229 WeakPolarHBondContact O-CG 3.39Å; W225-L229 PolarHBondContact O-N 2.7Å
226	L	85.4	Confident	82.4	Confident	89 Å²	89	61.6 Å²	61.6	47%	0.466	32%	0.32	S	S	.	.	H	α-helix	trans	-64.2	-42.6	174.8	-71.1	-179.8	0	0	0	112.2	F222 S223 F224 L229 S230	F222-L226 HydrophobicContact CD1-CD1 3.95Å; F222-L226 HydrophobicContact CD1-CG 4.34Å; F222-L226 HydrophobicContact CE1-CD1 3.46Å; F222-L226 VanDerWaalsContact CE1-CD1 3.46Å; F222-L226 HydrophobicContact CE1-CD2 4.4Å; F222-L226 HydrophobicContact CE1-CG 3.97Å; F222-L226 HydrophobicContact CZ-CD1 3.99Å; F222-L226 HydrophobicContact CZ-CD2 4.09Å; F222-L226 HydrophobicContact CZ-CG 4.11Å; F222-L226 WeakPolarHBondContact O-CG 3.33Å; F222-L226 PolarHBondContact O-N 3.41Å; S223-L226 PolarHBondContact O-N 3.38Å; F224-L226 VanDerWaalsContact C-N 3.35Å; L226-L229 PolarHBondContact O-N 2.88Å; L226-S230 WeakPolarHBondContact O-CB 3.44Å; L226-S230 PolarHBondContact O-N 3.44Å
227	I	86.8	Confident	80.9	Confident	79 Å²	79	64 Å²	64	41%	0.405	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-46.3	176.2	-66.8	164.6	0	0	0	110.2	S223 F224 S230 H231 L302	S223-I227 WeakPolarHBondContact O-CG1 3.03Å; S223-I227 PolarHBondContact O-N 3.45Å; F224-I227 PolarHBondContact O-N 2.87Å; I227-S230 WeakPolarHBondContact O-CB 3.32Å; I227-S230 PolarHBondContact O-N 2.9Å; I227-H231 PolarHBondContact O-CD2 3.43Å; I227-H231 PolarHBondContact O-N 3.24Å; I227-L302 HydrophobicContact CG2-CD1 3.88Å; I227-L302 HydrophobicContact CG2-CD2 4.46Å
228	F	83.9	Confident	79.4	Confident	5 Å²	5	66 Å²	66	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-60	-48.2	177.2	-178.5	-103.4	0	0	0	112.1	I74 L77 F224 W225 S230 H231 W232 A299 L302	I74-F228 HydrophobicContact CG1-CG 4.49Å; I74-F228 HydrophobicContact CG2-CD2 3.77Å; I74-F228 HydrophobicContact CG2-CE2 3.84Å; I74-F228 HydrophobicContact CG2-CG 4.44Å; L77-F228 HydrophobicContact CB-CE1 4.02Å; L77-F228 HydrophobicContact CB-CZ 3.88Å; L77-F228 HydrophobicContact CD1-CD1 4.42Å; L77-F228 HydrophobicContact CD1-CE1 3.64Å; L77-F228 HydrophobicContact CD1-CZ 4.24Å; L77-F228 HydrophobicContact CG-CE1 4.42Å; F224-F228 WeakPolarHBondContact O-CB 3.35Å; F224-F228 PolarHBondContact O-N 3.11Å; W225-F228 HydrophobicContact CE3-CD1 4.42Å; W225-F228 HydrophobicContact CZ3-CD1 4.35Å; W225-F228 PolarHBondContact O-N 3.26Å; F228-S230 VanDerWaalsContact C-N 3.29Å; F228-S230 PolarHBondContact O-N 3.08Å; F228-H231 PolarHBondContact O-N 2.68Å; F228-W232 WeakPolarHBondContact O-CB 3.23Å; F228-W232 PolarHBondContact O-N 2.83Å; F228-A299 HydrophobicContact CE2-CB 4.12Å; F228-L302 HydrophobicContact CB-CD2 3.64Å; F228-L302 HydrophobicContact CD2-CD2 3.89Å; F228-L302 HydrophobicContact CG-CD2 4.25Å
229	L	81.6	Confident	77.7	Confident	86 Å²	86	65.8 Å²	65.8	45%	0.45	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-33.4	178.6	-71.9	170.6	0	0	0	112.3	W225 L226 W232 K233	W225-L229 WeakPolarHBondContact O-CB 3.38Å; W225-L229 VanDerWaalsContact O-CG 3.24Å; W225-L229 WeakPolarHBondContact O-CG 3.39Å; W225-L229 PolarHBondContact O-N 2.7Å; L226-L229 PolarHBondContact O-N 2.88Å; L229-W232 HydrophobicContact CD2-CE3 4.49Å; L229-W232 PolarHBondContact O-N 3.14Å; L229-K233 WeakPolarHBondContact O-CB 3.26Å; L229-K233 PolarHBondContact O-N 3.11Å
230	S	81.8	Confident	75.7	Confident	82 Å²	82	64.9 Å²	64.9	57%	0.573	34%	0.344	S	S	*	.	H	α-helix	trans	-64	-47	174.4	-172.1	0	0	0	0	111.6	L226 I227 F228 K233 S234	L226-S230 WeakPolarHBondContact O-CB 3.44Å; L226-S230 PolarHBondContact O-N 3.44Å; I227-S230 WeakPolarHBondContact O-CB 3.32Å; I227-S230 PolarHBondContact O-N 2.9Å; F228-S230 VanDerWaalsContact C-N 3.29Å; F228-S230 PolarHBondContact O-N 3.08Å; S230-K233 PolarHBondContact O-N 2.64Å; S230-S234 PolarHBondContact O-N 3.03Å; S230-S234 VanDerWaalsContact O-N 3.1Å
231	H	78.4	Confident	73.3	Confident	83 Å²	83	70.1 Å²	70.1	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-41.8	175	-80.3	-68	0	0	0	111.9	I227 F228 K233 S234 D235	I227-H231 PolarHBondContact O-CD2 3.43Å; I227-H231 PolarHBondContact O-N 3.24Å; F228-H231 PolarHBondContact O-N 2.68Å; H231-K233 PolarHBondContact O-N 2.65Å; H231-S234 PolarHBondContact O-N 3.11Å; H231-D235 PolarHBondContact O-N 3.23Å
232	W	75.1	Confident	70.8	Confident	44 Å²	44	75.2 Å²	75.2	17%	0.167	40%	0.403	C	S	.	.	H	α-helix	trans	-66.2	-36.2	179.8	-163.1	56.1	0	0	0	113.1	F228 L229 K236	F228-W232 WeakPolarHBondContact O-CB 3.23Å; F228-W232 PolarHBondContact O-N 2.83Å; L229-W232 HydrophobicContact CD2-CE3 4.49Å; L229-W232 PolarHBondContact O-N 3.14Å; W232-K236 VanDerWaalsContact CH2-NZ 3.29Å; W232-K236 VanDerWaalsContact CZ2-CE 3.49Å; W232-K236 PolarHBondContact O-N 3.23Å
233	K	75.5	Confident	68.1	Low	143 Å²	143	76.2 Å²	76.2	62%	0.622	42%	0.415	S	S	*	.	H	α-helix	trans	-67.3	-47	174.5	-173	176.6	179.1	-177.4	0	111.3	L229 S230 H231 D235 K236 D237	L229-K233 WeakPolarHBondContact O-CB 3.26Å; L229-K233 PolarHBondContact O-N 3.11Å; S230-K233 PolarHBondContact O-N 2.64Å; H231-K233 PolarHBondContact O-N 2.65Å; K233-D235 VanDerWaalsContact C-N 3.3Å; K233-D235 PolarHBondContact O-N 2.85Å; K233-K236 PolarHBondContact O-N 3.29Å; K233-D237 PolarHBondContact O-N 3.36Å
234	S	71.7	Confident	65.8	Low	76 Å²	76	81.7 Å²	81.7	53%	0.531	44%	0.44	S	S	.	.	H	α-helix	trans	-59.6	-39.5	178.3	-169.4	0	0	0	0	112.4	S230 H231 A238	S230-S234 PolarHBondContact O-N 3.03Å; S230-S234 VanDerWaalsContact O-N 3.1Å; H231-S234 PolarHBondContact O-N 3.11Å; S234-A238 PolarHBondContact O-N 3.46Å
235	D	64.7	Low	63.1	Low	31 Å²	31	85.2 Å²	85.2	17%	0.166	47%	0.468	C	S	.	.	H	α-helix	trans	-76.3	-30.2	177.8	-84.6	-9.5	0	0	0	112.7	H231 K233 D237 A238 M239	H231-D235 PolarHBondContact O-N 3.23Å; K233-D235 VanDerWaalsContact C-N 3.3Å; K233-D235 PolarHBondContact O-N 2.85Å; D235-D237 VanDerWaalsContact C-N 3.34Å; D235-A238 CarbonylContact O-C 3.52Å; D235-A238 PolarHBondContact O-N 2.87Å; D235-M239 WeakPolarHBondContact O-CB 3.5Å; D235-M239 PolarHBondContact O-N 2.7Å
236	K	58.6	Low	60.5	Low	47 Å²	47	90.6 Å²	90.6	20%	0.204	50%	0.501	C	S	.	.	H	α-helix	trans	-60.9	-45.8	170	-88.6	-166.5	179.5	-179.2	0	111	W232 K233 A238 M239 T240	W232-K236 VanDerWaalsContact CH2-NZ 3.29Å; W232-K236 VanDerWaalsContact CZ2-CE 3.49Å; W232-K236 PolarHBondContact O-N 3.23Å; K233-K236 PolarHBondContact O-N 3.29Å; K236-A238 PolarHBondContact O-N 2.8Å; K236-M239 PolarHBondContact O-N 3Å; K236-M239 VanDerWaalsContact O-N 3.12Å; K236-T240 WeakPolarHBondContact O-CG2 3.49Å; K236-T240 PolarHBondContact O-N 3.36Å; K236-T240 PolarHBondContact O-OG1 2.71Å
237	D	57.3	Low	57.9	Low	103 Å²	103	95.3 Å²	95.3	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-29.9	176.7	-63	-25.4	0	0	0	111.2	K233 D235 T240	K233-D237 PolarHBondContact O-N 3.36Å; D235-D237 VanDerWaalsContact C-N 3.34Å; D237-T240 WeakPolarHBondContact CA-OG1 3.5Å; D237-T240 VanDerWaalsContact O-O 3.06Å; D237-T240 PolarHBondContact O-OG1 3.25Å; D237-T240 VanDerWaalsContact O-OG1 3.11Å
238	A	55.5	Low	55.1	Low	42 Å²	42	97 Å²	97	35%	0.347	54%	0.539	S	S	.	.	H	α-helix	trans	-83	-25.8	174.3	0	0	0	0	0	115	S234 D235 K236 Y287	S234-A238 PolarHBondContact O-N 3.46Å; D235-A238 CarbonylContact O-C 3.52Å; D235-A238 PolarHBondContact O-N 2.87Å; K236-A238 PolarHBondContact O-N 2.8Å; A238-Y287 PolarHBondContact O-OH 2.97Å
239	M	51.8	Low	52.5	Low	67 Å²	67	104.9 Å²	104.9	33%	0.33	58%	0.581	S	S	.	*	H	α-helix	trans	-82.7	-31.6	174.9	-88	-174.9	164.4	0	0	111.9	D235 K236 L241 I288 Q291 L292	D235-M239 WeakPolarHBondContact O-CB 3.5Å; D235-M239 PolarHBondContact O-N 2.7Å; K236-M239 PolarHBondContact O-N 3Å; K236-M239 VanDerWaalsContact O-N 3.12Å; M239-L241 PolarHBondContact O-N 2.8Å; M239-L241 VanDerWaalsContact O-N 3.08Å; M239-I288 HydrophobicContact CE-CG2 4.35Å; M239-Q291 HydrophobicContact CE-CB 3.77Å; M239-Q291 HydrophobicContact CG-CB 4.3Å; M239-L292 HydrophobicContact CE-CB 4.26Å
240	T	46.4	Very low	49.7	Very low	87 Å²	87	108.3 Å²	108.3	53%	0.534	60%	0.599	S	S	.	*	S	Bend	trans	-72.7	96.1	164.9	54	0	0	0	0	107.2	K236 D237	K236-T240 WeakPolarHBondContact O-CG2 3.49Å; K236-T240 PolarHBondContact O-N 3.36Å; K236-T240 PolarHBondContact O-OG1 2.71Å; D237-T240 WeakPolarHBondContact CA-OG1 3.5Å; D237-T240 VanDerWaalsContact O-O 3.06Å; D237-T240 PolarHBondContact O-OG1 3.25Å; D237-T240 VanDerWaalsContact O-OG1 3.11Å
241	L	40.7	Very low	47.2	Very low	136 Å²	136	114.6 Å²	114.6	71%	0.712	61%	0.612	S	S	*	*			trans	-45	131.2	168.2	-147.6	86.1	0	0	0	108.3	M239 N243	M239-L241 PolarHBondContact O-N 2.8Å; M239-L241 VanDerWaalsContact O-N 3.08Å; L241-N243 PolarHBondContact O-N 3.34Å
242	P	35.6	Very low	44.7	Very low	116 Å²	116	121 Å²	121	75%	0.753	64%	0.639	S	S	*	*			trans	-56.6	113.8	180	-20.9	30.4	0	0	0	108.8	D244	P242-D244 PolarHBondContact O-N 3.06Å
243	N	32.8	Very low	42.6	Very low	149 Å²	149	123.5 Å²	123.5	80%	0.797	66%	0.663	S	S	*	*			trans	-60.4	117.7	163.6	-83.5	-14.8	0	0	0	106.7	L241 S245	L241-N243 PolarHBondContact O-N 3.34Å; N243-S245 PolarHBondContact O-N 2.63Å; N243-S245 VanDerWaalsContact O-N 3.15Å
244	D	41	Very low	40.2	Very low	167 Å²	167	126.3 Å²	126.3	89%	0.893	68%	0.675	S	S	*	*	S	Bend	trans	8.2	90.3	162.8	-64.5	-36.3	0	0	0	115.9	P242	P242-D244 PolarHBondContact O-N 3.06Å
245	S	32.5	Very low	38.3	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	69%	0.69	S	S	*	*			trans	-158.1	94.6	152.4	43.1	0	0	0	0	110.9	N243 E247	N243-S245 PolarHBondContact O-N 2.63Å; N243-S245 VanDerWaalsContact O-N 3.15Å; S245-E247 PolarHBondContact O-N 3.05Å
246	N	34.5	Very low	36.6	Very low	169 Å²	169	133.9 Å²	133.9	90%	0.904	73%	0.726	S	S	*	*			trans	34.4	73.2	147.7	-61.4	-14.8	0	0	0	117.8
247	E	30.9	Very low	35.2	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.883	75%	0.745	S	S	*	*			trans	-144.7	122.4	142.9	-123.3	173.1	-168.4	0	0	110.2	S245 L249	S245-E247 PolarHBondContact O-N 3.05Å; E247-L249 PolarHBondContact O-N 3.44Å
248	S	26.5	Very low	33.8	Very low	113 Å²	113	137.4 Å²	137.4	79%	0.79	75%	0.75	S	S	*	*			trans	-67.4	84.8	-168.9	53.1	0	0	0	0	112
249	L	29	Very low	32.5	Very low	171 Å²	171	144.1 Å²	144.1	90%	0.895	78%	0.779	S	S	*	*			trans	-105.4	105	155.5	-90.7	160.5	0	0	0	108.4	E247 Y251	E247-L249 PolarHBondContact O-N 3.44Å; L249-Y251 VanDerWaalsContact C-N 3.34Å; L249-Y251 PolarHBondContact O-N 2.73Å
250	N	24	Very low	31.2	Very low	158 Å²	158	147.5 Å²	147.5	85%	0.845	79%	0.794	S	S	*	*			trans	-50.8	86	179.6	-80.4	-43.2	0	0	0	112.4
251	Y	28.9	Very low	30.3	Very low	215 Å²	215	151.1 Å²	151.1	84%	0.843	80%	0.804	S	S	*	*			trans	-130.5	107.2	149.1	-117.6	-91.2	0	0	0	109.4	L249 S253	L249-Y251 VanDerWaalsContact C-N 3.34Å; L249-Y251 PolarHBondContact O-N 2.73Å; Y251-S253 PolarHBondContact O-N 3.15Å
252	K	26.8	Very low	29.6	Very low	216 Å²	216	151.6 Å²	151.6	94%	0.939	81%	0.813	S	S	*	*			trans	-75.8	81.6	-173	-158.4	179	-167.9	176.4	0	108.8
253	S	29.8	Very low	29.1	Very low	98 Å²	98	151.5 Å²	151.5	69%	0.685	81%	0.81	S	S	*	*			trans	-131.4	108.3	170.7	55.5	0	0	0	0	110.5	Y251	Y251-S253 PolarHBondContact O-N 3.15Å
254	K	26.2	Very low	28.8	Very low	201 Å²	201	152.4 Å²	152.4	87%	0.874	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-61.9	141.2	175.2	-68.7	179.8	173.7	-174.8	0	110.6
255	P	30.8	Very low	28.3	Very low	130 Å²	130	149 Å²	149	84%	0.844	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-77.1	133.9	-176	30.2	-32.2	0	0	0	111.5
256	C	28.9	Very low	28	Very low	137 Å²	137	150.5 Å²	150.5	93%	0.926	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.8	120.6	177.7	-107.1	0	0	0	0	110.5
257	G	29	Very low	27.7	Very low	57 Å²	57	149 Å²	149	59%	0.588	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78.7	142.2	177.8	0	0	0	0	0	114.7
258	Y	28.3	Very low	28.2	Very low	167 Å²	167	145 Å²	145	66%	0.655	78%	0.783	S	S	*	*			trans	-3.4	123.5	153.3	-79.4	-98.7	0	0	0	119.7
259	L	27.6	Very low	28.6	Very low	182 Å²	182	148.4 Å²	148.4	95%	0.953	78%	0.784	S	S	*	*			trans	-105.7	106.2	152.4	-92	158.5	0	0	0	108.4
260	Q	25.4	Very low	28.7	Very low	139 Å²	139	143.4 Å²	143.4	65%	0.65	78%	0.775	S	S	*	*			trans	-104	136.1	164	-103.5	-180	-22.1	0	0	108.8
261	H	26.8	Very low	29	Very low	163 Å²	163	144.9 Å²	144.9	76%	0.755	78%	0.776	S	S	*	*			trans	55.1	99.9	154.8	-76.3	-83	0	0	0	119.1
262	T	26.1	Very low	29.2	Very low	146 Å²	146	146.2 Å²	146.2	90%	0.896	78%	0.78	S	S	*	*			trans	-143.4	119.6	131	40.3	0	0	0	0	110.4
263	V	25.8	Very low	29.5	Very low	113 Å²	113	143.5 Å²	143.5	69%	0.685	78%	0.775	S	S	*	*			trans	-49.7	141	158.8	178.3	0	0	0	0	109.5
264	Q	25.2	Very low	30.3	Very low	168 Å²	168	145 Å²	145	79%	0.785	78%	0.783	S	S	*	*				162.6	144.2	127	-80.4	-59.3	-16.1	0	0	110.1
265	P	32.5	Very low	30.6	Very low	95 Å²	95	138.8 Å²	138.8	62%	0.617	78%	0.776	S	S	*	*			trans	-84.5	154.1	-170.8	35.8	-32.3	0	0	0	112.3
266	T	25.2	Very low	31.2	Very low	133 Å²	133	136 Å²	136	82%	0.816	77%	0.77	S	S	*	*			trans	48.7	101	152	58.3	0	0	0	0	117.9
267	N	28.2	Very low	31.9	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	75%	0.752	S	S	*	*			trans	-127.6	110.8	141.4	-162.7	-4.9	0	0	0	108.7	F269	N267-F269 VanDerWaalsContact C-N 3.28Å; N267-F269 PolarHBondContact O-N 3.3Å
268	P	42.1	Very low	32.9	Very low	104 Å²	104	136 Å²	136	68%	0.675	75%	0.754	S	S	*	*	S	Bend	trans	-81.7	5.2	-171.2	31.2	-32.7	0	0	0	114.7
269	F	33.3	Very low	33.8	Very low	185 Å²	185	133.7 Å²	133.7	81%	0.811	75%	0.752	S	S	*	*			trans	-137	80.5	175.9	-61.4	-76.4	0	0	0	111	N267	N267-F269 VanDerWaalsContact C-N 3.28Å; N267-F269 PolarHBondContact O-N 3.3Å
270	G	31	Very low	35	Very low	67 Å²	67	129.4 Å²	129.4	69%	0.691	74%	0.736	S	S	*	*			trans	-139.1	115	171.2	0	0	0	0	0	109.4
271	H	30.8	Very low	36.8	Very low	189 Å²	189	127.5 Å²	127.5	88%	0.875	73%	0.731	S	S	*	*			trans	-54.8	137	-176	-77.1	-90.4	0	0	0	112.7	D273	H271-D273 PolarHBondContact O-N 3Å
272	R	32.5	Very low	38.8	Very low	243 Å²	243	125 Å²	125	92%	0.917	72%	0.72	S	S	*	*			trans	-58.9	112.7	170.1	-87.1	178.5	175.3	167.5	-1.3	109.8	P274	R272-P274 WeakPolarHBondContact O-CD 3.43Å
273	D	34.2	Very low	40.9	Very low	158 Å²	158	121.9 Å²	121.9	85%	0.845	70%	0.7	S	S	*	*			trans	-80.8	118.3	155.5	-74.4	-31.7	0	0	0	109	H271 G275	H271-D273 PolarHBondContact O-N 3Å; D273-G275 PolarHBondContact O-N 3.27Å
274	P	45.5	Very low	42.9	Very low	131 Å²	131	123.1 Å²	123.1	85%	0.851	70%	0.696	S	S	*	*			trans	-90.1	98.7	175.7	32.7	-24.8	0	0	0	108.6	R272	R272-P274 WeakPolarHBondContact O-CD 3.43Å
275	G	33.8	Very low	44.9	Very low	70 Å²	70	123.9 Å²	123.9	72%	0.722	69%	0.692	S	S	*	*			trans	-154.9	94.3	-175.6	0	0	0	0	0	115.1	D273 S277	D273-G275 PolarHBondContact O-N 3.27Å; G275-S277 PolarHBondContact O-N 2.74Å
276	G	42.6	Very low	46.7	Very low	70 Å²	70	124 Å²	124	72%	0.722	69%	0.687	S	S	*	*	S	Bend	trans	93.2	-26.1	141.2	0	0	0	0	0	120
277	S	44.9	Very low	49.1	Very low	79 Å²	79	122.2 Å²	122.2	55%	0.552	67%	0.665	S	S	*	*	H	α-helix	trans	-76.3	-32	178.6	56.9	0	0	0	0	113.2	G275 L279	G275-S277 PolarHBondContact O-N 2.74Å; S277-L279 PolarHBondContact O-N 3.39Å
278	N	48.9	Very low	51.2	Low	117 Å²	117	118.9 Å²	118.9	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-74.6	-22.4	-170.3	-66.3	-3	0	0	0	113.8	E282	N278-E282 WeakPolarHBondContact O-CB 3.37Å; N278-E282 PolarHBondContact O-N 3.25Å
279	L	47.7	Very low	52.7	Low	118 Å²	118	118.5 Å²	118.5	62%	0.618	64%	0.639	S	S	*	*	H	α-helix	trans	-76.1	-38.4	-174.1	-168.2	72	0	0	0	112.6	S277 D281 E282 T283	S277-L279 PolarHBondContact O-N 3.39Å; L279-D281 VanDerWaalsContact C-N 3.33Å; L279-E282 PolarHBondContact O-N 3.2Å; L279-T283 WeakPolarHBondContact O-CB 3.48Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 2.94Å; L279-T283 PolarHBondContact O-OG1 3.27Å
280	C	53.4	Low	54.7	Low	92 Å²	92	114.5 Å²	114.5	62%	0.622	62%	0.623	S	S	*	*	H	α-helix	trans	-67.1	-38.7	173	-72.5	0	0	0	0	110.9	T283 K284	C280-T283 WeakPolarHBondContact CA-OG1 3.49Å; C280-T283 PolarHBondContact O-OG1 3.16Å; C280-T283 VanDerWaalsContact O-OG1 3.06Å; C280-K284 VanDerWaalsContact O-CB 3.27Å; C280-K284 WeakPolarHBondContact O-CB 3.49Å; C280-K284 PolarHBondContact O-N 2.91Å
281	D	63.4	Low	56.8	Low	98 Å²	98	112.4 Å²	112.4	52%	0.524	60%	0.595	S	S	.	*	H	α-helix	trans	-67.5	-40.6	175.3	-72	-20.1	0	0	0	111.7	L279 K284 R285	L279-D281 VanDerWaalsContact C-N 3.33Å; D281-K284 PolarHBondContact O-N 3.41Å; D281-R285 WeakPolarHBondContact O-CB 3.22Å; D281-R285 WeakPolarHBondContact O-CG 3.46Å; D281-R285 PolarHBondContact O-N 2.81Å
282	E	68.2	Low	59	Low	112 Å²	112	105.3 Å²	105.3	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-42.5	178	-172.9	169.6	-159	0	0	111.9	N278 L279 R285 I286	N278-E282 WeakPolarHBondContact O-CB 3.37Å; N278-E282 PolarHBondContact O-N 3.25Å; L279-E282 PolarHBondContact O-N 3.2Å; E282-R285 WeakPolarHBondContact O-CB 3.37Å; E282-R285 PolarHBondContact O-N 2.88Å; E282-I286 HydrophobicContact CG-CD1 3.99Å; E282-I286 WeakPolarHBondContact O-CB 3.31Å; E282-I286 WeakPolarHBondContact O-CD1 3.03Å; E282-I286 WeakPolarHBondContact O-CG1 3.41Å; E282-I286 PolarHBondContact O-N 3.43Å
283	T	68.9	Low	61.1	Low	79 Å²	79	96.2 Å²	96.2	49%	0.485	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-39.1	174.9	48.4	0	0	0	0	112.3	L279 C280 I286 Y287	L279-T283 WeakPolarHBondContact O-CB 3.48Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 2.94Å; L279-T283 PolarHBondContact O-OG1 3.27Å; C280-T283 WeakPolarHBondContact CA-OG1 3.49Å; C280-T283 PolarHBondContact O-OG1 3.16Å; C280-T283 VanDerWaalsContact O-OG1 3.06Å; T283-I286 PolarHBondContact O-N 3.01Å; T283-Y287 PolarHBondContact O-N 3.3Å
284	K	68.8	Low	63.3	Low	140 Å²	140	93.1 Å²	93.1	61%	0.609	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-41.5	172.4	-172	176.1	-178.4	178.1	0	111.5	C280 D281 Y287 I288	C280-K284 VanDerWaalsContact O-CB 3.27Å; C280-K284 WeakPolarHBondContact O-CB 3.49Å; C280-K284 PolarHBondContact O-N 2.91Å; D281-K284 PolarHBondContact O-N 3.41Å; K284-Y287 PolarHBondContact O-N 3.49Å; K284-I288 HydrophobicContact CG-CD1 3.9Å; K284-I288 WeakPolarHBondContact O-CB 3.19Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 3Å
285	R	66.4	Low	65	Low	184 Å²	184	87.2 Å²	87.2	69%	0.694	48%	0.478	S	S	*	.	H	α-helix	trans	-60.4	-48.5	173.8	-72.8	-111	-117.9	-149	-5.8	111.4	D281 E282 Y287 I288 D289	D281-R285 WeakPolarHBondContact O-CB 3.22Å; D281-R285 WeakPolarHBondContact O-CG 3.46Å; D281-R285 PolarHBondContact O-N 2.81Å; E282-R285 WeakPolarHBondContact O-CB 3.37Å; E282-R285 PolarHBondContact O-N 2.88Å; R285-Y287 VanDerWaalsContact C-N 3.35Å; R285-Y287 PolarHBondContact O-N 3.09Å; R285-I288 PolarHBondContact O-N 3.21Å; R285-D289 WeakPolarHBondContact O-CB 3.42Å; R285-D289 VanDerWaalsContact O-CG 3.3Å; R285-D289 PolarHBondContact O-N 2.63Å
286	I	71.8	Confident	67.2	Low	98 Å²	98	87.6 Å²	87.6	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-42.9	178.7	-67.7	162.6	0	0	0	111.1	E282 T283 D289 Q290	E282-I286 HydrophobicContact CG-CD1 3.99Å; E282-I286 WeakPolarHBondContact O-CB 3.31Å; E282-I286 WeakPolarHBondContact O-CD1 3.03Å; E282-I286 WeakPolarHBondContact O-CG1 3.41Å; E282-I286 PolarHBondContact O-N 3.43Å; T283-I286 PolarHBondContact O-N 3.01Å; I286-D289 PolarHBondContact O-N 3.27Å; I286-Q290 WeakPolarHBondContact O-CB 3.44Å; I286-Q290 PolarHBondContact O-N 3.07Å
287	Y	74.4	Confident	69.2	Low	94 Å²	94	86.4 Å²	86.4	37%	0.369	44%	0.438	S	S	.	.	H	α-helix	trans	-64.9	-45	177	180	-100.4	0	0	0	112	A238 T283 K284 R285 Q290 Q291	A238-Y287 PolarHBondContact O-OH 2.97Å; T283-Y287 PolarHBondContact O-N 3.3Å; K284-Y287 PolarHBondContact O-N 3.49Å; R285-Y287 VanDerWaalsContact C-N 3.35Å; R285-Y287 PolarHBondContact O-N 3.09Å; Y287-Q290 PolarHBondContact O-N 3.14Å; Y287-Q291 HydrophobicContact CD1-CG 4.32Å; Y287-Q291 HydrophobicContact CE1-CG 3.88Å; Y287-Q291 HydrophobicContact CE2-CG 4.22Å; Y287-Q291 VanDerWaalsContact CZ-NE2 3.33Å; Y287-Q291 WeakPolarHBondContact O-CG 3.1Å; Y287-Q291 PolarHBondContact O-N 3.38Å; Y287-Q291 PolarHBondContact OH-NE2 3.49Å
288	I	72.3	Confident	71.1	Confident	69 Å²	69	85.4 Å²	85.4	35%	0.354	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-45	176.3	-69.9	167.6	0	0	0	110.5	M239 K284 R285 Q290 Q291 L292	M239-I288 HydrophobicContact CE-CG2 4.35Å; K284-I288 HydrophobicContact CG-CD1 3.9Å; K284-I288 WeakPolarHBondContact O-CB 3.19Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 3Å; R285-I288 PolarHBondContact O-N 3.21Å; I288-Q290 VanDerWaalsContact C-N 3.3Å; I288-Q290 PolarHBondContact O-N 3.34Å; I288-Q291 PolarHBondContact O-N 3.49Å; I288-L292 WeakPolarHBondContact O-CB 3.31Å; I288-L292 PolarHBondContact O-N 2.84Å
289	D	73.9	Confident	72.8	Confident	95 Å²	95	79.9 Å²	79.9	51%	0.508	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-38.3	177.9	-76.1	-15.6	0	0	0	111.2	R285 I286 L292 S293	R285-D289 WeakPolarHBondContact O-CB 3.42Å; R285-D289 VanDerWaalsContact O-CG 3.3Å; R285-D289 PolarHBondContact O-N 2.63Å; I286-D289 PolarHBondContact O-N 3.27Å; D289-L292 PolarHBondContact O-N 3.16Å; D289-S293 WeakPolarHBondContact O-CB 3.26Å; D289-S293 PolarHBondContact O-N 3.08Å
290	Q	76.4	Confident	74.6	Confident	101 Å²	101	74.5 Å²	74.5	47%	0.472	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-45	175.4	-168.9	178.3	6.8	0	0	111.8	I286 Y287 I288 S293 K294	I286-Q290 WeakPolarHBondContact O-CB 3.44Å; I286-Q290 PolarHBondContact O-N 3.07Å; Y287-Q290 PolarHBondContact O-N 3.14Å; I288-Q290 VanDerWaalsContact C-N 3.3Å; I288-Q290 PolarHBondContact O-N 3.34Å; Q290-S293 PolarHBondContact O-N 3.01Å; Q290-S293 PolarHBondContact O-OG 3.13Å; Q290-K294 PolarHBondContact O-N 3.44Å; Q290-K294 VanDerWaalsContact O-N 3.12Å
291	Q	74.9	Confident	76.2	Confident	23 Å²	23	72.8 Å²	72.8	11%	0.107	35%	0.353	C	S	.	.	H	α-helix	trans	-66.6	-40.2	176.4	-64.7	-60.8	1.3	0	0	111.7	M239 Y287 I288 S293 K294 L295	M239-Q291 HydrophobicContact CE-CB 3.77Å; M239-Q291 HydrophobicContact CG-CB 4.3Å; Y287-Q291 HydrophobicContact CD1-CG 4.32Å; Y287-Q291 HydrophobicContact CE1-CG 3.88Å; Y287-Q291 HydrophobicContact CE2-CG 4.22Å; Y287-Q291 VanDerWaalsContact CZ-NE2 3.33Å; Y287-Q291 WeakPolarHBondContact O-CG 3.1Å; Y287-Q291 PolarHBondContact O-N 3.38Å; Y287-Q291 PolarHBondContact OH-NE2 3.49Å; I288-Q291 PolarHBondContact O-N 3.49Å; Q291-S293 VanDerWaalsContact C-N 3.3Å; Q291-S293 PolarHBondContact O-N 2.77Å; Q291-K294 PolarHBondContact O-N 3.05Å; Q291-L295 PolarHBondContact O-N 3Å
292	L	76.7	Confident	77.4	Confident	41 Å²	41	69.1 Å²	69.1	22%	0.215	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-38.5	174.7	-176.5	62.9	0	0	0	111.6	P78 M239 I288 D289 L295 K296	P78-L292 HydrophobicContact CB-CD1 4.48Å; P78-L292 WeakPolarHBondContact O-CD1 3.47Å; M239-L292 HydrophobicContact CE-CB 4.26Å; I288-L292 WeakPolarHBondContact O-CB 3.31Å; I288-L292 PolarHBondContact O-N 2.84Å; D289-L292 PolarHBondContact O-N 3.16Å; L292-L295 PolarHBondContact O-N 3.46Å; L292-K296 HydrophobicContact CG-CD 4.42Å; L292-K296 WeakPolarHBondContact O-CB 3.3Å; L292-K296 VanDerWaalsContact O-CG 3.27Å; L292-K296 WeakPolarHBondContact O-CG 3.34Å; L292-K296 PolarHBondContact O-N 3.13Å
293	S	76.8	Confident	78.4	Confident	52 Å²	52	63.8 Å²	63.8	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-65.5	-40.2	176.3	76.6	0	0	0	0	112.4	Y130 D289 Q290 Q291 K296 T297	Y130-S293 PolarHBondContact OH-O 2.72Å; D289-S293 WeakPolarHBondContact O-CB 3.26Å; D289-S293 PolarHBondContact O-N 3.08Å; Q290-S293 PolarHBondContact O-N 3.01Å; Q290-S293 PolarHBondContact O-OG 3.13Å; Q291-S293 VanDerWaalsContact C-N 3.3Å; Q291-S293 PolarHBondContact O-N 2.77Å; S293-K296 PolarHBondContact O-N 3.32Å; S293-T297 PolarHBondContact O-N 3.39Å
294	K	80.2	Confident	79.4	Confident	92 Å²	92	60.2 Å²	60.2	40%	0.4	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-46.1	174.9	-70.2	177.8	-177	175.5	0	111.3	Q290 Q291 K296 T297 I298	Q290-K294 PolarHBondContact O-N 3.44Å; Q290-K294 VanDerWaalsContact O-N 3.12Å; Q291-K294 PolarHBondContact O-N 3.05Å; K294-K296 VanDerWaalsContact C-N 3.26Å; K294-K296 PolarHBondContact O-N 3.29Å; K294-T297 PolarHBondContact O-N 2.76Å; K294-T297 VanDerWaalsContact O-N 3.11Å; K294-T297 PolarHBondContact O-OG1 3.08Å; K294-I298 WeakPolarHBondContact O-CG1 3.33Å; K294-I298 PolarHBondContact O-N 3.06Å
295	L	80	Confident	80.4	Confident	8 Å²	8	57.6 Å²	57.6	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-38.7	176.7	-178	64.1	0	0	0	111.6	P78 Q291 L292 I298 A299	P78-L295 HydrophobicContact CB-CD2 4.14Å; P78-L295 HydrophobicContact CB-CG 4.35Å; P78-L295 HydrophobicContact CG-CD2 4.46Å; P78-L295 HydrophobicContact CG-CG 4.35Å; Q291-L295 PolarHBondContact O-N 3Å; L292-L295 PolarHBondContact O-N 3.46Å; L295-I298 PolarHBondContact O-N 3.1Å; L295-A299 VanDerWaalsContact O-CB 3.26Å; L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.39Å
296	K	81.7	Confident	81.6	Confident	77 Å²	77	48.8 Å²	48.8	34%	0.335	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-42.2	173.8	-76.3	173.4	178.6	-179.1	0	112.7	P78 N79 L292 S293 K294 A299 L300	P78-K296 HydrophobicContact CB-CG 4.32Å; N79-K296 VanDerWaalsContact OD1-CE 3.24Å; N79-K296 WeakPolarHBondContact OD1-CE 3.46Å; L292-K296 HydrophobicContact CG-CD 4.42Å; L292-K296 WeakPolarHBondContact O-CB 3.3Å; L292-K296 VanDerWaalsContact O-CG 3.27Å; L292-K296 WeakPolarHBondContact O-CG 3.34Å; L292-K296 PolarHBondContact O-N 3.13Å; S293-K296 PolarHBondContact O-N 3.32Å; K294-K296 VanDerWaalsContact C-N 3.26Å; K294-K296 PolarHBondContact O-N 3.29Å; K296-A299 PolarHBondContact O-N 3.15Å; K296-L300 WeakPolarHBondContact O-CB 3.49Å; K296-L300 PolarHBondContact O-N 3.47Å
297	T	83.3	Confident	82.5	Confident	46 Å²	46	44.1 Å²	44.1	28%	0.282	22%	0.222	S	C	.	.	H	α-helix	trans	-60.1	-47.9	174.3	54.7	0	0	0	0	111.7	Y130 S293 K294 A299 L300 D301	Y130-T297 HydrophobicContact CE1-CG2 4.17Å; Y130-T297 WeakPolarHBondContact OH-CG2 3.29Å; Y130-T297 PolarHBondContact OH-N 3.23Å; S293-T297 PolarHBondContact O-N 3.39Å; K294-T297 PolarHBondContact O-N 2.76Å; K294-T297 VanDerWaalsContact O-N 3.11Å; K294-T297 PolarHBondContact O-OG1 3.08Å; T297-A299 PolarHBondContact O-N 3.34Å; T297-L300 PolarHBondContact O-N 2.88Å; T297-D301 PolarHBondContact O-N 3.27Å
298	I	84.6	Confident	83.3	Confident	58 Å²	58	42.2 Å²	42.2	30%	0.297	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-44	-179	-64.4	167.1	0	0	0	110.6	K294 L295 L300 D301 L302	K294-I298 WeakPolarHBondContact O-CG1 3.33Å; K294-I298 PolarHBondContact O-N 3.06Å; L295-I298 PolarHBondContact O-N 3.1Å; I298-L300 VanDerWaalsContact C-N 3.3Å; I298-L300 PolarHBondContact O-N 3.04Å; I298-D301 PolarHBondContact O-N 3.42Å; I298-L302 VanDerWaalsContact O-CB 3.23Å; I298-L302 WeakPolarHBondContact O-CB 3.47Å; I298-L302 PolarHBondContact O-N 3.18Å
299	A	85.2	Confident	84.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-39.3	177.5	0	0	0	0	0	111.9	I74 P78 F228 L295 K296 T297 S303	I74-A299 HydrophobicContact CG2-CB 4.42Å; P78-A299 HydrophobicContact CG-CB 3.97Å; F228-A299 HydrophobicContact CE2-CB 4.12Å; L295-A299 VanDerWaalsContact O-CB 3.26Å; L295-A299 WeakPolarHBondContact O-CB 3.24Å; L295-A299 PolarHBondContact O-N 3.39Å; K296-A299 PolarHBondContact O-N 3.15Å; T297-A299 PolarHBondContact O-N 3.34Å; A299-S303 WeakPolarHBondContact O-CB 3.21Å; A299-S303 PolarHBondContact O-N 3.35Å
300	L	86.1	Confident	85	Confident	4 Å²	4	37 Å²	37	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-48.1	176.9	-178.8	151.6	0	0	0	111.8	L75 Y130 K133 I134 K296 T297 I298 L302 S303 V304	L75-L300 HydrophobicContact CD2-CB 4.21Å; Y130-L300 HydrophobicContact CD1-CD1 3.78Å; Y130-L300 HydrophobicContact CE1-CD1 4.37Å; K133-L300 HydrophobicContact CB-CD1 3.86Å; K133-L300 HydrophobicContact CB-CD2 3.4Å; K133-L300 VanDerWaalsContact CB-CD2 3.4Å; K133-L300 HydrophobicContact CB-CG 4.2Å; K133-L300 HydrophobicContact CD-CD2 3.85Å; K133-L300 HydrophobicContact CG-CD2 3.73Å; I134-L300 HydrophobicContact CG1-CD1 3.98Å; K296-L300 WeakPolarHBondContact O-CB 3.49Å; K296-L300 PolarHBondContact O-N 3.47Å; T297-L300 PolarHBondContact O-N 2.88Å; I298-L300 VanDerWaalsContact C-N 3.3Å; I298-L300 PolarHBondContact O-N 3.04Å; L300-L302 VanDerWaalsContact C-N 3.32Å; L300-L302 PolarHBondContact O-N 3.44Å; L300-S303 PolarHBondContact O-N 3.1Å; L300-S303 VanDerWaalsContact O-N 3.14Å; L300-S303 PolarHBondContact O-OG 3.47Å; L300-V304 HydrophobicContact CD2-CG2 4.3Å; L300-V304 WeakPolarHBondContact O-CG2 3.44Å; L300-V304 PolarHBondContact O-N 3.28Å
301	D	87.1	Confident	85.7	Confident	57 Å²	57	34 Å²	34	31%	0.305	18%	0.18	S	C	.	.	H	α-helix	trans	-62.9	-42.9	-179.9	-70.1	-25.3	0	0	0	110.4	Y129 T297 I298 S303 V304 D305	Y129-D301 PolarHBondContact OH-OD1 2.86Å; T297-D301 PolarHBondContact O-N 3.27Å; I298-D301 PolarHBondContact O-N 3.42Å; D301-S303 VanDerWaalsContact C-N 3.32Å; D301-S303 PolarHBondContact O-N 3.43Å; D301-V304 PolarHBondContact O-N 3.43Å; D301-D305 PolarHBondContact O-N 3.2Å
302	L	88.7	Confident	86.4	Confident	20 Å²	20	35.8 Å²	35.8	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-38.2	174.7	-169.5	71	0	0	0	112.4	F224 I227 F228 I298 L300 D305 F306	F224-L302 HydrophobicContact CD1-CD1 3.68Å; F224-L302 HydrophobicContact CD1-CG 4.09Å; F224-L302 HydrophobicContact CE1-CD1 3.93Å; I227-L302 HydrophobicContact CG2-CD1 3.88Å; I227-L302 HydrophobicContact CG2-CD2 4.46Å; F228-L302 HydrophobicContact CB-CD2 3.64Å; F228-L302 HydrophobicContact CD2-CD2 3.89Å; F228-L302 HydrophobicContact CG-CD2 4.25Å; I298-L302 VanDerWaalsContact O-CB 3.23Å; I298-L302 WeakPolarHBondContact O-CB 3.47Å; I298-L302 PolarHBondContact O-N 3.18Å; L300-L302 VanDerWaalsContact C-N 3.32Å; L300-L302 PolarHBondContact O-N 3.44Å; L302-D305 PolarHBondContact O-N 2.67Å; L302-F306 VanDerWaalsContact O-CB 3.24Å; L302-F306 WeakPolarHBondContact O-CB 3.42Å; L302-F306 PolarHBondContact O-N 2.97Å
303	S	88.7	Confident	87	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.7	-36.9	176.9	76.4	0	0	0	0	112.5	A299 L300 D301 V307	A299-S303 WeakPolarHBondContact O-CB 3.21Å; A299-S303 PolarHBondContact O-N 3.35Å; L300-S303 PolarHBondContact O-N 3.1Å; L300-S303 VanDerWaalsContact O-N 3.14Å; L300-S303 PolarHBondContact O-OG 3.47Å; D301-S303 VanDerWaalsContact C-N 3.32Å; D301-S303 PolarHBondContact O-N 3.43Å; S303-V307 WeakPolarHBondContact O-CG2 3.41Å; S303-V307 PolarHBondContact O-N 2.88Å
304	V	89.7	Confident	87.5	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-44.5	176	173.1	0	0	0	0	110.3	K133 L137 L300 D301 V307 N308	K133-V304 HydrophobicContact CD-CG2 4.48Å; L137-V304 HydrophobicContact CB-CG2 4.2Å; L137-V304 HydrophobicContact CD1-CG2 4.07Å; L300-V304 HydrophobicContact CD2-CG2 4.3Å; L300-V304 WeakPolarHBondContact O-CG2 3.44Å; L300-V304 PolarHBondContact O-N 3.28Å; D301-V304 PolarHBondContact O-N 3.43Å; V304-V307 PolarHBondContact O-N 2.87Å; V304-N308 PolarHBondContact O-N 2.9Å; V304-N308 PolarHBondContact O-ND2 2.79Å
305	D	89.7	Confident	87.9	Confident	85 Å²	85	32.9 Å²	32.9	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-64.7	-39.7	177.6	-75.3	-16.2	0	0	0	112.3	F224 D301 L302 V307 N308 V309	F224-D305 HydrophobicContact CE1-CB 4.19Å; D301-D305 PolarHBondContact O-N 3.2Å; L302-D305 PolarHBondContact O-N 2.67Å; D305-V307 VanDerWaalsContact C-N 3.35Å; D305-V307 PolarHBondContact O-N 2.93Å; D305-N308 WeakPolarHBondContact O-CB 3.48Å; D305-N308 PolarHBondContact O-N 2.65Å; D305-V309 WeakPolarHBondContact O-CG2 3.37Å; D305-V309 PolarHBondContact O-N 2.76Å
306	F	91.2	Very high	88.2	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-53.5	-51.8	171.6	174.8	-87.3	0	0	0	111.3	S70 P71 T221 F224 L302 N308 V309 H310	S70-F306 VanDerWaalsContact OG-CE1 3.23Å; S70-F306 WeakPolarHBondContact OG-CE1 3.3Å; S70-F306 WeakPolarHBondContact OG-CZ 3.24Å; P71-F306 HydrophobicContact CB-CD1 4.28Å; P71-F306 HydrophobicContact CG-CD1 4.45Å; P71-F306 HydrophobicContact CG-CE1 4.37Å; T221-F306 HydrophobicContact CG2-CE2 3.9Å; T221-F306 HydrophobicContact CG2-CZ 3.89Å; F224-F306 HydrophobicContact CB-CD2 3.72Å; F224-F306 HydrophobicContact CB-CE2 4.32Å; F224-F306 HydrophobicContact CD1-CB 3.95Å; F224-F306 HydrophobicContact CD1-CD2 4.15Å; F224-F306 AromaticContact CD2-CD2 3.84Å; F224-F306 HydrophobicContact CD2-CD2 3.84Å; F224-F306 HydrophobicContact CE1-CB 4.02Å; F224-F306 HydrophobicContact CE2-CD2 4.5Å; F224-F306 HydrophobicContact CG-CB 4.3Å; F224-F306 AromaticContact CG-CD2 3.65Å; F224-F306 HydrophobicContact CG-CD2 3.65Å; F224-F306 HydrophobicContact CG-CG 4.48Å; F224-F306 HydrophobicContact CZ-CB 4.44Å; L302-F306 VanDerWaalsContact O-CB 3.24Å; L302-F306 WeakPolarHBondContact O-CB 3.42Å; L302-F306 PolarHBondContact O-N 2.97Å; F306-N308 PolarHBondContact O-N 3.49Å; F306-V309 PolarHBondContact O-N 3.09Å; F306-H310 AromaticContact CD2-CD2 3.94Å; F306-H310 AromaticContact CE1-CD2 3.52Å; F306-H310 AromaticContact CE2-CD2 3.49Å; F306-H310 VanDerWaalsContact CE2-CD2 3.49Å; F306-H310 WeakPolarHBondContact CE2-CD2 2.85Å; F306-H310 AromaticContact CE2-NE2 3.38Å; F306-H310 WeakPolarHBondContact CE2-NE2 3.49Å; F306-H310 AromaticContact CZ-CD2 3.23Å; F306-H310 WeakPolarHBondContact CZ-CD2 3.39Å; F306-H310 AromaticContact CZ-NE2 3.29Å; F306-H310 VanDerWaalsContact CZ-NE2 3.29Å; F306-H310 WeakPolarHBondContact CZ-NE2 3.45Å; F306-H310 PolarHBondContact O-CD2 3.49Å; F306-H310 PolarHBondContact O-N 2.84Å
307	V	91	Very high	88.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.6	-38.4	-179.4	178.3	0	0	0	0	111.2	P71 L137 K140 I141 L144 S303 V304 D305 H310 L311	P71-V307 HydrophobicContact CB-CG2 4.2Å; P71-V307 HydrophobicContact CG-CG2 4.39Å; L137-V307 HydrophobicContact CD1-CB 4.37Å; L137-V307 HydrophobicContact CD1-CG2 3.74Å; K140-V307 HydrophobicContact CB-CG1 3.57Å; I141-V307 HydrophobicContact CG1-CG1 4.35Å; I141-V307 HydrophobicContact CG1-CG2 3.83Å; L144-V307 HydrophobicContact CB-CG1 4.49Å; L144-V307 HydrophobicContact CD2-CG1 4.33Å; S303-V307 WeakPolarHBondContact O-CG2 3.41Å; S303-V307 PolarHBondContact O-N 2.88Å; V304-V307 PolarHBondContact O-N 2.87Å; D305-V307 VanDerWaalsContact C-N 3.35Å; D305-V307 PolarHBondContact O-N 2.93Å; V307-H310 PolarHBondContact O-N 3.48Å; V307-L311 VanDerWaalsContact O-CB 3.25Å; V307-L311 WeakPolarHBondContact O-CB 3.08Å; V307-L311 PolarHBondContact O-N 3.04Å
308	N	90.5	Very high	88.4	Confident	53 Å²	53	31.8 Å²	31.8	28%	0.283	18%	0.178	S	C	.	.	H	α-helix	trans	-59.5	-49	176.3	-71.9	-30.1	0	0	0	111.9	K140 V304 D305 F306 L311 S312	K140-N308 VanDerWaalsContact CD-OD1 3.29Å; K140-N308 WeakPolarHBondContact CD-OD1 3.49Å; K140-N308 VanDerWaalsContact CE-OD1 3.27Å; K140-N308 WeakPolarHBondContact CE-OD1 3.24Å; K140-N308 PolarHBondContact NZ-OD1 3.41Å; V304-N308 PolarHBondContact O-N 2.9Å; V304-N308 PolarHBondContact O-ND2 2.79Å; D305-N308 WeakPolarHBondContact O-CB 3.48Å; D305-N308 PolarHBondContact O-N 2.65Å; F306-N308 PolarHBondContact O-N 3.49Å; N308-L311 PolarHBondContact O-N 3Å; N308-S312 WeakPolarHBondContact O-CB 3.45Å; N308-S312 PolarHBondContact O-N 3.07Å
309	V	91.3	Very high	88.4	Confident	53 Å²	53	34 Å²	34	32%	0.321	19%	0.189	S	C	.	.	H	α-helix	trans	-63.8	-45.7	179.9	175.5	0	0	0	0	109.8	V220 F224 D305 F306 L311 S312 I313	V220-V309 HydrophobicContact CG1-CG1 3.71Å; F224-V309 HydrophobicContact CE2-CB 4.09Å; F224-V309 HydrophobicContact CE2-CG1 4.29Å; F224-V309 HydrophobicContact CE2-CG2 4.14Å; F224-V309 HydrophobicContact CZ-CB 4.23Å; F224-V309 HydrophobicContact CZ-CG2 3.88Å; D305-V309 WeakPolarHBondContact O-CG2 3.37Å; D305-V309 PolarHBondContact O-N 2.76Å; F306-V309 PolarHBondContact O-N 3.09Å; V309-L311 PolarHBondContact O-N 2.92Å; V309-S312 PolarHBondContact O-N 3.22Å; V309-S312 PolarHBondContact O-OG 2.93Å; V309-I313 HydrophobicContact CG1-CD1 3.86Å; V309-I313 WeakPolarHBondContact O-CG1 3.28Å; V309-I313 PolarHBondContact O-N 3.28Å
310	H	90.5	Very high	88.2	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-42.7	176.2	-87.7	-74.9	0	0	0	113.2	L144 T221 F306 V307 S312 I313 Q314	L144-H310 HydrophobicContact CD1-CB 4.02Å; L144-H310 HydrophobicContact CD2-CB 4.17Å; T221-H310 VanDerWaalsContact CG2-CE1 3.5Å; T221-H310 WeakPolarHBondContact CG2-CE1 3.35Å; T221-H310 VanDerWaalsContact CG2-NE2 3.29Å; T221-H310 WeakPolarHBondContact CG2-NE2 3.47Å; F306-H310 AromaticContact CD2-CD2 3.94Å; F306-H310 AromaticContact CE1-CD2 3.52Å; F306-H310 AromaticContact CE2-CD2 3.49Å; F306-H310 VanDerWaalsContact CE2-CD2 3.49Å; F306-H310 WeakPolarHBondContact CE2-CD2 2.85Å; F306-H310 AromaticContact CE2-NE2 3.38Å; F306-H310 WeakPolarHBondContact CE2-NE2 3.49Å; F306-H310 AromaticContact CZ-CD2 3.23Å; F306-H310 WeakPolarHBondContact CZ-CD2 3.39Å; F306-H310 AromaticContact CZ-NE2 3.29Å; F306-H310 VanDerWaalsContact CZ-NE2 3.29Å; F306-H310 WeakPolarHBondContact CZ-NE2 3.45Å; F306-H310 PolarHBondContact O-CD2 3.49Å; F306-H310 PolarHBondContact O-N 2.84Å; V307-H310 PolarHBondContact O-N 3.48Å; H310-S312 VanDerWaalsContact C-N 3.29Å; H310-S312 PolarHBondContact O-N 2.78Å; H310-I313 PolarHBondContact O-N 3.21Å; H310-Q314 WeakPolarHBondContact O-CG 3.26Å; H310-Q314 PolarHBondContact O-N 3.36Å
311	L	91.3	Very high	87.7	Confident	39 Å²	39	38.7 Å²	38.7	20%	0.204	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-42.3	175.2	-170.6	82.3	0	0	0	110.7	L143 L144 V307 N308 V309 Q314 L315	L143-L311 HydrophobicContact CB-CD1 3.95Å; L144-L311 HydrophobicContact CB-CD1 4.32Å; V307-L311 VanDerWaalsContact O-CB 3.25Å; V307-L311 WeakPolarHBondContact O-CB 3.08Å; V307-L311 PolarHBondContact O-N 3.04Å; N308-L311 PolarHBondContact O-N 3Å; V309-L311 PolarHBondContact O-N 2.92Å; L311-Q314 PolarHBondContact O-N 2.91Å; L311-L315 VanDerWaalsContact O-CB 3.28Å; L311-L315 WeakPolarHBondContact O-CB 3.44Å; L311-L315 PolarHBondContact O-N 2.6Å
312	S	90.3	Very high	87.2	Confident	60 Å²	60	40.5 Å²	40.5	42%	0.42	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-40.7	177.5	79.8	0	0	0	0	112.5	N308 V309 H310 L315 T316	N308-S312 WeakPolarHBondContact O-CB 3.45Å; N308-S312 PolarHBondContact O-N 3.07Å; V309-S312 PolarHBondContact O-N 3.22Å; V309-S312 PolarHBondContact O-OG 2.93Å; H310-S312 VanDerWaalsContact C-N 3.29Å; H310-S312 PolarHBondContact O-N 2.78Å; S312-L315 PolarHBondContact O-N 3.18Å; S312-T316 WeakPolarHBondContact O-CB 3.35Å; S312-T316 VanDerWaalsContact O-CG2 3.25Å; S312-T316 WeakPolarHBondContact O-CG2 3.2Å; S312-T316 PolarHBondContact O-N 3.3Å; S312-T316 PolarHBondContact O-OG1 3.35Å
313	I	89	Confident	86.5	Confident	18 Å²	18	43.6 Å²	43.6	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-44	176.4	-66.5	161.8	0	0	0	110.4	I216 T217 V220 V309 H310 T316 A317	I216-I313 HydrophobicContact CG2-CD1 4.11Å; I216-I313 HydrophobicContact CG2-CG1 4.47Å; I216-I313 HydrophobicContact CG2-CG2 4.35Å; T217-I313 HydrophobicContact CG2-CG2 3.93Å; V220-I313 HydrophobicContact CB-CD1 4.25Å; V220-I313 HydrophobicContact CG1-CD1 4.18Å; V220-I313 HydrophobicContact CG2-CD1 3.87Å; V309-I313 HydrophobicContact CG1-CD1 3.86Å; V309-I313 WeakPolarHBondContact O-CG1 3.28Å; V309-I313 PolarHBondContact O-N 3.28Å; H310-I313 PolarHBondContact O-N 3.21Å; I313-T316 WeakPolarHBondContact CA-OG1 3.35Å; I313-T316 PolarHBondContact O-OG1 2.9Å; I313-A317 VanDerWaalsContact O-CB 3.32Å; I313-A317 WeakPolarHBondContact O-CB 3.25Å; I313-A317 PolarHBondContact O-N 3.33Å
314	Q	87.5	Confident	85.6	Confident	2 Å²	2	47 Å²	47	1%	0.009	25%	0.246	C	C	.	.	H	α-helix	trans	-70.6	-38.5	179.2	-61.6	-59.9	0.9	0	0	112.2	L144 C147 I151 H310 L311 A317 I318	L144-Q314 HydrophobicContact CD1-CG 3.93Å; C147-Q314 HydrophobicContact CB-CB 4.22Å; I151-Q314 HydrophobicContact CD1-CB 3.89Å; I151-Q314 HydrophobicContact CD1-CG 4.35Å; H310-Q314 WeakPolarHBondContact O-CG 3.26Å; H310-Q314 PolarHBondContact O-N 3.36Å; L311-Q314 PolarHBondContact O-N 2.91Å; Q314-A317 PolarHBondContact O-N 2.64Å; Q314-I318 WeakPolarHBondContact O-CG1 3.41Å; Q314-I318 PolarHBondContact O-N 2.98Å
315	L	88.8	Confident	84.3	Confident	105 Å²	105	50.4 Å²	50.4	55%	0.55	27%	0.267	S	S	.	.	H	α-helix	trans	-65.3	-44	176.3	-165.5	96.2	0	0	0	111.2	L311 S312 A317 I318 L319	L311-L315 VanDerWaalsContact O-CB 3.28Å; L311-L315 WeakPolarHBondContact O-CB 3.44Å; L311-L315 PolarHBondContact O-N 2.6Å; S312-L315 PolarHBondContact O-N 3.18Å; L315-A317 VanDerWaalsContact C-N 3.34Å; L315-I318 PolarHBondContact O-N 3.37Å; L315-L319 WeakPolarHBondContact O-CB 3.28Å; L315-L319 PolarHBondContact O-N 3.47Å
316	T	85.5	Confident	83.2	Confident	73 Å²	73	50.2 Å²	50.2	45%	0.448	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-38.2	174.6	51.9	0	0	0	0	111.4	S312 I313 L319 L320	S312-T316 WeakPolarHBondContact O-CB 3.35Å; S312-T316 VanDerWaalsContact O-CG2 3.25Å; S312-T316 WeakPolarHBondContact O-CG2 3.2Å; S312-T316 PolarHBondContact O-N 3.3Å; S312-T316 PolarHBondContact O-OG1 3.35Å; I313-T316 WeakPolarHBondContact CA-OG1 3.35Å; I313-T316 PolarHBondContact O-OG1 2.9Å; T316-L319 PolarHBondContact O-N 3Å; T316-L320 WeakPolarHBondContact O-CB 3.34Å; T316-L320 VanDerWaalsContact O-CG 3.23Å; T316-L320 WeakPolarHBondContact O-CG 3.3Å; T316-L320 PolarHBondContact O-N 2.77Å
317	A	84.8	Confident	81.7	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-46.2	172.7	0	0	0	0	0	112.3	I151 I213 I313 Q314 L315 L319 L320 I321	I151-A317 HydrophobicContact CD1-CB 4.36Å; I213-A317 HydrophobicContact CD1-CB 4Å; I213-A317 HydrophobicContact CG1-CB 4.22Å; I213-A317 HydrophobicContact CG2-CB 4.22Å; I313-A317 VanDerWaalsContact O-CB 3.32Å; I313-A317 WeakPolarHBondContact O-CB 3.25Å; I313-A317 PolarHBondContact O-N 3.33Å; Q314-A317 PolarHBondContact O-N 2.64Å; L315-A317 VanDerWaalsContact C-N 3.34Å; A317-L319 VanDerWaalsContact C-N 3.32Å; A317-L319 PolarHBondContact O-N 3.39Å; A317-L320 PolarHBondContact O-N 2.78Å; A317-I321 VanDerWaalsContact O-CG1 3.26Å; A317-I321 WeakPolarHBondContact O-CG1 3.34Å; A317-I321 PolarHBondContact O-N 3.2Å
318	I	84.9	Confident	80.1	Confident	34 Å²	34	55.3 Å²	55.3	17%	0.174	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-44.6	175.2	-68.6	164	0	0	0	110.4	C147 Y150 I151 Q314 L315 L320 I321 K322	C147-I318 HydrophobicContact CB-CD1 4.03Å; Y150-I318 HydrophobicContact CD1-CD1 4.23Å; Y150-I318 HydrophobicContact CD1-CG1 4.14Å; Y150-I318 HydrophobicContact CE1-CG2 4.41Å; I151-I318 HydrophobicContact CD1-CD1 4.01Å; I151-I318 HydrophobicContact CD1-CG1 3.69Å; I151-I318 HydrophobicContact CG1-CD1 4.06Å; I151-I318 HydrophobicContact CG1-CG1 3.57Å; Q314-I318 WeakPolarHBondContact O-CG1 3.41Å; Q314-I318 PolarHBondContact O-N 2.98Å; L315-I318 PolarHBondContact O-N 3.37Å; I318-L320 VanDerWaalsContact C-N 3.34Å; I318-L320 PolarHBondContact O-N 3.2Å; I318-I321 PolarHBondContact O-N 3.01Å; I318-K322 HydrophobicContact CG2-CG 4.29Å; I318-K322 WeakPolarHBondContact O-CB 3.19Å; I318-K322 WeakPolarHBondContact O-CG 3.19Å; I318-K322 PolarHBondContact O-N 3.5Å
319	L	83.9	Confident	78.5	Confident	104 Å²	104	58.9 Å²	58.9	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-60	-45.3	177.4	-172.4	150.9	0	0	0	110.3	L315 T316 A317 K322 F323	L315-L319 WeakPolarHBondContact O-CB 3.28Å; L315-L319 PolarHBondContact O-N 3.47Å; T316-L319 PolarHBondContact O-N 3Å; A317-L319 VanDerWaalsContact C-N 3.32Å; A317-L319 PolarHBondContact O-N 3.39Å; L319-K322 PolarHBondContact O-N 3.34Å; L319-F323 HydrophobicContact CD2-CB 4.45Å; L319-F323 WeakPolarHBondContact O-CA 3.33Å; L319-F323 WeakPolarHBondContact O-CB 3.46Å; L319-F323 PolarHBondContact O-N 2.74Å
320	L	80.8	Confident	76.8	Confident	61 Å²	61	61.1 Å²	61.1	32%	0.319	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-39.2	177.6	-72.6	171.5	0	0	0	112.6	F209 T316 A317 I318 K324	F209-L320 HydrophobicContact CE2-CB 4.32Å; F209-L320 HydrophobicContact CE2-CD1 3.95Å; F209-L320 HydrophobicContact CZ-CB 3.69Å; F209-L320 HydrophobicContact CZ-CD1 3.79Å; F209-L320 HydrophobicContact CZ-CG 4.4Å; T316-L320 WeakPolarHBondContact O-CB 3.34Å; T316-L320 VanDerWaalsContact O-CG 3.23Å; T316-L320 WeakPolarHBondContact O-CG 3.3Å; T316-L320 PolarHBondContact O-N 2.77Å; A317-L320 PolarHBondContact O-N 2.78Å; I318-L320 VanDerWaalsContact C-N 3.34Å; I318-L320 PolarHBondContact O-N 3.2Å; L320-K324 VanDerWaalsContact O-CB 3.26Å; L320-K324 WeakPolarHBondContact O-CB 3.31Å; L320-K324 PolarHBondContact O-N 3.37Å
321	I	76.7	Confident	75.4	Confident	43 Å²	43	63.9 Å²	63.9	22%	0.221	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-49.3	174.8	-69.2	164.4	0	0	0	110	F209 A317 I318 K324 T325	F209-I321 HydrophobicContact CE1-CG1 4.04Å; A317-I321 VanDerWaalsContact O-CG1 3.26Å; A317-I321 WeakPolarHBondContact O-CG1 3.34Å; A317-I321 PolarHBondContact O-N 3.2Å; I318-I321 PolarHBondContact O-N 3.01Å; I321-K324 PolarHBondContact O-N 3.09Å; I321-T325 WeakPolarHBondContact O-CG2 3.23Å; I321-T325 PolarHBondContact O-N 3.45Å
322	K	76.3	Confident	73.8	Confident	95 Å²	95	63.1 Å²	63.1	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-43.1	178	-70.7	-63.6	-172.5	-178.6	0	111.3	Y150 I318 L319 K324 T325 I326	Y150-K322 VanDerWaalsContact OH-CE 3.31Å; Y150-K322 WeakPolarHBondContact OH-CE 3.04Å; Y150-K322 PolarHBondContact OH-NZ 2.79Å; Y150-K322 VanDerWaalsContact OH-NZ 3.08Å; I318-K322 HydrophobicContact CG2-CG 4.29Å; I318-K322 WeakPolarHBondContact O-CB 3.19Å; I318-K322 WeakPolarHBondContact O-CG 3.19Å; I318-K322 PolarHBondContact O-N 3.5Å; L319-K322 PolarHBondContact O-N 3.34Å; K322-K324 VanDerWaalsContact C-N 3.31Å; K322-K324 PolarHBondContact O-N 2.75Å; K322-T325 WeakPolarHBondContact CA-OG1 3.07Å; K322-T325 CarbonylContact O-C 3.6Å; K322-T325 PolarHBondContact O-N 3.47Å; K322-T325 VanDerWaalsContact O-N 3.11Å; K322-T325 PolarHBondContact O-OG1 3.41Å; K322-I326 WeakPolarHBondContact O-CB 3.48Å; K322-I326 WeakPolarHBondContact O-CD1 3.47Å; K322-I326 VanDerWaalsContact O-CG1 3.22Å; K322-I326 WeakPolarHBondContact O-CG1 3.18Å; K322-I326 PolarHBondContact O-N 3.23Å
323	F	73.9	Confident	72.7	Confident	85 Å²	85	64.3 Å²	64.3	37%	0.373	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-37.6	177.8	-166.5	-108.4	0	0	0	111.2	L319 I326 L327 W753	L319-F323 HydrophobicContact CD2-CB 4.45Å; L319-F323 WeakPolarHBondContact O-CA 3.33Å; L319-F323 WeakPolarHBondContact O-CB 3.46Å; L319-F323 PolarHBondContact O-N 2.74Å; F323-I326 CarbonylContact O-C 3.58Å; F323-I326 PolarHBondContact O-N 2.8Å; F323-L327 HydrophobicContact CD1-CD1 3.41Å; F323-L327 VanDerWaalsContact CD1-CD1 3.41Å; F323-L327 HydrophobicContact CD1-CG 3.99Å; F323-L327 HydrophobicContact CE1-CD1 3.32Å; F323-L327 HydrophobicContact CE1-CD2 4.3Å; F323-L327 HydrophobicContact CE1-CG 3.78Å; F323-L327 HydrophobicContact CG-CD1 4.38Å; F323-L327 HydrophobicContact CZ-CD1 4.22Å; F323-L327 HydrophobicContact CZ-CD2 4.48Å; F323-L327 HydrophobicContact CZ-CG 4.21Å; F323-L327 VanDerWaalsContact O-CB 3.3Å; F323-L327 WeakPolarHBondContact O-CB 3.23Å; F323-L327 WeakPolarHBondContact O-CG 3.17Å; F323-L327 PolarHBondContact O-N 2.71Å; F323-W753 HydrophobicContact CD1-CZ3 4.22Å; F323-W753 HydrophobicContact CE1-CH2 4.32Å; F323-W753 AromaticContact CE1-CZ3 3.86Å; F323-W753 HydrophobicContact CE1-CZ3 3.86Å
324	K	69.5	Low	72.1	Confident	71 Å²	71	63.7 Å²	63.7	31%	0.309	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-46	169.9	-178.7	172.1	-177	163.5	0	111.6	L320 I321 K322 I326 L327 D328	L320-K324 VanDerWaalsContact O-CB 3.26Å; L320-K324 WeakPolarHBondContact O-CB 3.31Å; L320-K324 PolarHBondContact O-N 3.37Å; I321-K324 PolarHBondContact O-N 3.09Å; K322-K324 VanDerWaalsContact C-N 3.31Å; K322-K324 PolarHBondContact O-N 2.75Å; K324-I326 VanDerWaalsContact C-N 3.25Å; K324-I326 PolarHBondContact O-N 3.41Å; K324-L327 PolarHBondContact O-N 2.87Å; K324-D328 WeakPolarHBondContact O-CB 3.41Å; K324-D328 PolarHBondContact O-N 3.45Å
325	T	62.6	Low	71.8	Confident	75 Å²	75	65.2 Å²	65.2	46%	0.46	33%	0.331	S	S	.	.	H	α-helix	trans	-63.2	-34.4	176	60.6	0	0	0	0	112.6	I321 K322 W329	I321-T325 WeakPolarHBondContact O-CG2 3.23Å; I321-T325 PolarHBondContact O-N 3.45Å; K322-T325 WeakPolarHBondContact CA-OG1 3.07Å; K322-T325 CarbonylContact O-C 3.6Å; K322-T325 PolarHBondContact O-N 3.47Å; K322-T325 VanDerWaalsContact O-N 3.11Å; K322-T325 PolarHBondContact O-OG1 3.41Å; T325-W329 VanDerWaalsContact O-CB 3.24Å; T325-W329 WeakPolarHBondContact O-CB 3.15Å; T325-W329 PolarHBondContact O-N 3.27Å
326	I	66.5	Low	71.5	Confident	81 Å²	81	60.2 Å²	60.2	42%	0.415	31%	0.305	S	S	.	.	H	α-helix	trans	-73	-42.1	176.7	-68.2	162.7	0	0	0	110.2	K322 F323 K324 W329 L330	K322-I326 WeakPolarHBondContact O-CB 3.48Å; K322-I326 WeakPolarHBondContact O-CD1 3.47Å; K322-I326 VanDerWaalsContact O-CG1 3.22Å; K322-I326 WeakPolarHBondContact O-CG1 3.18Å; K322-I326 PolarHBondContact O-N 3.23Å; F323-I326 CarbonylContact O-C 3.58Å; F323-I326 PolarHBondContact O-N 2.8Å; K324-I326 VanDerWaalsContact C-N 3.25Å; K324-I326 PolarHBondContact O-N 3.41Å; I326-W329 CarbonylContact O-C 3.51Å; I326-W329 WeakPolarHBondContact O-CB 3.1Å; I326-W329 PolarHBondContact O-N 3.17Å; I326-L330 HydrophobicContact CG2-CD1 3.66Å; I326-L330 HydrophobicContact CG2-CG 4.14Å; I326-L330 VanDerWaalsContact O-CB 3.31Å; I326-L330 WeakPolarHBondContact O-CB 3.47Å; I326-L330 WeakPolarHBondContact O-CG 3.33Å; I326-L330 PolarHBondContact O-N 3.47Å
327	L	60.1	Low	71.4	Confident	42 Å²	42	59.8 Å²	59.8	22%	0.22	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-42.6	175.2	-85.4	167.9	0	0	0	111.8	F323 K324 W329 L330 S331 W753 I756	F323-L327 HydrophobicContact CD1-CD1 3.41Å; F323-L327 VanDerWaalsContact CD1-CD1 3.41Å; F323-L327 HydrophobicContact CD1-CG 3.99Å; F323-L327 HydrophobicContact CE1-CD1 3.32Å; F323-L327 HydrophobicContact CE1-CD2 4.3Å; F323-L327 HydrophobicContact CE1-CG 3.78Å; F323-L327 HydrophobicContact CG-CD1 4.38Å; F323-L327 HydrophobicContact CZ-CD1 4.22Å; F323-L327 HydrophobicContact CZ-CD2 4.48Å; F323-L327 HydrophobicContact CZ-CG 4.21Å; F323-L327 VanDerWaalsContact O-CB 3.3Å; F323-L327 WeakPolarHBondContact O-CB 3.23Å; F323-L327 WeakPolarHBondContact O-CG 3.17Å; F323-L327 PolarHBondContact O-N 2.71Å; K324-L327 PolarHBondContact O-N 2.87Å; L327-W329 VanDerWaalsContact C-N 3.27Å; L327-W329 PolarHBondContact O-N 3.44Å; L327-L330 PolarHBondContact O-N 3.07Å; L327-S331 VanDerWaalsContact O-CB 3.24Å; L327-S331 WeakPolarHBondContact O-CB 3.07Å; L327-S331 PolarHBondContact O-N 3.16Å; L327-S331 PolarHBondContact O-OG 3.26Å; L327-W753 HydrophobicContact CD1-CZ3 4.26Å; L327-I756 HydrophobicContact CD1-CD1 4.28Å
328	D	57.7	Low	71.3	Confident	65 Å²	65	59.8 Å²	59.8	35%	0.348	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-42.8	173	-78	-10.3	0	0	0	109.7	K324 S331 C332	K324-D328 WeakPolarHBondContact O-CB 3.41Å; K324-D328 PolarHBondContact O-N 3.45Å; D328-S331 PolarHBondContact O-N 3.38Å; D328-C332 PolarHBondContact O-N 3.1Å; D328-C332 PolarHBondContact O-SG 2.94Å
329	W	56.1	Low	71.1	Confident	128 Å²	128	59.9 Å²	59.9	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-41.8	175.8	-177.9	83.2	0	0	0	112.8	T325 I326 L327 S331 C332 M741	T325-W329 VanDerWaalsContact O-CB 3.24Å; T325-W329 WeakPolarHBondContact O-CB 3.15Å; T325-W329 PolarHBondContact O-N 3.27Å; I326-W329 CarbonylContact O-C 3.51Å; I326-W329 WeakPolarHBondContact O-CB 3.1Å; I326-W329 PolarHBondContact O-N 3.17Å; L327-W329 VanDerWaalsContact C-N 3.27Å; L327-W329 PolarHBondContact O-N 3.44Å; W329-S331 VanDerWaalsContact C-N 3.31Å; W329-S331 PolarHBondContact O-N 2.97Å; W329-C332 VanDerWaalsContact O-CB 3.3Å; W329-C332 WeakPolarHBondContact O-CB 3.07Å; W329-C332 PolarHBondContact O-N 3.32Å; W329-C332 VanDerWaalsContact O-N 3.13Å; W329-M741 HydrophobicContact CH2-CE 3.53Å; W329-M741 HydrophobicContact CH2-SD 4.44Å; W329-M741 HydrophobicContact CZ3-CE 3.82Å
330	L	57	Low	70.9	Confident	100 Å²	100	55.4 Å²	55.4	52%	0.524	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-33.7	176.5	-75.8	165.9	0	0	0	111.6	I326 L327 C332	I326-L330 HydrophobicContact CG2-CD1 3.66Å; I326-L330 HydrophobicContact CG2-CG 4.14Å; I326-L330 VanDerWaalsContact O-CB 3.31Å; I326-L330 WeakPolarHBondContact O-CB 3.47Å; I326-L330 WeakPolarHBondContact O-CG 3.33Å; I326-L330 PolarHBondContact O-N 3.47Å; L327-L330 PolarHBondContact O-N 3.07Å; L330-C332 PolarHBondContact O-N 3.49Å
331	S	59.6	Low	70.5	Confident	59 Å²	59	54.7 Å²	54.7	41%	0.413	28%	0.279	S	S	.	.	H	α-helix	trans	-70.3	-19.6	175.1	-60.4	0	0	0	0	111.6	L327 D328 W329 K333 G352	L327-S331 VanDerWaalsContact O-CB 3.24Å; L327-S331 WeakPolarHBondContact O-CB 3.07Å; L327-S331 PolarHBondContact O-N 3.16Å; L327-S331 PolarHBondContact O-OG 3.26Å; D328-S331 PolarHBondContact O-N 3.38Å; W329-S331 VanDerWaalsContact C-N 3.31Å; W329-S331 PolarHBondContact O-N 2.97Å; S331-K333 PolarHBondContact O-N 3Å; S331-G352 WeakPolarHBondContact O-CA 3.49Å
332	C	58.5	Low	70.1	Confident	24 Å²	24	55 Å²	55	16%	0.162	28%	0.279	C	S	.	.			trans	-75.9	93.7	178	-66.8	0	0	0	0	111.1	D328 W329 L330 K350 F739	D328-C332 PolarHBondContact O-N 3.1Å; D328-C332 PolarHBondContact O-SG 2.94Å; W329-C332 VanDerWaalsContact O-CB 3.3Å; W329-C332 WeakPolarHBondContact O-CB 3.07Å; W329-C332 PolarHBondContact O-N 3.32Å; W329-C332 VanDerWaalsContact O-N 3.13Å; L330-C332 PolarHBondContact O-N 3.49Å; C332-K350 HydrophobicContact CB-CB 4.22Å; C332-K350 VanDerWaalsContact SG-CB 3.57Å; C332-F739 WeakPolarHBondContact O-CD2 3.21Å
333	K	67.9	Low	69.7	Low	85 Å²	85	53.4 Å²	53.4	37%	0.37	28%	0.275	S	S	.	.			trans	-79.9	-29.7	175.4	-167.7	174.8	177.6	-167.4	0	113.2	S331 I351 V354 F739	S331-K333 PolarHBondContact O-N 3Å; K333-I351 PolarHBondContact N-O 3.42Å; K333-V354 HydrophobicContact CD-CG2 4.3Å; K333-F739 PolarHBondContact O-N 3.05Å
334	Y	75.2	Confident	69.6	Low	4 Å²	4	51.6 Å²	51.6	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.1	-174.8	-55.9	-82.8	0	0	0	112.3	I351 S353 V354 V717 V736 K737 Q738	Y334-I351 PolarHBondContact N-O 3.32Å; Y334-I351 PolarHBondContact O-N 2.94Å; Y334-I351 VanDerWaalsContact O-O 3.1Å; Y334-S353 VanDerWaalsContact CD2-O 3.28Å; Y334-S353 WeakPolarHBondContact CD2-O 3.21Å; Y334-S353 WeakPolarHBondContact CE2-O 3.41Å; Y334-V354 HydrophobicContact CE2-CG2 4.45Å; Y334-V717 HydrophobicContact CD1-CG1 4.33Å; Y334-V717 HydrophobicContact CE1-CG1 4.13Å; Y334-V717 PolarHBondContact OH-O 2.85Å; Y334-V717 VanDerWaalsContact OH-O 3.09Å; Y334-V736 HydrophobicContact CD1-CG1 3.63Å; Y334-V736 HydrophobicContact CG-CG1 4.03Å; Y334-K737 CarbonylContact C-O 3.55Å; Y334-K737 WeakPolarHBondContact CA-O 3.27Å; Y334-Q738 HydrophobicContact CD1-CB 3.84Å; Y334-Q738 HydrophobicContact CD1-CG 3.93Å; Y334-Q738 HydrophobicContact CE1-CB 3.89Å; Y334-Q738 HydrophobicContact CE1-CG 3.69Å
335	N	81.2	Confident	69.8	Low	34 Å²	34	52.4 Å²	52.4	18%	0.182	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.8	167.7	-178.3	26.5	0	0	0	108.8	Y349 K737 F739	N335-Y349 CarbonylContact C-O 3.6Å; N335-Y349 WeakPolarHBondContact CA-O 3.39Å; N335-K737 PolarHBondContact N-O 3.16Å; N335-K737 PolarHBondContact O-N 3.35Å; N335-F739 HydrophobicContact CB-CE2 3.83Å; N335-F739 HydrophobicContact CB-CZ 3.83Å
336	V	82.2	Confident	70.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.6	-179.8	-169.3	0	0	0	0	109.7	V338 Y349 I351 I359 I363 C734 V735 V736	V336-V338 HydrophobicContact CG1-CG2 3.94Å; V336-Y349 PolarHBondContact N-O 3.49Å; V336-Y349 PolarHBondContact O-N 2.77Å; V336-I351 HydrophobicContact CB-CD1 4.26Å; V336-I351 HydrophobicContact CG2-CD1 3.78Å; V336-I359 HydrophobicContact CG2-CG2 3.96Å; V336-I363 HydrophobicContact CB-CD1 4.31Å; V336-I363 HydrophobicContact CG1-CD1 3.75Å; V336-C734 HydrophobicContact CG1-CB 3.95Å; V336-V735 CarbonylContact C-O 3.51Å; V336-V735 WeakPolarHBondContact CA-O 3.4Å; V336-V736 HydrophobicContact CG1-CG2 4.22Å; V336-V736 HydrophobicContact CG2-CB 4.41Å; V336-V736 HydrophobicContact CG2-CG1 4.2Å; V336-V736 HydrophobicContact CG2-CG2 3.97Å
337	H	83.2	Confident	71.2	Confident	65 Å²	65	52.4 Å²	52.4	30%	0.301	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	113.7	173.4	-178.2	-83.3	0	0	0	109.1	V339 N348 C734 V735	H337-V339 WeakPolarHBondContact CE1-CG2 3.42Å; H337-V339 VanDerWaalsContact ND1-CG2 3.33Å; H337-V339 WeakPolarHBondContact ND1-CG2 3.43Å; H337-N348 WeakPolarHBondContact CA-OD1 3.41Å; H337-N348 WeakPolarHBondContact CB-OD1 3.19Å; H337-N348 PolarHBondContact CD2-OD1 3.4Å; H337-C734 WeakPolarHBondContact O-CA 3.33Å; H337-V735 PolarHBondContact N-O 3.25Å; H337-V735 PolarHBondContact O-N 3.32Å
338	V	83.8	Confident	72.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.8	-176.7	-178.3	0	0	0	0	109.7	V336 S346 Y347 Y349 I363 F371 L732 F733 C734	V336-V338 HydrophobicContact CG1-CG2 3.94Å; V338-S346 CarbonylContact O-C 3.59Å; V338-S346 WeakPolarHBondContact O-CA 3.46Å; V338-Y347 PolarHBondContact N-O 2.88Å; V338-Y347 PolarHBondContact O-N 3.49Å; V338-Y349 HydrophobicContact CB-CD2 4.16Å; V338-Y349 HydrophobicContact CB-CE2 4.09Å; V338-Y349 HydrophobicContact CG2-CD2 3.59Å; V338-Y349 HydrophobicContact CG2-CE2 3.93Å; V338-I363 HydrophobicContact CG1-CG2 4.05Å; V338-I363 HydrophobicContact CG2-CD1 3.92Å; V338-I363 HydrophobicContact CG2-CG1 4.11Å; V338-I363 HydrophobicContact CG2-CG2 3.84Å; V338-F371 HydrophobicContact CB-CZ 4.31Å; V338-F371 HydrophobicContact CG1-CE2 4.43Å; V338-F371 HydrophobicContact CG1-CZ 3.87Å; V338-L732 HydrophobicContact CG1-CB 3.96Å; V338-L732 HydrophobicContact CG1-CD1 4.43Å; V338-L732 HydrophobicContact CG1-CD2 4.25Å; V338-L732 HydrophobicContact CG1-CG 4.45Å; V338-F733 CarbonylContact C-O 3.52Å; V338-F733 VanDerWaalsContact CA-O 3.26Å; V338-F733 WeakPolarHBondContact CA-O 3.35Å; V338-C734 HydrophobicContact CG2-CB 4.36Å
339	V	81.5	Confident	73.3	Confident	36 Å²	36	51.6 Å²	51.6	22%	0.218	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.8	179.7	-170.9	0	0	0	0	110.2	H337 L732 F733	H337-V339 WeakPolarHBondContact CE1-CG2 3.42Å; H337-V339 VanDerWaalsContact ND1-CG2 3.33Å; H337-V339 WeakPolarHBondContact ND1-CG2 3.43Å; V339-L732 CarbonylContact O-C 3.52Å; V339-L732 WeakPolarHBondContact O-CA 3.42Å; V339-F733 HydrophobicContact CB-CB 4.45Å; V339-F733 PolarHBondContact N-O 3.27Å; V339-F733 PolarHBondContact O-N 2.87Å
340	R	78.3	Confident	74.4	Confident	10 Å²	10	51.1 Å²	51.1	4%	0.038	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.4	171.3	179.9	167.6	64	-175.4	6	110.6	Q342 D343 G344 F345 F371 K372 M730 R731 L732	R340-Q342 VanDerWaalsContact C-N 3.3Å; R340-Q342 HydrophobicContact CG-CB 4.46Å; R340-Q342 PolarHBondContact O-N 3.34Å; R340-D343 WeakPolarHBondContact CB-OD1 3.38Å; R340-D343 WeakPolarHBondContact CG-OD1 3.47Å; R340-D343 IonicContact CZ-OD1 2.84Å; R340-D343 IonicContact CZ-OD2 3.23Å; R340-D343 VanDerWaalsContact NE-CG 3.3Å; R340-D343 IonicContact NE-OD1 2.81Å; R340-D343 PolarHBondContact NE-OD1 3.46Å; R340-D343 IonicContact NE-OD2 3.82Å; R340-D343 PolarHBondContact NE-OD2 2.86Å; R340-D343 IonicContact NH2-OD1 3.68Å; R340-D343 IonicContact NH2-OD2 3.73Å; R340-D343 PolarHBondContact NH2-OD2 2.96Å; R340-G344 VanDerWaalsContact O-CA 3.28Å; R340-G344 WeakPolarHBondContact O-CA 3.15Å; R340-G344 PolarHBondContact O-N 3.17Å; R340-F345 PolarHBondContact N-O 3.4Å; R340-F371 HydrophobicContact CB-CD1 3.81Å; R340-F371 HydrophobicContact CB-CE1 3.72Å; R340-K372 PolarHBondContact NH1-O 3.01Å; R340-K372 PolarHBondContact NH2-O 3.49Å; R340-M730 VanDerWaalsContact CD-CE 3.43Å; R340-M730 HydrophobicContact CG-CE 4.41Å; R340-R731 WeakPolarHBondContact CA-O 3.16Å; R340-L732 HydrophobicContact CB-CD2 3.85Å; R340-L732 HydrophobicContact CG-CD2 4.23Å
341	A	73.5	Confident	75.4	Confident	47 Å²	47	46.4 Å²	46.4	39%	0.388	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.4	-173.7	0	0	0	0	0	114.5	R731 F733	A341-R731 HydrophobicContact CB-CB 3.73Å; A341-R731 PolarHBondContact N-O 2.77Å; A341-F733 HydrophobicContact CB-CD2 4.17Å; A341-F733 HydrophobicContact CB-CE2 3.5Å; A341-F733 HydrophobicContact CB-CZ 4.31Å
342	Q	67.2	Low	75.7	Confident	48 Å²	48	45 Å²	45	22%	0.224	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-34	-170.2	-65.6	170.9	-14.8	0	0	113.5	R340 Y374 D729 M730	R340-Q342 VanDerWaalsContact C-N 3.3Å; R340-Q342 HydrophobicContact CG-CB 4.46Å; R340-Q342 PolarHBondContact O-N 3.34Å; Q342-Y374 HydrophobicContact CB-CD2 3.99Å; Q342-Y374 HydrophobicContact CB-CE2 3.89Å; Q342-Y374 HydrophobicContact CB-CG 4.49Å; Q342-D729 PolarHBondContact NE2-O 3.07Å; Q342-M730 PolarHBondContact NE2-SD 3.4Å; Q342-M730 PolarHBondContact OE1-SD 3.45Å
343	D	68.7	Low	76.1	Confident	63 Å²	63	45.2 Å²	45.2	34%	0.337	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-10.5	-175.4	62.7	-20.9	0	0	0	113.9	R340 F345 Y374	R340-D343 WeakPolarHBondContact CB-OD1 3.38Å; R340-D343 WeakPolarHBondContact CG-OD1 3.47Å; R340-D343 IonicContact CZ-OD1 2.84Å; R340-D343 IonicContact CZ-OD2 3.23Å; R340-D343 VanDerWaalsContact NE-CG 3.3Å; R340-D343 IonicContact NE-OD1 2.81Å; R340-D343 PolarHBondContact NE-OD1 3.46Å; R340-D343 IonicContact NE-OD2 3.82Å; R340-D343 PolarHBondContact NE-OD2 2.86Å; R340-D343 IonicContact NH2-OD1 3.68Å; R340-D343 IonicContact NH2-OD2 3.73Å; R340-D343 PolarHBondContact NH2-OD2 2.96Å; D343-F345 PolarHBondContact O-N 3.27Å; D343-F345 PolarHBondContact OD1-N 3.36Å; D343-F345 VanDerWaalsContact OD2-CB 3.26Å; D343-F345 WeakPolarHBondContact OD2-CB 3.35Å; D343-Y374 HydrophobicContact CB-CD2 4.21Å; D343-Y374 HydrophobicContact CB-CE2 4.29Å
344	G	72.2	Confident	76	Confident	47 Å²	47	44.1 Å²	44.1	49%	0.485	25%	0.249	S	C	.	.			trans	72.1	12.4	-175.6	0	0	0	0	0	113.4	R340 S346	R340-G344 VanDerWaalsContact O-CA 3.28Å; R340-G344 WeakPolarHBondContact O-CA 3.15Å; R340-G344 PolarHBondContact O-N 3.17Å; G344-S346 PolarHBondContact O-N 3.06Å
345	F	72.8	Confident	75.9	Confident	88 Å²	88	49.2 Å²	49.2	39%	0.386	28%	0.277	S	S	.	.			trans	-66.3	128.7	174.9	-173.7	-94.9	0	0	0	109.1	R340 D343 F371	R340-F345 PolarHBondContact N-O 3.4Å; D343-F345 PolarHBondContact O-N 3.27Å; D343-F345 PolarHBondContact OD1-N 3.36Å; D343-F345 VanDerWaalsContact OD2-CB 3.26Å; D343-F345 WeakPolarHBondContact OD2-CB 3.35Å; F345-F371 AromaticContact CD1-CD1 3.57Å; F345-F371 HydrophobicContact CD1-CD1 3.57Å; F345-F371 AromaticContact CD1-CE1 3.74Å; F345-F371 HydrophobicContact CD1-CE1 3.74Å; F345-F371 HydrophobicContact CD1-CG 4.23Å; F345-F371 HydrophobicContact CE1-CD1 4.28Å; F345-F371 HydrophobicContact CE1-CE1 4.48Å; F345-F371 WeakPolarHBondContact O-CE1 3.46Å
346	S	78.9	Confident	75.5	Confident	59 Å²	59	48.5 Å²	48.5	41%	0.413	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.7	-176.8	60.4	0	0	0	0	111.5	V338 G344	V338-S346 CarbonylContact O-C 3.59Å; V338-S346 WeakPolarHBondContact O-CA 3.46Å; G344-S346 PolarHBondContact O-N 3.06Å
347	Y	79.3	Confident	75	Confident	97 Å²	97	54.6 Å²	54.6	38%	0.38	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.6	174.5	-163.8	-92.1	0	0	0	111	V338 Y349 D370	V338-Y347 PolarHBondContact N-O 2.88Å; V338-Y347 PolarHBondContact O-N 3.49Å; Y347-Y349 AromaticContact CD1-CD1 3.93Å; Y347-Y349 HydrophobicContact CD1-CD1 3.93Å; Y347-Y349 HydrophobicContact CD1-CD2 4.12Å; Y347-Y349 AromaticContact CD1-CE1 3.55Å; Y347-Y349 HydrophobicContact CD1-CE1 3.55Å; Y347-Y349 AromaticContact CD1-CE2 3.8Å; Y347-Y349 HydrophobicContact CD1-CE2 3.8Å; Y347-Y349 HydrophobicContact CD1-CG 4.19Å; Y347-Y349 AromaticContact CD1-CZ 3.48Å; Y347-Y349 VanDerWaalsContact CD1-CZ 3.48Å; Y347-Y349 AromaticContact CE1-CD1 3.95Å; Y347-Y349 HydrophobicContact CE1-CD1 3.95Å; Y347-Y349 AromaticContact CE1-CE1 3.66Å; Y347-Y349 HydrophobicContact CE1-CE1 3.66Å; Y347-D370 HydrophobicContact CD2-CB 4.5Å
348	N	82.2	Confident	74.5	Confident	84 Å²	84	53.7 Å²	53.7	45%	0.449	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.7	-179.4	-72	-30.5	0	0	0	110.6	H337	H337-N348 WeakPolarHBondContact CA-OD1 3.41Å; H337-N348 WeakPolarHBondContact CB-OD1 3.19Å; H337-N348 PolarHBondContact CD2-OD1 3.4Å
349	Y	81	Confident	74.1	Confident	6 Å²	6	53.7 Å²	53.7	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.5	175.5	-68.5	-71.8	0	0	0	110.9	N335 V336 V338 Y347 Y362 I363 N366 A367 D370 F371	N335-Y349 CarbonylContact C-O 3.6Å; N335-Y349 WeakPolarHBondContact CA-O 3.39Å; V336-Y349 PolarHBondContact N-O 3.49Å; V336-Y349 PolarHBondContact O-N 2.77Å; V338-Y349 HydrophobicContact CB-CD2 4.16Å; V338-Y349 HydrophobicContact CB-CE2 4.09Å; V338-Y349 HydrophobicContact CG2-CD2 3.59Å; V338-Y349 HydrophobicContact CG2-CE2 3.93Å; Y347-Y349 AromaticContact CD1-CD1 3.93Å; Y347-Y349 HydrophobicContact CD1-CD1 3.93Å; Y347-Y349 HydrophobicContact CD1-CD2 4.12Å; Y347-Y349 AromaticContact CD1-CE1 3.55Å; Y347-Y349 HydrophobicContact CD1-CE1 3.55Å; Y347-Y349 AromaticContact CD1-CE2 3.8Å; Y347-Y349 HydrophobicContact CD1-CE2 3.8Å; Y347-Y349 HydrophobicContact CD1-CG 4.19Å; Y347-Y349 AromaticContact CD1-CZ 3.48Å; Y347-Y349 VanDerWaalsContact CD1-CZ 3.48Å; Y347-Y349 AromaticContact CE1-CD1 3.95Å; Y347-Y349 HydrophobicContact CE1-CD1 3.95Å; Y347-Y349 AromaticContact CE1-CE1 3.66Å; Y347-Y349 HydrophobicContact CE1-CE1 3.66Å; Y349-Y362 HydrophobicContact CD1-CD1 4.47Å; Y349-Y362 AromaticContact CD1-CE1 3.89Å; Y349-Y362 HydrophobicContact CD1-CE1 3.89Å; Y349-Y362 HydrophobicContact CG-CE1 4.38Å; Y349-I363 HydrophobicContact CD2-CG1 4.11Å; Y349-I363 HydrophobicContact CE2-CG2 4.36Å; Y349-N366 HydrophobicContact CD1-CB 4.36Å; Y349-N366 HydrophobicContact CE1-CB 3.48Å; Y349-N366 VanDerWaalsContact CE1-CB 3.48Å; Y349-A367 PolarHBondContact OH-N 2.74Å; Y349-D370 WeakPolarHBondContact CE1-OD2 3.46Å; Y349-D370 PolarHBondContact OH-OD2 2.97Å; Y349-F371 HydrophobicContact CE2-CE2 4.27Å
350	K	78.1	Confident	73.8	Confident	117 Å²	117	52 Å²	52	51%	0.509	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.6	168.4	-57	-176.6	-179.2	-178.8	0	108.8	C332	C332-K350 HydrophobicContact CB-CB 4.22Å; C332-K350 VanDerWaalsContact SG-CB 3.57Å
351	I	78.6	Confident	73.5	Confident	2 Å²	2	54 Å²	54	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.4	-171.9	-56.9	174.6	0	0	0	109.7	K333 Y334 V336 S353 I359 Y362 I363	K333-I351 PolarHBondContact N-O 3.42Å; Y334-I351 PolarHBondContact N-O 3.32Å; Y334-I351 PolarHBondContact O-N 2.94Å; Y334-I351 VanDerWaalsContact O-O 3.1Å; V336-I351 HydrophobicContact CB-CD1 4.26Å; V336-I351 HydrophobicContact CG2-CD1 3.78Å; I351-S353 VanDerWaalsContact CG2-OG 3.23Å; I351-S353 WeakPolarHBondContact CG2-OG 3.34Å; I351-I359 HydrophobicContact CD1-CB 4.44Å; I351-I359 HydrophobicContact CD1-CG2 3.84Å; I351-I359 HydrophobicContact CG2-CG1 3.99Å; I351-Y362 HydrophobicContact CD1-CD1 3.61Å; I351-Y362 HydrophobicContact CD1-CE1 4.2Å; I351-Y362 HydrophobicContact CD1-CG 4.46Å; I351-Y362 HydrophobicContact CG1-CD1 3.64Å; I351-Y362 HydrophobicContact CG1-CE1 3.78Å; I351-I363 HydrophobicContact CD1-CD1 4.39Å; I351-I363 HydrophobicContact CD1-CG1 4.14Å
352	G	66.2	Low	73.6	Confident	29 Å²	29	54.3 Å²	54.3	30%	0.299	29%	0.293	S	S	.	.			trans	-94.3	-11.1	178.8	0	0	0	0	0	116.1	S331	S331-G352 WeakPolarHBondContact O-CA 3.49Å
353	S	66.8	Low	74.3	Confident	28 Å²	28	52 Å²	52	20%	0.196	28%	0.282	C	S	.	.			trans	-82.5	146.4	-175.6	60.6	0	0	0	0	113.1	Y334 I351 S358	Y334-S353 VanDerWaalsContact CD2-O 3.28Å; Y334-S353 WeakPolarHBondContact CD2-O 3.21Å; Y334-S353 WeakPolarHBondContact CE2-O 3.41Å; I351-S353 VanDerWaalsContact CG2-OG 3.23Å; I351-S353 WeakPolarHBondContact CG2-OG 3.34Å; S353-S358 WeakPolarHBondContact CB-OG 3.49Å; S353-S358 PolarHBondContact OG-OG 3.44Å
354	V	65.6	Low	74.7	Confident	62 Å²	62	49 Å²	49	38%	0.376	27%	0.266	S	S	.	.			trans	-89.5	-20.3	179.9	-169.6	0	0	0	0	112.1	K333 Y334 V717	K333-V354 HydrophobicContact CD-CG2 4.3Å; Y334-V354 HydrophobicContact CE2-CG2 4.45Å; V354-V717 VanDerWaalsContact O-CG2 3.3Å; V354-V717 WeakPolarHBondContact O-CG2 3.35Å
355	N	71.9	Confident	74.8	Confident	111 Å²	111	52.3 Å²	52.3	59%	0.594	27%	0.267	S	S	*	.	B	Isolated β-bridge	trans	-90.1	124.9	-171.1	-63.9	-4.9	0	0	0	111.1	K357 S358 I359	N355-K357 PolarHBondContact O-N 2.75Å; N355-K357 VanDerWaalsContact O-N 3.16Å; N355-S358 PolarHBondContact O-N 2.83Å; N355-S358 PolarHBondContact O-OG 2.85Å; N355-I359 PolarHBondContact O-N 3.17Å; N355-I359 VanDerWaalsContact O-N 3.1Å
356	L	72.9	Confident	74.8	Confident	19 Å²	19	50.3 Å²	50.3	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-52.1	-41.3	177.9	-178.2	59.5	0	0	0	113.1	S358 I359 A360 L706 L708 V717 F721 F723	L356-S358 VanDerWaalsContact C-N 3.32Å; L356-S358 PolarHBondContact O-N 2.94Å; L356-I359 PolarHBondContact O-N 2.84Å; L356-A360 WeakPolarHBondContact O-CB 3.13Å; L356-A360 PolarHBondContact O-N 3.44Å; L356-L706 HydrophobicContact CD2-CD2 4.04Å; L356-L706 HydrophobicContact CG-CD2 4.21Å; L356-L708 HydrophobicContact CD2-CD2 3.52Å; L356-V717 HydrophobicContact CB-CG2 3.8Å; L356-V717 HydrophobicContact CD1-CG2 4.34Å; L356-F721 HydrophobicContact CD1-CD1 4.22Å; L356-F721 HydrophobicContact CD1-CE1 3.59Å; L356-F721 HydrophobicContact CD2-CE1 3.73Å; L356-F721 HydrophobicContact CD2-CZ 3.9Å; L356-F721 HydrophobicContact CG-CE1 4.27Å; L356-F723 HydrophobicContact CD1-CD1 3.6Å; L356-F723 HydrophobicContact CD1-CD2 4.46Å; L356-F723 HydrophobicContact CD1-CE1 3.68Å; L356-F723 HydrophobicContact CD1-CG 4.01Å; L356-F723 HydrophobicContact CD1-CZ 4.15Å
357	K	72.9	Confident	74.4	Confident	129 Å²	129	47.9 Å²	47.9	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-58	-43.3	177.4	-65.9	-173.7	-179.5	-175.3	0	112.4	N355 N361 T772	N355-K357 PolarHBondContact O-N 2.75Å; N355-K357 VanDerWaalsContact O-N 3.16Å; K357-N361 WeakPolarHBondContact O-CB 3.41Å; K357-N361 PolarHBondContact O-N 3.48Å; K357-T772 HydrophobicContact CD-CG2 4.37Å; K357-T772 PolarHBondContact NZ-OG1 3.48Å
358	S	72	Confident	73.8	Confident	45 Å²	45	47.9 Å²	47.9	32%	0.315	25%	0.25	S	C	.	.	H	α-helix	trans	-70.6	-37.8	179.6	67.5	0	0	0	0	112.2	S353 N355 L356 N361 Y362	S353-S358 WeakPolarHBondContact CB-OG 3.49Å; S353-S358 PolarHBondContact OG-OG 3.44Å; N355-S358 PolarHBondContact O-N 2.83Å; N355-S358 PolarHBondContact O-OG 2.85Å; L356-S358 VanDerWaalsContact C-N 3.32Å; L356-S358 PolarHBondContact O-N 2.94Å; S358-N361 PolarHBondContact O-N 2.98Å; S358-Y362 WeakPolarHBondContact O-CB 3.37Å; S358-Y362 PolarHBondContact O-N 3.45Å
359	I	74.9	Confident	73	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-51	173.8	-66.9	177.7	0	0	0	109.7	V336 I351 N355 L356 N361 Y362 I363 V717 F723	V336-I359 HydrophobicContact CG2-CG2 3.96Å; I351-I359 HydrophobicContact CD1-CB 4.44Å; I351-I359 HydrophobicContact CD1-CG2 3.84Å; I351-I359 HydrophobicContact CG2-CG1 3.99Å; N355-I359 PolarHBondContact O-N 3.17Å; N355-I359 VanDerWaalsContact O-N 3.1Å; L356-I359 PolarHBondContact O-N 2.84Å; I359-N361 PolarHBondContact O-N 2.89Å; I359-Y362 PolarHBondContact O-N 2.85Å; I359-I363 HydrophobicContact CG2-CD1 3.64Å; I359-I363 WeakPolarHBondContact O-CD1 3Å; I359-I363 VanDerWaalsContact O-CG1 3.27Å; I359-I363 WeakPolarHBondContact O-CG1 3.43Å; I359-I363 PolarHBondContact O-N 2.71Å; I359-V717 HydrophobicContact CD1-CB 4.35Å; I359-V717 HydrophobicContact CD1-CG1 3.97Å; I359-V717 HydrophobicContact CD1-CG2 3.9Å; I359-F723 HydrophobicContact CG2-CE1 4.17Å; I359-F723 HydrophobicContact CG2-CZ 3.8Å
360	A	75.4	Confident	72.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-46.3	178.9	0	0	0	0	0	112	L356 Y362 I363 V364 L706 F723 L725 I783	L356-A360 WeakPolarHBondContact O-CB 3.13Å; L356-A360 PolarHBondContact O-N 3.44Å; A360-Y362 PolarHBondContact O-N 2.74Å; A360-I363 PolarHBondContact O-N 3.37Å; A360-V364 WeakPolarHBondContact O-CG2 3.33Å; A360-V364 PolarHBondContact O-N 2.82Å; A360-L706 HydrophobicContact CB-CD1 4.5Å; A360-F723 HydrophobicContact CB-CE2 4.46Å; A360-L725 HydrophobicContact CB-CD2 4.05Å; A360-I783 HydrophobicContact CB-CD1 3.57Å
361	N	73.4	Confident	72	Confident	52 Å²	52	45 Å²	45	28%	0.278	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-44.4	177.5	-169.8	-3.7	0	0	0	112	K357 S358 I359 I363 V364 K365	K357-N361 WeakPolarHBondContact O-CB 3.41Å; K357-N361 PolarHBondContact O-N 3.48Å; S358-N361 PolarHBondContact O-N 2.98Å; I359-N361 PolarHBondContact O-N 2.89Å; N361-I363 VanDerWaalsContact C-N 3.34Å; N361-I363 PolarHBondContact O-N 3.38Å; N361-V364 PolarHBondContact O-N 3.19Å; N361-K365 WeakPolarHBondContact O-CG 3.34Å; N361-K365 PolarHBondContact O-N 3.33Å; N361-K365 WeakPolarHBondContact OD1-CE 3.41Å
362	Y	74.9	Confident	71.5	Confident	54 Å²	54	52.6 Å²	52.6	21%	0.212	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-43.8	176.9	-177.1	-97.9	0	0	0	112	Y349 I351 S358 I359 A360 K365 N366	Y349-Y362 HydrophobicContact CD1-CD1 4.47Å; Y349-Y362 AromaticContact CD1-CE1 3.89Å; Y349-Y362 HydrophobicContact CD1-CE1 3.89Å; Y349-Y362 HydrophobicContact CG-CE1 4.38Å; I351-Y362 HydrophobicContact CD1-CD1 3.61Å; I351-Y362 HydrophobicContact CD1-CE1 4.2Å; I351-Y362 HydrophobicContact CD1-CG 4.46Å; I351-Y362 HydrophobicContact CG1-CD1 3.64Å; I351-Y362 HydrophobicContact CG1-CE1 3.78Å; S358-Y362 WeakPolarHBondContact O-CB 3.37Å; S358-Y362 PolarHBondContact O-N 3.45Å; I359-Y362 PolarHBondContact O-N 2.85Å; A360-Y362 PolarHBondContact O-N 2.74Å; Y362-K365 PolarHBondContact O-N 3.25Å; Y362-N366 WeakPolarHBondContact CD1-ND2 3.34Å; Y362-N366 WeakPolarHBondContact CE1-ND2 3.29Å; Y362-N366 WeakPolarHBondContact CE2-ND2 3.2Å; Y362-N366 PolarHBondContact O-N 2.85Å; Y362-N366 PolarHBondContact O-ND2 2.76Å; Y362-N366 PolarHBondContact OH-ND2 2.93Å
363	I	81.5	Confident	71.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-47.8	177.3	-67.8	163.2	0	0	0	110.5	V336 V338 Y349 I351 I359 A360 N361 K365 N366 A367 F723 L725 L732	V336-I363 HydrophobicContact CB-CD1 4.31Å; V336-I363 HydrophobicContact CG1-CD1 3.75Å; V338-I363 HydrophobicContact CG1-CG2 4.05Å; V338-I363 HydrophobicContact CG2-CD1 3.92Å; V338-I363 HydrophobicContact CG2-CG1 4.11Å; V338-I363 HydrophobicContact CG2-CG2 3.84Å; Y349-I363 HydrophobicContact CD2-CG1 4.11Å; Y349-I363 HydrophobicContact CE2-CG2 4.36Å; I351-I363 HydrophobicContact CD1-CD1 4.39Å; I351-I363 HydrophobicContact CD1-CG1 4.14Å; I359-I363 HydrophobicContact CG2-CD1 3.64Å; I359-I363 WeakPolarHBondContact O-CD1 3Å; I359-I363 VanDerWaalsContact O-CG1 3.27Å; I359-I363 WeakPolarHBondContact O-CG1 3.43Å; I359-I363 PolarHBondContact O-N 2.71Å; A360-I363 PolarHBondContact O-N 3.37Å; N361-I363 VanDerWaalsContact C-N 3.34Å; N361-I363 PolarHBondContact O-N 3.38Å; I363-K365 VanDerWaalsContact C-N 3.32Å; I363-K365 PolarHBondContact O-N 3.35Å; I363-N366 PolarHBondContact O-N 2.93Å; I363-A367 WeakPolarHBondContact O-CA 3.14Å; I363-A367 WeakPolarHBondContact O-CB 3.31Å; I363-A367 PolarHBondContact O-N 2.96Å; I363-F723 HydrophobicContact CD1-CE2 4.24Å; I363-F723 HydrophobicContact CD1-CZ 3.69Å; I363-L725 HydrophobicContact CB-CD1 4.3Å; I363-L725 HydrophobicContact CG2-CD1 3.92Å; I363-L732 HydrophobicContact CG2-CD1 4.46Å
364	V	77.9	Confident	70.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-42.2	-179.5	175.6	0	0	0	0	111.3	A360 N361 L368 W704 L725 L785	A360-V364 WeakPolarHBondContact O-CG2 3.33Å; A360-V364 PolarHBondContact O-N 2.82Å; N361-V364 PolarHBondContact O-N 3.19Å; V364-L368 WeakPolarHBondContact O-CG 3.49Å; V364-L368 PolarHBondContact O-N 3.3Å; V364-W704 HydrophobicContact CG1-CD2 4.12Å; V364-W704 HydrophobicContact CG1-CG 4.17Å; V364-W704 HydrophobicContact CG1-CZ2 4.1Å; V364-W704 VanDerWaalsContact CG1-NE1 3.32Å; V364-W704 HydrophobicContact CG2-CD2 4.01Å; V364-W704 HydrophobicContact CG2-CE3 4.36Å; V364-W704 HydrophobicContact CG2-CG 4.12Å; V364-L725 HydrophobicContact CG2-CD1 3.87Å; V364-L785 HydrophobicContact CB-CD1 4.01Å; V364-L785 HydrophobicContact CG1-CD1 3.31Å
365	K	74.5	Confident	70.6	Confident	117 Å²	117	59.9 Å²	59.9	51%	0.509	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-47.9	178.2	-76	179.1	175.1	179.4	0	112.6	N361 Y362 I363	N361-K365 WeakPolarHBondContact O-CG 3.34Å; N361-K365 PolarHBondContact O-N 3.33Å; N361-K365 WeakPolarHBondContact OD1-CE 3.41Å; Y362-K365 PolarHBondContact O-N 3.25Å; I363-K365 VanDerWaalsContact C-N 3.32Å; I363-K365 PolarHBondContact O-N 3.35Å
366	N	71.6	Confident	69.8	Low	45 Å²	45	57.6 Å²	57.6	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-80.3	-28.4	-177.5	-63.6	-29	0	0	0	112.7	Y349 Y362 I363 L368 V369 D370	Y349-N366 HydrophobicContact CD1-CB 4.36Å; Y349-N366 HydrophobicContact CE1-CB 3.48Å; Y349-N366 VanDerWaalsContact CE1-CB 3.48Å; Y362-N366 WeakPolarHBondContact CD1-ND2 3.34Å; Y362-N366 WeakPolarHBondContact CE1-ND2 3.29Å; Y362-N366 WeakPolarHBondContact CE2-ND2 3.2Å; Y362-N366 PolarHBondContact O-N 2.85Å; Y362-N366 PolarHBondContact O-ND2 2.76Å; Y362-N366 PolarHBondContact OH-ND2 2.93Å; I363-N366 PolarHBondContact O-N 2.93Å; N366-L368 PolarHBondContact O-N 2.7Å; N366-V369 PolarHBondContact O-N 2.81Å; N366-D370 PolarHBondContact O-N 2.73Å
367	A	70.7	Confident	68.7	Low	9 Å²	9	62 Å²	62	7%	0.074	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-30.3	179.2	0	0	0	0	0	111.9	Y349 I363 V369 F371 L732	Y349-A367 PolarHBondContact OH-N 2.74Å; I363-A367 WeakPolarHBondContact O-CA 3.14Å; I363-A367 WeakPolarHBondContact O-CB 3.31Å; I363-A367 PolarHBondContact O-N 2.96Å; A367-V369 PolarHBondContact O-N 3.43Å; A367-F371 HydrophobicContact CB-CD2 3.66Å; A367-F371 HydrophobicContact CB-CE2 3.78Å; A367-F371 VanDerWaalsContact O-CB 3.28Å; A367-F371 WeakPolarHBondContact O-CB 3.4Å; A367-F371 WeakPolarHBondContact O-CD2 3.4Å; A367-F371 PolarHBondContact O-N 3.25Å; A367-F371 VanDerWaalsContact O-N 3.11Å; A367-L732 HydrophobicContact CB-CD1 3.98Å
368	L	66.6	Low	67.8	Low	96 Å²	96	60.7 Å²	60.7	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-24.6	173.1	-69	170.6	0	0	0	113.2	V364 N366	V364-L368 WeakPolarHBondContact O-CG 3.49Å; V364-L368 PolarHBondContact O-N 3.3Å; N366-L368 PolarHBondContact O-N 2.7Å
369	V	65.3	Low	66.9	Low	79 Å²	79	60.2 Å²	60.2	48%	0.479	31%	0.312	S	S	.	.	H	α-helix	trans	-96.4	-45.6	-179.4	-178.1	0	0	0	0	111.1	N366 A367	N366-V369 PolarHBondContact O-N 2.81Å; A367-V369 PolarHBondContact O-N 3.43Å
370	D	70.2	Confident	65.6	Low	54 Å²	54	68.2 Å²	68.2	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-79.9	-33.6	-172.4	-61.3	-38.6	0	0	0	112.9	Y347 Y349 N366 K372	Y347-D370 HydrophobicContact CD2-CB 4.5Å; Y349-D370 WeakPolarHBondContact CE1-OD2 3.46Å; Y349-D370 PolarHBondContact OH-OD2 2.97Å; N366-D370 PolarHBondContact O-N 2.73Å; D370-K372 PolarHBondContact O-N 2.98Å
371	F	68.8	Low	64.3	Low	13 Å²	13	75 Å²	75	6%	0.057	37%	0.374	C	S	.	.	S	Bend	trans	-87.2	115	179.5	-66.5	-109.5	0	0	0	109.3	V338 R340 F345 Y349 A367 L732	V338-F371 HydrophobicContact CB-CZ 4.31Å; V338-F371 HydrophobicContact CG1-CE2 4.43Å; V338-F371 HydrophobicContact CG1-CZ 3.87Å; R340-F371 HydrophobicContact CB-CD1 3.81Å; R340-F371 HydrophobicContact CB-CE1 3.72Å; F345-F371 AromaticContact CD1-CD1 3.57Å; F345-F371 HydrophobicContact CD1-CD1 3.57Å; F345-F371 AromaticContact CD1-CE1 3.74Å; F345-F371 HydrophobicContact CD1-CE1 3.74Å; F345-F371 HydrophobicContact CD1-CG 4.23Å; F345-F371 HydrophobicContact CE1-CD1 4.28Å; F345-F371 HydrophobicContact CE1-CE1 4.48Å; F345-F371 WeakPolarHBondContact O-CE1 3.46Å; Y349-F371 HydrophobicContact CE2-CE2 4.27Å; A367-F371 HydrophobicContact CB-CD2 3.66Å; A367-F371 HydrophobicContact CB-CE2 3.78Å; A367-F371 VanDerWaalsContact O-CB 3.28Å; A367-F371 WeakPolarHBondContact O-CB 3.4Å; A367-F371 WeakPolarHBondContact O-CD2 3.4Å; A367-F371 PolarHBondContact O-N 3.25Å; A367-F371 VanDerWaalsContact O-N 3.11Å; F371-L732 HydrophobicContact CE1-CD2 4.23Å; F371-L732 HydrophobicContact CZ-CD2 4.37Å
372	K	67.8	Low	63.1	Low	163 Å²	163	79.3 Å²	79.3	71%	0.709	39%	0.39	S	S	*	.			trans	-54.5	142.3	173.1	-65.7	-179.8	-178.8	176.6	0	110.3	R340 D370 Y374	R340-K372 PolarHBondContact NH1-O 3.01Å; R340-K372 PolarHBondContact NH2-O 3.49Å; D370-K372 PolarHBondContact O-N 2.98Å; K372-Y374 PolarHBondContact O-N 3.15Å
373	P	64.7	Low	61.4	Low	124 Å²	124	84.4 Å²	84.4	81%	0.805	41%	0.409	S	S	*	.			trans	-49.7	129.6	172.6	-24.5	32.4	0	0	0	109.9	D375	P373-D375 PolarHBondContact O-N 2.8Å; P373-D375 VanDerWaalsContact O-N 3.14Å
374	Y	54.9	Low	59.3	Low	78 Å²	78	89.1 Å²	89.1	31%	0.306	43%	0.434	S	S	.	.			trans	-69	111.1	179	173.2	-99.3	0	0	0	108.8	Q342 D343 K372 P376 V379	Q342-Y374 HydrophobicContact CB-CD2 3.99Å; Q342-Y374 HydrophobicContact CB-CE2 3.89Å; Q342-Y374 HydrophobicContact CB-CG 4.49Å; D343-Y374 HydrophobicContact CB-CD2 4.21Å; D343-Y374 HydrophobicContact CB-CE2 4.29Å; K372-Y374 PolarHBondContact O-N 3.15Å; Y374-P376 HydrophobicContact CE1-CB 3.92Å; Y374-P376 WeakPolarHBondContact O-CD 3.48Å; Y374-V379 HydrophobicContact CE2-CG2 3.81Å
375	D	59.2	Low	57.6	Low	69 Å²	69	91.7 Å²	91.7	37%	0.369	45%	0.452	S	S	.	.			trans	-97.9	110	171.5	-171.9	-8.6	0	0	0	109.3	P373 L377 I378	P373-D375 PolarHBondContact O-N 2.8Å; P373-D375 VanDerWaalsContact O-N 3.14Å; D375-L377 PolarHBondContact O-N 3.46Å; D375-L377 VanDerWaalsContact O-N 3.15Å; D375-L377 WeakPolarHBondContact OD1-CB 3.46Å; D375-L377 PolarHBondContact OD1-N 3.48Å; D375-I378 HydrophobicContact CB-CD1 3.8Å; D375-I378 HydrophobicContact CB-CG1 3.95Å; D375-I378 PolarHBondContact O-N 2.99Å
376	P	56.8	Low	55.7	Low	64 Å²	64	94 Å²	94	42%	0.416	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-22.1	179.9	24.6	-33	0	0	0	112.9	Y374 R380	Y374-P376 HydrophobicContact CE1-CB 3.92Å; Y374-P376 WeakPolarHBondContact O-CD 3.48Å; P376-R380 WeakPolarHBondContact O-CG 3.26Å; P376-R380 PolarHBondContact O-N 3.24Å; P376-R380 VanDerWaalsContact O-N 3.09Å
377	L	48.6	Very low	53.9	Low	110 Å²	110	99.1 Å²	99.1	58%	0.576	48%	0.475	S	S	*	.	H	α-helix	trans	-71.2	-36.7	-179	-60	178.7	0	0	0	112	D375 V379 R380 Q381	D375-L377 PolarHBondContact O-N 3.46Å; D375-L377 VanDerWaalsContact O-N 3.15Å; D375-L377 WeakPolarHBondContact OD1-CB 3.46Å; D375-L377 PolarHBondContact OD1-N 3.48Å; L377-V379 PolarHBondContact O-N 2.96Å; L377-R380 PolarHBondContact O-N 2.62Å; L377-Q381 PolarHBondContact O-N 3.36Å
378	I	54.8	Low	52.1	Low	103 Å²	103	101.7 Å²	101.7	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-39.8	178.5	-58.3	176.7	0	0	0	110.7	D375 Q381 K382	D375-I378 HydrophobicContact CB-CD1 3.8Å; D375-I378 HydrophobicContact CB-CG1 3.95Å; D375-I378 PolarHBondContact O-N 2.99Å; I378-Q381 PolarHBondContact O-N 3.36Å; I378-K382 PolarHBondContact O-N 2.75Å
379	V	51.6	Low	50.9	Low	34 Å²	34	103.7 Å²	103.7	21%	0.206	50%	0.499	C	S	.	.	H	α-helix	trans	-70.8	-38.6	176.9	-179.4	0	0	0	0	111.1	Y374 L377 Q381 K382 R383	Y374-V379 HydrophobicContact CE2-CG2 3.81Å; L377-V379 PolarHBondContact O-N 2.96Å; V379-Q381 VanDerWaalsContact C-N 3.35Å; V379-K382 PolarHBondContact O-N 3.02Å; V379-R383 PolarHBondContact O-N 3.08Å
380	R	49	Very low	49.6	Very low	169 Å²	169	102.1 Å²	102.1	64%	0.638	49%	0.491	S	S	*	.	H	α-helix	trans	-61.8	-41.9	172.8	-78.5	-175.2	-178.8	-169.1	2.1	111.4	P376 L377 K382 R383 N384	P376-R380 WeakPolarHBondContact O-CG 3.26Å; P376-R380 PolarHBondContact O-N 3.24Å; P376-R380 VanDerWaalsContact O-N 3.09Å; L377-R380 PolarHBondContact O-N 2.62Å; R380-K382 PolarHBondContact O-N 2.84Å; R380-R383 PolarHBondContact O-N 2.81Å; R380-N384 WeakPolarHBondContact O-CB 3.47Å; R380-N384 PolarHBondContact O-N 3.17Å; R380-N384 PolarHBondContact O-OD1 2.84Å
381	Q	48.4	Very low	48.2	Very low	142 Å²	142	103 Å²	103	66%	0.664	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-41.4	173.6	-77.7	179.8	-12.7	0	0	112.4	L377 I378 V379 R383 N384 S385	L377-Q381 PolarHBondContact O-N 3.36Å; I378-Q381 PolarHBondContact O-N 3.36Å; V379-Q381 VanDerWaalsContact C-N 3.35Å; Q381-R383 PolarHBondContact O-N 3.47Å; Q381-N384 PolarHBondContact O-N 2.83Å; Q381-S385 WeakPolarHBondContact O-CB 3.37Å; Q381-S385 PolarHBondContact O-N 2.87Å; Q381-S385 PolarHBondContact O-OG 3.12Å
382	K	47.2	Very low	46.5	Very low	143 Å²	143	110.7 Å²	110.7	62%	0.622	53%	0.525	S	S	*	.	H	α-helix	trans	-73.5	-24.1	179.5	-148.5	178.6	-171.4	-179.7	0	114.1	I378 V379 R380 S385	I378-K382 PolarHBondContact O-N 2.75Å; V379-K382 PolarHBondContact O-N 3.02Å; R380-K382 PolarHBondContact O-N 2.84Å; K382-S385 PolarHBondContact O-OG 2.79Å
383	R	39.6	Very low	45.1	Very low	160 Å²	160	105.4 Å²	105.4	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-81.3	-41.5	169.2	-80	-171.6	175.8	118.5	0.4	111.1	V379 R380 Q381 S385 R386 Y387	V379-R383 PolarHBondContact O-N 3.08Å; R380-R383 PolarHBondContact O-N 2.81Å; Q381-R383 PolarHBondContact O-N 3.47Å; R383-S385 VanDerWaalsContact C-N 3.3Å; R383-S385 PolarHBondContact O-N 3.49Å; R383-R386 PolarHBondContact O-N 2.79Å; R383-Y387 VanDerWaalsContact O-CB 3.28Å; R383-Y387 WeakPolarHBondContact O-CB 3.32Å; R383-Y387 PolarHBondContact O-N 3.11Å
384	N	36.8	Very low	43.7	Very low	99 Å²	99	103 Å²	103	53%	0.529	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-33.1	177.7	-71.4	-2.4	0	0	0	111.5	R380 Q381 Y387 S388	R380-N384 WeakPolarHBondContact O-CB 3.47Å; R380-N384 PolarHBondContact O-N 3.17Å; R380-N384 PolarHBondContact O-OD1 2.84Å; Q381-N384 PolarHBondContact O-N 2.83Å; N384-Y387 PolarHBondContact O-N 2.81Å; N384-S388 WeakPolarHBondContact O-CB 3.42Å; N384-S388 PolarHBondContact O-N 3Å; N384-S388 PolarHBondContact O-OG 2.84Å
385	S	42	Very low	42.7	Very low	54 Å²	54	102.7 Å²	102.7	38%	0.378	50%	0.498	S	S	.	.	H	α-helix	trans	-68.8	-32.6	173.7	65.6	0	0	0	0	113.3	Q381 K382 R383 S388 Q389	Q381-S385 WeakPolarHBondContact O-CB 3.37Å; Q381-S385 PolarHBondContact O-N 2.87Å; Q381-S385 PolarHBondContact O-OG 3.12Å; K382-S385 PolarHBondContact O-OG 2.79Å; R383-S385 VanDerWaalsContact C-N 3.3Å; R383-S385 PolarHBondContact O-N 3.49Å; S385-S388 WeakPolarHBondContact CA-OG 3.38Å; S385-S388 PolarHBondContact O-OG 3.05Å; S385-S388 VanDerWaalsContact O-OG 3.12Å; S385-Q389 WeakPolarHBondContact O-CB 3.5Å; S385-Q389 VanDerWaalsContact O-CG 3.31Å; S385-Q389 WeakPolarHBondContact O-CG 3.47Å; S385-Q389 PolarHBondContact O-N 3.1Å
386	R	35.2	Very low	41.6	Very low	167 Å²	167	103.8 Å²	103.8	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-77.9	-35.2	172.9	-82	-171.6	-89.6	178	-9.2	112.5	R383 S390	R383-R386 PolarHBondContact O-N 2.79Å; R386-S390 PolarHBondContact O-N 2.84Å
387	Y	33.2	Very low	40.5	Very low	151 Å²	151	107.6 Å²	107.6	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-73.5	-34.8	176.7	-170.3	-106.6	0	0	0	112.1	R383 N384 S390 I391	R383-Y387 VanDerWaalsContact O-CB 3.28Å; R383-Y387 WeakPolarHBondContact O-CB 3.32Å; R383-Y387 PolarHBondContact O-N 3.11Å; N384-Y387 PolarHBondContact O-N 2.81Å; Y387-S390 WeakPolarHBondContact CA-OG 3.5Å; Y387-S390 PolarHBondContact O-N 2.87Å; Y387-S390 PolarHBondContact O-OG 2.79Å; Y387-I391 HydrophobicContact CD1-CD1 3.66Å; Y387-I391 HydrophobicContact CE1-CD1 3.29Å; Y387-I391 HydrophobicContact CE1-CG1 4.34Å; Y387-I391 HydrophobicContact CG-CD1 4.42Å; Y387-I391 VanDerWaalsContact O-CG1 3.31Å; Y387-I391 WeakPolarHBondContact O-CG1 3.28Å; Y387-I391 PolarHBondContact O-N 3.21Å
388	S	34.2	Very low	39.9	Very low	63 Å²	63	107.2 Å²	107.2	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-70.8	-35.6	172.7	61.6	0	0	0	0	111.5	N384 S385 Y392	N384-S388 WeakPolarHBondContact O-CB 3.42Å; N384-S388 PolarHBondContact O-N 3Å; N384-S388 PolarHBondContact O-OG 2.84Å; S385-S388 WeakPolarHBondContact CA-OG 3.38Å; S385-S388 PolarHBondContact O-OG 3.05Å; S385-S388 VanDerWaalsContact O-OG 3.12Å; S388-Y392 WeakPolarHBondContact O-CB 3.46Å; S388-Y392 PolarHBondContact O-N 2.78Å
389	Q	39.9	Very low	38.9	Very low	139 Å²	139	107.1 Å²	107.1	65%	0.65	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-40	171.2	-80.1	176.1	-10.5	0	0	112.7	S385 Y392 S393	S385-Q389 WeakPolarHBondContact O-CB 3.5Å; S385-Q389 VanDerWaalsContact O-CG 3.31Å; S385-Q389 WeakPolarHBondContact O-CG 3.47Å; S385-Q389 PolarHBondContact O-N 3.1Å; Q389-Y392 PolarHBondContact O-N 2.64Å; Q389-S393 PolarHBondContact O-N 3.38Å; Q389-S393 PolarHBondContact O-OG 3.28Å
390	S	39.3	Very low	38.3	Very low	45 Å²	45	111.3 Å²	111.3	32%	0.315	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-40.2	176.8	63.7	0	0	0	0	112.1	R386 Y387 S393 D394	R386-S390 PolarHBondContact O-N 2.84Å; Y387-S390 WeakPolarHBondContact CA-OG 3.5Å; Y387-S390 PolarHBondContact O-N 2.87Å; Y387-S390 PolarHBondContact O-OG 2.79Å; S390-S393 WeakPolarHBondContact CA-OG 3.41Å; S390-S393 PolarHBondContact O-N 3.12Å; S390-S393 PolarHBondContact O-OG 3.14Å; S390-D394 WeakPolarHBondContact O-CB 3.28Å; S390-D394 VanDerWaalsContact O-CG 3.23Å; S390-D394 PolarHBondContact O-N 3.37Å
391	I	39.3	Very low	37.8	Very low	72 Å²	72	108.5 Å²	108.5	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-65.8	-41.5	175.1	-68	169.5	0	0	0	110.9	Y387 S393 D394 C395	Y387-I391 HydrophobicContact CD1-CD1 3.66Å; Y387-I391 HydrophobicContact CE1-CD1 3.29Å; Y387-I391 HydrophobicContact CE1-CG1 4.34Å; Y387-I391 HydrophobicContact CG-CD1 4.42Å; Y387-I391 VanDerWaalsContact O-CG1 3.31Å; Y387-I391 WeakPolarHBondContact O-CG1 3.28Å; Y387-I391 PolarHBondContact O-N 3.21Å; I391-S393 VanDerWaalsContact C-N 3.3Å; I391-S393 PolarHBondContact O-N 2.92Å; I391-D394 PolarHBondContact O-N 3.43Å; I391-C395 VanDerWaalsContact O-CB 3.26Å; I391-C395 WeakPolarHBondContact O-CB 3.46Å; I391-C395 PolarHBondContact O-N 3.47Å; I391-C395 PolarHBondContact O-SG 3.33Å; I391-C395 VanDerWaalsContact O-SG 3.39Å
392	Y	33.2	Very low	37.2	Very low	176 Å²	176	104.6 Å²	104.6	69%	0.69	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-37.1	177.7	-130.8	-90.5	0	0	0	111.8	S388 Q389 I396	S388-Y392 WeakPolarHBondContact O-CB 3.46Å; S388-Y392 PolarHBondContact O-N 2.78Å; Q389-Y392 PolarHBondContact O-N 2.64Å; Y392-I396 HydrophobicContact CD1-CD1 4.02Å; Y392-I396 HydrophobicContact CE1-CD1 4.32Å; Y392-I396 WeakPolarHBondContact O-CG1 3.22Å; Y392-I396 PolarHBondContact O-N 2.85Å
393	S	38.7	Very low	36.7	Very low	52 Å²	52	104.1 Å²	104.1	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-71.7	-34	175.3	58.4	0	0	0	0	113.5	Q389 S390 I391 R397	Q389-S393 PolarHBondContact O-N 3.38Å; Q389-S393 PolarHBondContact O-OG 3.28Å; S390-S393 WeakPolarHBondContact CA-OG 3.41Å; S390-S393 PolarHBondContact O-N 3.12Å; S390-S393 PolarHBondContact O-OG 3.14Å; I391-S393 VanDerWaalsContact C-N 3.3Å; I391-S393 PolarHBondContact O-N 2.92Å; S393-R397 WeakPolarHBondContact O-CB 3.27Å; S393-R397 PolarHBondContact O-N 3.17Å
394	D	36	Very low	36.6	Very low	72 Å²	72	101.1 Å²	101.1	39%	0.385	53%	0.53	S	S	.	.	H	α-helix	trans	-82.4	-31.8	-179.1	-68	-19.6	0	0	0	112	S390 I391 R397 N398	S390-D394 WeakPolarHBondContact O-CB 3.28Å; S390-D394 VanDerWaalsContact O-CG 3.23Å; S390-D394 PolarHBondContact O-N 3.37Å; I391-D394 PolarHBondContact O-N 3.43Å; D394-R397 PolarHBondContact O-N 3.41Å; D394-R397 IonicContact OD1-CZ 3.45Å; D394-R397 IonicContact OD1-NH1 3.79Å; D394-R397 PolarHBondContact OD1-NH1 2.77Å; D394-N398 VanDerWaalsContact O-CB 3.26Å; D394-N398 WeakPolarHBondContact O-CB 3.36Å; D394-N398 VanDerWaalsContact O-CG 3.28Å; D394-N398 PolarHBondContact O-N 3.44Å
395	C	33.9	Very low	36.7	Very low	72 Å²	72	100.8 Å²	100.8	49%	0.486	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-39.5	172.6	-78.1	0	0	0	0	112.3	I391 N398 T399	I391-C395 VanDerWaalsContact O-CB 3.26Å; I391-C395 WeakPolarHBondContact O-CB 3.46Å; I391-C395 PolarHBondContact O-N 3.47Å; I391-C395 PolarHBondContact O-SG 3.33Å; I391-C395 VanDerWaalsContact O-SG 3.39Å; C395-N398 PolarHBondContact O-N 3.4Å; C395-T399 WeakPolarHBondContact O-CB 3.26Å; C395-T399 PolarHBondContact O-N 3.25Å; C395-T399 PolarHBondContact O-OG1 3Å
396	I	35.2	Very low	36.4	Very low	93 Å²	93	102 Å²	102	48%	0.477	54%	0.536	S	S	.	.	H	α-helix	trans	-69	-39.5	174.9	-66.4	174.5	0	0	0	110.5	Y392 N398 T399 I400	Y392-I396 HydrophobicContact CD1-CD1 4.02Å; Y392-I396 HydrophobicContact CE1-CD1 4.32Å; Y392-I396 WeakPolarHBondContact O-CG1 3.22Å; Y392-I396 PolarHBondContact O-N 2.85Å; I396-N398 VanDerWaalsContact C-N 3.32Å; I396-N398 PolarHBondContact O-N 2.76Å; I396-T399 WeakPolarHBondContact CA-OG1 3.49Å; I396-T399 PolarHBondContact O-OG1 3.15Å; I396-I400 HydrophobicContact CG2-CD1 4.38Å
397	R	34.8	Very low	36.4	Very low	143 Å²	143	99.3 Å²	99.3	54%	0.54	53%	0.534	S	S	.	.	H	α-helix	trans	-68.3	-31.3	177.8	-156.4	179.9	-60.7	115.7	3.5	112.7	S393 D394	S393-R397 WeakPolarHBondContact O-CB 3.27Å; S393-R397 PolarHBondContact O-N 3.17Å; D394-R397 PolarHBondContact O-N 3.41Å; D394-R397 IonicContact OD1-CZ 3.45Å; D394-R397 IonicContact OD1-NH1 3.79Å; D394-R397 PolarHBondContact OD1-NH1 2.77Å
398	N	35.8	Very low	36.6	Very low	103 Å²	103	99.1 Å²	99.1	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-87.8	-20.9	-179.5	-73	-11.4	0	0	0	114.1	D394 C395 I396 S402	D394-N398 VanDerWaalsContact O-CB 3.26Å; D394-N398 WeakPolarHBondContact O-CB 3.36Å; D394-N398 VanDerWaalsContact O-CG 3.28Å; D394-N398 PolarHBondContact O-N 3.44Å; C395-N398 PolarHBondContact O-N 3.4Å; I396-N398 VanDerWaalsContact C-N 3.32Å; I396-N398 PolarHBondContact O-N 2.76Å; N398-S402 WeakPolarHBondContact O-CB 3.39Å; N398-S402 PolarHBondContact O-N 2.89Å; N398-S402 PolarHBondContact O-OG 2.89Å
399	T	34.1	Very low	36.9	Very low	100 Å²	100	102 Å²	102	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-76.2	-34.2	176.1	31.5	0	0	0	0	112.1	C395 I396 N401	C395-T399 WeakPolarHBondContact O-CB 3.26Å; C395-T399 PolarHBondContact O-N 3.25Å; C395-T399 PolarHBondContact O-OG1 3Å; I396-T399 WeakPolarHBondContact CA-OG1 3.49Å; I396-T399 PolarHBondContact O-OG1 3.15Å; T399-N401 VanDerWaalsContact C-N 3.32Å; T399-N401 PolarHBondContact O-N 3.35Å
400	I	38	Very low	36.8	Very low	123 Å²	123	103.7 Å²	103.7	63%	0.631	55%	0.547	S	S	*	.	H	α-helix	trans	-71.3	-27.9	179.1	-62	171.3	0	0	0	112	I396	I396-I400 HydrophobicContact CG2-CD1 4.38Å
401	N	38.5	Very low	36.9	Very low	110 Å²	110	106.5 Å²	106.5	59%	0.588	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	3.8	-176.7	-67.9	-11.1	0	0	0	114.7	T399	T399-N401 VanDerWaalsContact C-N 3.32Å; T399-N401 PolarHBondContact O-N 3.35Å
402	S	36.2	Very low	36.7	Very low	59 Å²	59	108.4 Å²	108.4	41%	0.413	57%	0.567	S	S	.	*	H	α-helix	trans	-96.4	2.9	-173.6	-74.4	0	0	0	0	116.2	N398	N398-S402 WeakPolarHBondContact O-CB 3.39Å; N398-S402 PolarHBondContact O-N 2.89Å; N398-S402 PolarHBondContact O-OG 2.89Å
403	T	36.5	Very low	37.2	Very low	134 Å²	134	102.8 Å²	102.8	82%	0.822	56%	0.557	S	S	*	*	H	α-helix	trans	-75.6	-21.2	173.2	37.8	0	0	0	0	113.6
404	S	37.2	Very low	37.2	Very low	96 Å²	96	106.7 Å²	106.7	67%	0.671	57%	0.567	S	S	*	*	H	α-helix	trans	-104	-23.1	-179.8	66.2	0	0	0	0	115.2
405	N	40	Very low	37.3	Very low	92 Å²	92	106.1 Å²	106.1	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-101.8	-5.2	-170.7	-119.2	11.1	0	0	0	115.7	N407 K408	N405-N407 PolarHBondContact O-N 3.28Å; N405-K408 PolarHBondContact O-N 2.65Å
406	C	34.5	Very low	37.7	Very low	80 Å²	80	109 Å²	109	54%	0.541	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-28.1	174.8	-91.8	0	0	0	0	113.3	R410	C406-R410 WeakPolarHBondContact O-CB 3.47Å; C406-R410 PolarHBondContact O-N 3.31Å
407	N	37	Very low	38	Very low	111 Å²	111	112.6 Å²	112.6	59%	0.594	58%	0.584	S	S	*	*	H	α-helix	trans	-74.4	-29.3	178.8	-70.4	-18.7	0	0	0	112.7	N405 N411	N405-N407 PolarHBondContact O-N 3.28Å; N407-N411 PolarHBondContact O-N 3.23Å; N407-N411 VanDerWaalsContact O-N 3.16Å; N407-N411 PolarHBondContact O-ND2 2.84Å
408	K	37.4	Very low	38.1	Very low	146 Å²	146	113.6 Å²	113.6	64%	0.635	59%	0.593	S	S	*	*	H	α-helix	trans	-74	-43.8	-178.4	-130.9	174.5	-174.2	175.2	0	112	N405 R410 N411 M412	N405-K408 PolarHBondContact O-N 2.65Å; K408-R410 VanDerWaalsContact C-N 3.35Å; K408-N411 PolarHBondContact O-N 2.91Å; K408-M412 WeakPolarHBondContact O-CG 3.42Å; K408-M412 PolarHBondContact O-N 2.77Å
409	L	40.4	Very low	38	Very low	125 Å²	125	115.4 Å²	115.4	65%	0.654	60%	0.598	S	S	*	*	H	α-helix	trans	-66.6	-35.7	175	-82.2	163	0	0	0	112.3	N411 M412 A413	L409-N411 VanDerWaalsContact C-N 3.31Å; L409-N411 PolarHBondContact O-N 3.42Å; L409-M412 PolarHBondContact O-N 3.14Å; L409-A413 WeakPolarHBondContact O-CB 3.36Å; L409-A413 PolarHBondContact O-N 3.25Å
410	R	37.3	Very low	38	Very low	173 Å²	173	118.1 Å²	118.1	65%	0.653	61%	0.605	S	S	*	*	H	α-helix	trans	-67	-32.9	176.3	-151.2	175.8	-159.7	177.9	4.9	112.4	C406 K408 K414	C406-R410 WeakPolarHBondContact O-CB 3.47Å; C406-R410 PolarHBondContact O-N 3.31Å; K408-R410 VanDerWaalsContact C-N 3.35Å; R410-K414 WeakPolarHBondContact O-CG 3.47Å; R410-K414 PolarHBondContact O-N 3.2Å
411	N	40	Very low	37.8	Very low	105 Å²	105	120.2 Å²	120.2	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-76.5	-36	175.9	-69.4	-12.3	0	0	0	112.1	N407 K408 L409 K414 S415	N407-N411 PolarHBondContact O-N 3.23Å; N407-N411 VanDerWaalsContact O-N 3.16Å; N407-N411 PolarHBondContact O-ND2 2.84Å; K408-N411 PolarHBondContact O-N 2.91Å; L409-N411 VanDerWaalsContact C-N 3.31Å; L409-N411 PolarHBondContact O-N 3.42Å; N411-K414 PolarHBondContact O-N 2.86Å; N411-S415 PolarHBondContact O-N 3.03Å; N411-S415 PolarHBondContact O-OG 3.25Å
412	M	37.1	Very low	37.8	Very low	112 Å²	112	121.6 Å²	121.6	55%	0.552	62%	0.616	S	S	*	*	H	α-helix	trans	-67.2	-39.6	173.4	-69.8	-177.9	83.5	0	0	112.5	K408 L409 K414 S415 E416	K408-M412 WeakPolarHBondContact O-CG 3.42Å; K408-M412 PolarHBondContact O-N 2.77Å; L409-M412 PolarHBondContact O-N 3.14Å; M412-K414 VanDerWaalsContact C-N 3.29Å; M412-K414 PolarHBondContact O-N 3.24Å; M412-S415 WeakPolarHBondContact CA-OG 3.3Å; M412-S415 PolarHBondContact O-N 2.83Å; M412-S415 PolarHBondContact O-OG 2.81Å; M412-E416 PolarHBondContact O-N 2.9Å
413	A	42.2	Very low	37.5	Very low	58 Å²	58	125.8 Å²	125.8	48%	0.479	63%	0.633	S	S	.	*	H	α-helix	trans	-67	-31.1	175.3	0	0	0	0	0	112.5	L409 Y417	L409-A413 WeakPolarHBondContact O-CB 3.36Å; L409-A413 PolarHBondContact O-N 3.25Å; A413-Y417 PolarHBondContact O-N 2.75Å; A413-Y417 VanDerWaalsContact O-N 3.14Å
414	K	39.5	Very low	37.1	Very low	133 Å²	133	128.5 Å²	128.5	58%	0.578	63%	0.633	S	S	*	*	H	α-helix	trans	-71.9	-33.1	173.3	-77.2	177.5	179.6	-177.2	0	112.5	R410 N411 M412 K418	R410-K414 WeakPolarHBondContact O-CG 3.47Å; R410-K414 PolarHBondContact O-N 3.2Å; N411-K414 PolarHBondContact O-N 2.86Å; M412-K414 VanDerWaalsContact C-N 3.29Å; M412-K414 PolarHBondContact O-N 3.24Å; K414-K418 PolarHBondContact O-N 2.97Å
415	S	38.5	Very low	36.7	Very low	61 Å²	61	130 Å²	130	43%	0.427	64%	0.641	S	S	.	*	H	α-helix	trans	-73.3	-40.4	174.3	57.3	0	0	0	0	111.9	N411 M412 Y417 K418 E419	N411-S415 PolarHBondContact O-N 3.03Å; N411-S415 PolarHBondContact O-OG 3.25Å; M412-S415 WeakPolarHBondContact CA-OG 3.3Å; M412-S415 PolarHBondContact O-N 2.83Å; M412-S415 PolarHBondContact O-OG 2.81Å; S415-Y417 VanDerWaalsContact C-N 3.34Å; S415-Y417 PolarHBondContact O-N 3.12Å; S415-K418 PolarHBondContact O-N 3.22Å; S415-K418 VanDerWaalsContact O-N 3.14Å; S415-E419 PolarHBondContact O-N 3.43Å
416	E	41.8	Very low	35.9	Very low	131 Å²	131	134.9 Å²	134.9	61%	0.612	66%	0.658	S	S	*	*	H	α-helix	trans	-64.2	-36.9	176.1	-77	-177.1	162.7	0	0	112.2	M412 K418 E419 M420	M412-E416 PolarHBondContact O-N 2.9Å; E416-K418 VanDerWaalsContact C-N 3.32Å; E416-K418 PolarHBondContact O-N 3.48Å; E416-E419 PolarHBondContact O-N 2.9Å; E416-M420 WeakPolarHBondContact O-CB 3.39Å; E416-M420 PolarHBondContact O-N 3.33Å
417	Y	40.5	Very low	35.4	Very low	170 Å²	170	139.4 Å²	139.4	67%	0.667	68%	0.676	S	S	*	*	H	α-helix	trans	-69.6	-28.2	175.1	-164.2	-98.8	0	0	0	113.2	A413 S415	A413-Y417 PolarHBondContact O-N 2.75Å; A413-Y417 VanDerWaalsContact O-N 3.14Å; S415-Y417 VanDerWaalsContact C-N 3.34Å; S415-Y417 PolarHBondContact O-N 3.12Å
418	K	37	Very low	34.8	Very low	164 Å²	164	139.3 Å²	139.3	71%	0.713	68%	0.679	S	S	*	*	H	α-helix	trans	-75.4	-39	173.2	-81.6	-174	175.5	-174.3	0	111.9	K414 S415 E416 K421	K414-K418 PolarHBondContact O-N 2.97Å; S415-K418 PolarHBondContact O-N 3.22Å; S415-K418 VanDerWaalsContact O-N 3.14Å; E416-K418 VanDerWaalsContact C-N 3.32Å; E416-K418 PolarHBondContact O-N 3.48Å; K418-K421 PolarHBondContact O-N 3.45Å
419	E	35	Very low	34.1	Very low	140 Å²	140	137.7 Å²	137.7	65%	0.654	69%	0.686	S	S	*	*	H	α-helix	trans	-68.3	-37.4	175	-84.9	-175.1	146.5	0	0	112.5	S415 E416 K421 I422	S415-E419 PolarHBondContact O-N 3.43Å; E416-E419 PolarHBondContact O-N 2.9Å; E419-K421 PolarHBondContact O-N 3.06Å; E419-I422 PolarHBondContact O-N 2.91Å; E419-I422 VanDerWaalsContact O-N 3.09Å
420	M	33.8	Very low	33.3	Very low	157 Å²	157	137.2 Å²	137.2	77%	0.773	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-12.8	-179.9	-150.7	170.9	-175.7	0	0	113.5	E416	E416-M420 WeakPolarHBondContact O-CB 3.39Å; E416-M420 PolarHBondContact O-N 3.33Å
421	K	33.9	Very low	32.7	Very low	167 Å²	167	135.3 Å²	135.3	73%	0.726	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-12.4	172.5	-115.8	-177.2	-179.2	-173.7	0	113.9	K418 E419	K418-K421 PolarHBondContact O-N 3.45Å; E419-K421 PolarHBondContact O-N 3.06Å
422	I	38.8	Very low	32	Very low	139 Å²	139	139.4 Å²	139.4	71%	0.713	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-11	-176.2	-61.1	174.2	0	0	0	112.5	E419	E419-I422 PolarHBondContact O-N 2.91Å; E419-I422 VanDerWaalsContact O-N 3.09Å
423	L	29.4	Very low	31.5	Very low	147 Å²	147	138.4 Å²	138.4	77%	0.77	73%	0.726	S	S	*	*			trans	-112.9	77.1	171.4	-84.2	92.9	0	0	0	112.6
424	K	27.1	Very low	30.5	Very low	191 Å²	191	145.1 Å²	145.1	83%	0.83	75%	0.745	S	S	*	*			trans	-117.6	117.6	150	-80.4	-171.5	178.5	-178	0	108.7	K426	K424-K426 PolarHBondContact O-N 3.42Å
425	P	29.4	Very low	29.8	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	75%	0.754	S	S	*	*			trans	-65	127.6	172.4	-12.4	26.2	0	0	0	109.9	L427	P425-L427 PolarHBondContact O-N 3.21Å
426	K	22.7	Very low	29	Very low	194 Å²	194	152.4 Å²	152.4	84%	0.843	78%	0.775	S	S	*	*			trans	-56	108.5	172.1	-149	172.7	-172.9	178.1	0	109	K424	K424-K426 PolarHBondContact O-N 3.42Å
427	L	25	Very low	28.1	Very low	175 Å²	175	152 Å²	152	92%	0.916	79%	0.785	S	S	*	*			trans	-89.2	107.9	163.5	-162.2	75.8	0	0	0	106.8	P425	P425-L427 PolarHBondContact O-N 3.21Å
428	T	23.9	Very low	27.4	Very low	108 Å²	108	151.7 Å²	151.7	66%	0.663	79%	0.79	S	S	*	*			trans	-77.8	121.9	179.8	41.9	0	0	0	0	111.2
429	S	22.3	Very low	27.2	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	79%	0.787	S	S	*	*			trans	56.3	103.6	144.2	62.4	0	0	0	0	120
430	S	25.2	Very low	27	Very low	116 Å²	116	147.3 Å²	147.3	81%	0.811	79%	0.788	S	S	*	*				-148.4	117.5	113.8	64.4	0	0	0	0	109.1	Q432	S430-Q432 PolarHBondContact O-N 2.91Å
431	T	23.5	Very low	26.9	Very low	133 Å²	133	147.8 Å²	147.8	82%	0.816	79%	0.789	S	S	*	*			trans	-46.9	127.5	167.7	31.1	0	0	0	0	112.2
432	Q	26.4	Very low	26.6	Very low	190 Å²	190	147.9 Å²	147.9	89%	0.888	79%	0.789	S	S	*	*				-174.6	127.3	126.3	-98.3	166.9	24.5	0	0	111.6	S430	S430-Q432 PolarHBondContact O-N 2.91Å
433	A	24.8	Very low	26.2	Very low	91 Å²	91	147.1 Å²	147.1	75%	0.752	79%	0.785	S	S	*	*			trans	20.7	127.8	159.1	0	0	0	0	0	121.3	T435	A433-T435 PolarHBondContact O-N 2.88Å
434	K	22.7	Very low	26.2	Very low	200 Å²	200	148.5 Å²	148.5	87%	0.87	79%	0.785	S	S	*	*			trans	-47.3	118.6	159	-66.8	166.9	177.6	172.7	0	111
435	T	23.4	Very low	26.4	Very low	127 Å²	127	142.9 Å²	142.9	78%	0.779	77%	0.774	S	S	*	*			trans	-146.4	107.9	149.9	-29.7	0	0	0	0	109.3	A433 C437	A433-T435 PolarHBondContact O-N 2.88Å; T435-C437 PolarHBondContact O-N 3.36Å
436	Y	22.2	Very low	26.4	Very low	220 Å²	220	144 Å²	144	86%	0.863	77%	0.773	S	S	*	*			trans	-61.4	125.4	162.9	-75.1	-94.2	0	0	0	108.3
437	C	23.5	Very low	26.8	Very low	122 Å²	122	142.3 Å²	142.3	82%	0.824	77%	0.767	S	S	*	*			trans	-160.3	117.2	156.7	-118.8	0	0	0	0	114.5	T435	T435-C437 PolarHBondContact O-N 3.36Å
438	H	25.4	Very low	27	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.755	76%	0.759	S	S	*	*			trans	10.1	148	154.5	-89.6	-95.1	0	0	0	123.9	T440	H438-T440 PolarHBondContact O-N 2.86Å
439	P	32.7	Very low	27.1	Very low	101 Å²	101	142.6 Å²	142.6	66%	0.656	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	51.6	-165.5	39.5	-36.9	0	0	0	114.4
440	T	30	Very low	27.2	Very low	111 Å²	111	142.4 Å²	142.4	68%	0.681	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-5	172.3	47.2	0	0	0	0	114.3	H438	H438-T440 PolarHBondContact O-N 2.86Å
441	Q	31.7	Very low	27.1	Very low	168 Å²	168	144.1 Å²	144.1	79%	0.785	76%	0.761	S	S	*	*	S	Bend	trans	-84.4	-17.2	174.4	-74.4	-176.5	-6.7	0	0	114.5	I443 K444	Q441-I443 PolarHBondContact O-N 3.38Å; Q441-K444 PolarHBondContact O-N 3.32Å
442	F	29	Very low	26.9	Very low	168 Å²	168	147.8 Å²	147.8	74%	0.737	76%	0.76	S	S	*	*	H	α-helix	trans	-69.6	-18.2	176.3	-108.2	-84.7	0	0	0	113.7
443	I	30.2	Very low	26.6	Very low	124 Å²	124	148 Å²	148	64%	0.636	76%	0.758	S	S	*	*	H	α-helix	trans	-76.8	-25.5	178.1	-60.6	-178.8	0	0	0	111.7	Q441	Q441-I443 PolarHBondContact O-N 3.38Å
444	K	29.1	Very low	26.4	Very low	176 Å²	176	153.2 Å²	153.2	77%	0.765	76%	0.759	S	S	*	*	H	α-helix	trans	-79.8	-21.9	176.5	-83.3	-176.6	175.5	179.9	0	114	Q441	Q441-K444 PolarHBondContact O-N 3.32Å
445	A	30.9	Very low	26.4	Very low	72 Å²	72	153.8 Å²	153.8	60%	0.595	76%	0.757	S	S	*	*	H	α-helix	trans	-77.8	-23.7	-179.7	0	0	0	0	0	113.5
446	L	29.9	Very low	26.3	Very low	154 Å²	154	155.8 Å²	155.8	81%	0.806	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-13	177.5	-90.3	156.1	0	0	0	113.8
447	H	30.9	Very low	26.2	Very low	158 Å²	158	153.6 Å²	153.6	73%	0.731	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-10.2	-179.6	-118.1	-83.2	0	0	0	114.1	N449	H447-N449 PolarHBondContact O-N 2.99Å
448	N	28.7	Very low	26	Very low	139 Å²	139	154.5 Å²	154.5	74%	0.743	75%	0.754	S	S	*	*	S	Bend	trans	-99.9	77.5	177.8	-73.3	-3.8	0	0	0	111.1
449	N	26.2	Very low	25.8	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	75%	0.753	S	S	*	*			trans	76.7	112.1	153.2	-73.3	-24.3	0	0	0	120	H447	H447-N449 PolarHBondContact O-N 2.99Å
450	P	24.9	Very low	25.2	Very low	109 Å²	109	152.6 Å²	152.6	71%	0.708	76%	0.757	S	S	*	*			trans	-81.5	154	173.1	35.8	-32.6	0	0	0	111.7
451	L	22.3	Very low	24.7	Very low	152 Å²	152	153.7 Å²	153.7	80%	0.796	76%	0.763	S	S	*	*			trans	53.1	91.9	156.7	-60.8	171.8	0	0	0	117.1
452	R	20.2	Very low	24.2	Very low	210 Å²	210	149.9 Å²	149.9	79%	0.792	76%	0.755	S	S	*	*			trans	-133.1	99.3	146.6	-80.3	-166.5	173.5	-176.5	-1.8	111.4	R454	R452-R454 PolarHBondContact O-N 3.49Å
453	F	20.6	Very low	23.9	Very low	195 Å²	195	148.9 Å²	148.9	86%	0.855	76%	0.757	S	S	*	*			trans	-57.7	120.2	148.9	-79.8	-94.8	0	0	0	107.9
454	R	20.3	Very low	23.4	Very low	200 Å²	200	149.4 Å²	149.4	76%	0.755	77%	0.766	S	S	*	*			trans	-120.9	121.3	160.9	-92.8	-174.4	179.4	161.1	-2.6	108.5	R452	R452-R454 PolarHBondContact O-N 3.49Å
455	Y	21.5	Very low	23	Very low	212 Å²	212	145.4 Å²	145.4	83%	0.831	77%	0.766	S	S	*	*			trans	-66.4	127	163.3	-93.4	-96.5	0	0	0	108.6	K457	Y455-K457 PolarHBondContact O-N 3.1Å
456	D	21.9	Very low	22.7	Very low	168 Å²	168	149.7 Å²	149.7	90%	0.898	78%	0.778	S	S	*	*			trans	-70.7	112	164.3	-76.5	-33.9	0	0	0	108.5
457	K	19.6	Very low	22.2	Very low	175 Å²	175	146.8 Å²	146.8	76%	0.761	77%	0.77	S	S	*	*			trans	-122.3	114.1	166.4	-90.9	-173.1	175.6	-177.6	0	108.4	Y455	Y455-K457 PolarHBondContact O-N 3.1Å
458	N	21.2	Very low	21.7	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	77%	0.769	S	S	*	*			trans	79.4	124.1	147.5	-55.9	-5.9	0	0	0	118.8
459	S	20.5	Very low	21.5	Very low	105 Å²	105	146 Å²	146	73%	0.734	78%	0.778	S	S	*	*				58.8	129.5	125.9	77.6	0	0	0	0	117.3
460	T	20.2	Very low	21.3	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	77%	0.772	S	S	*	*			cis	-175.6	145.9	43.7	31.2	0	0	0	0	106.4
461	V	19.5	Very low	21	Very low	134 Å²	134	145.4 Å²	145.4	81%	0.812	77%	0.773	S	S	*	*				30.5	121.6	114.5	-171.6	0	0	0	0	113
462	S	21	Very low	21.1	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	77%	0.773	S	S	*	*			cis	-161.4	169.5	38.9	42.2	0	0	0	0	107.5
463	D	23.3	Very low	21.2	Very low	147 Å²	147	139.9 Å²	139.9	79%	0.786	77%	0.768	S	S	*	*				-173.3	155.9	58.4	-90.3	-56.4	0	0	0	110.8
464	T	18.9	Very low	21.5	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	77%	0.769	S	S	*	*			trans	-74	168.4	175.2	29.7	0	0	0	0	115.9
465	A	21.7	Very low	21.5	Very low	93 Å²	93	136.5 Å²	136.5	77%	0.769	77%	0.772	S	S	*	*			trans	92.8	138.6	161.9	0	0	0	0	0	114.9
466	I	23.1	Very low	21.7	Very low	162 Å²	162	136.2 Å²	136.2	83%	0.831	78%	0.775	S	S	*	*			cis	-150.3	154.7	30.9	-71.3	173	0	0	0	110.3
467	S	19.3	Very low	21.6	Very low	92 Å²	92	133.5 Å²	133.5	64%	0.643	77%	0.765	S	S	*	*			trans	-63.6	160.7	175.3	51.5	0	0	0	0	118
468	S	20.5	Very low	21.7	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	76%	0.764	S	S	*	*			trans	60.1	115.4	138.7	62.1	0	0	0	0	120.7
469	L	26	Very low	22	Very low	179 Å²	179	132.9 Å²	132.9	94%	0.937	77%	0.769	S	S	*	*			trans	-140.8	126.8	144.4	-103.7	156.5	0	0	0	109.3
470	T	20.7	Very low	22	Very low	109 Å²	109	135 Å²	135	67%	0.669	77%	0.772	S	S	*	*			trans	-103.3	154.8	-169.4	39.6	0	0	0	0	112.4
471	D	19.8	Very low	22.2	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	77%	0.774	S	S	*	*			trans	58.5	135.1	141.2	-56.5	-20.4	0	0	0	124.2
472	N	23.5	Very low	22.4	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	77%	0.769	S	S	*	*			trans	133.8	100.3	142.6	-68.9	-20.8	0	0	0	111.4
473	S	21.2	Very low	22.3	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	78%	0.782	S	S	*	*				56	115.2	85.7	77.2	0	0	0	0	114.5
474	I	28.8	Very low	22.4	Very low	169 Å²	169	137.1 Å²	137.1	87%	0.867	78%	0.782	S	S	*	*			trans	-157.8	120.2	142.7	-89.5	141.3	0	0	0	107.5
475	N	19.9	Very low	22.4	Very low	155 Å²	155	138 Å²	138	83%	0.829	78%	0.782	S	S	*	*			trans	-70.3	145.5	167.1	-70.7	-29.1	0	0	0	110.6
476	K	26	Very low	22.8	Very low	205 Å²	205	140 Å²	140	89%	0.891	79%	0.785	S	S	*	*			trans	-155.4	121.3	141.5	-114.5	172.7	-174.8	179.7	0	111.7
477	T	19.7	Very low	22.7	Very low	111 Å²	111	138.7 Å²	138.7	68%	0.681	78%	0.779	S	S	*	*			trans	-53.6	149	172.6	35.6	0	0	0	0	116.2
478	D	20.9	Very low	23	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	79%	0.787	S	S	*	*			trans	51.3	118.7	135.8	-52.9	-26.5	0	0	0	120.6
479	L	28.5	Very low	23.2	Very low	163 Å²	163	144.8 Å²	144.8	85%	0.853	79%	0.791	S	S	*	*			trans	-154.9	105.7	133.7	-95.7	167.5	0	0	0	107.9
480	N	18.8	Very low	23.1	Very low	150 Å²	150	146.1 Å²	146.1	80%	0.802	79%	0.785	S	S	*	*			trans	-94.3	129.8	159.9	-74.1	-39.7	0	0	0	106.8
481	D	25.4	Very low	23.6	Very low	144 Å²	144	145.9 Å²	145.9	77%	0.77	79%	0.794	S	S	*	*			trans	-152.2	107	156.9	-80	-44.1	0	0	0	105.8
482	A	23.6	Very low	24	Very low	86 Å²	86	147.5 Å²	147.5	71%	0.711	80%	0.797	S	S	*	*				71	97.8	96.8	0	0	0	0	0	111.7
483	E	19.9	Very low	24.3	Very low	188 Å²	188	147.4 Å²	147.4	88%	0.879	80%	0.797	S	S	*	*				83.2	114.2	88.5	-152.9	174.4	-137.6	0	0	112.3
484	S	23.6	Very low	24.6	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	80%	0.795	S	S	*	*				163.4	130.7	129.5	49.7	0	0	0	0	112.3
485	N	19.4	Very low	24.7	Very low	152 Å²	152	146.5 Å²	146.5	81%	0.813	79%	0.793	S	S	*	*			trans	-68.9	139.8	167.9	-63.4	-54.9	0	0	0	110.6
486	V	31	Very low	25.1	Very low	137 Å²	137	150 Å²	150	83%	0.83	79%	0.794	S	S	*	*			trans	-143	104.4	150.6	179.3	0	0	0	0	106.6
487	D	21.1	Very low	25.4	Very low	133 Å²	133	149.6 Å²	149.6	71%	0.711	79%	0.792	S	S	*	*			trans	-65.5	170.9	155.6	-68.3	-57.2	0	0	0	109.6
488	D	25.4	Very low	25.8	Very low	152 Å²	152	149 Å²	149	81%	0.813	79%	0.793	S	S	*	*			trans	99.3	132.4	-179.2	-54.4	-24.9	0	0	0	112.7
489	E	24	Very low	26.2	Very low	170 Å²	170	148 Å²	148	79%	0.794	80%	0.796	S	S	*	*			cis	-166.8	166.7	-1	-161.3	168.2	-170.5	0	0	106.1	A491	E489-A491 PolarHBondContact O-N 3.49Å
490	Y	24.4	Very low	26.2	Very low	208 Å²	208	148.6 Å²	148.6	82%	0.816	79%	0.794	S	S	*	*			trans	-46.2	121.3	-174.2	-66.9	-101.1	0	0	0	116.1
491	A	31.7	Very low	26.8	Very low	104 Å²	104	146.7 Å²	146.7	86%	0.86	79%	0.788	S	S	*	*			trans	-109	80	149.1	0	0	0	0	0	108.4	E489 D493	E489-A491 PolarHBondContact O-N 3.49Å; A491-D493 PolarHBondContact O-N 3.22Å
492	E	26.8	Very low	27.3	Very low	170 Å²	170	149.7 Å²	149.7	79%	0.794	80%	0.795	S	S	*	*			trans	-64.6	109.3	153.7	-81	-171.1	143.3	0	0	107.7
493	D	30	Very low	27.9	Very low	145 Å²	145	151 Å²	151	78%	0.775	79%	0.789	S	S	*	*			trans	-152.2	104.8	152.5	-111.5	-36.2	0	0	0	113.4	A491	A491-D493 PolarHBondContact O-N 3.22Å
494	N	27.8	Very low	29	Very low	122 Å²	122	151.2 Å²	151.2	65%	0.652	79%	0.788	S	S	*	*			trans	59.4	96.8	152	-82.5	-65.1	0	0	0	120.5	R496	N494-R496 VanDerWaalsContact C-N 3.31Å; N494-R496 PolarHBondContact O-N 3.32Å
495	P	31.9	Very low	29.8	Very low	127 Å²	127	155 Å²	155	83%	0.825	79%	0.791	S	S	*	*			trans	-78.5	79.5	164	34.8	-30.9	0	0	0	109.9	K497	P495-K497 VanDerWaalsContact C-N 3.3Å
496	R	28.3	Very low	30.9	Very low	228 Å²	228	156 Å²	156	86%	0.86	79%	0.787	S	S	*	*			trans	-97.9	55.2	157.7	-75.9	-173.5	-179.2	175.5	1.8	110.2	N494 S498	N494-R496 VanDerWaalsContact C-N 3.31Å; N494-R496 PolarHBondContact O-N 3.32Å; R496-S498 PolarHBondContact O-N 3.35Å; R496-S498 VanDerWaalsContact O-N 3.08Å
497	K	31.4	Very low	31.4	Very low	197 Å²	197	157.3 Å²	157.3	86%	0.857	79%	0.787	S	S	*	*			trans	-74.6	88.5	148.3	-99.8	-179.9	177.4	175.1	0	105.6	P495 C499	P495-K497 VanDerWaalsContact C-N 3.3Å; K497-C499 PolarHBondContact O-N 3.07Å
498	S	28.7	Very low	32.9	Very low	99 Å²	99	154.3 Å²	154.3	69%	0.692	78%	0.775	S	S	*	*			trans	-39	115.2	162	48.9	0	0	0	0	108.1	R496 E500	R496-S498 PolarHBondContact O-N 3.35Å; R496-S498 VanDerWaalsContact O-N 3.08Å; S498-E500 PolarHBondContact O-N 3.37Å
499	C	28.3	Very low	34.8	Very low	119 Å²	119	152.1 Å²	152.1	80%	0.804	76%	0.763	S	S	*	*			trans	-49.2	112.4	159.4	-70.3	0	0	0	0	105.8	K497 T501	K497-C499 PolarHBondContact O-N 3.07Å; C499-T501 PolarHBondContact O-N 3.17Å
500	E	29.8	Very low	37.1	Very low	175 Å²	175	149.8 Å²	149.8	82%	0.818	75%	0.754	S	S	*	*			trans	-59.2	99.2	166.3	-73.9	176.7	170.5	0	0	105.8	S498 F502	S498-E500 PolarHBondContact O-N 3.37Å; E500-F502 PolarHBondContact O-N 2.87Å
501	T	29.6	Very low	39.3	Very low	111 Å²	111	147.9 Å²	147.9	68%	0.681	75%	0.747	S	S	*	*			trans	-48	112.5	162.6	-57.3	0	0	0	0	105.9	C499 D503	C499-T501 PolarHBondContact O-N 3.17Å; T501-D503 PolarHBondContact O-N 3.21Å
502	F	37.8	Very low	41.4	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.904	73%	0.729	S	S	*	*			trans	-62.7	91.8	172.2	-90.7	-94.3	0	0	0	107.4	E500 F504	E500-F502 PolarHBondContact O-N 2.87Å; F502-F504 PolarHBondContact O-N 3.37Å
503	D	35	Very low	43.7	Very low	113 Å²	113	143.9 Å²	143.9	60%	0.604	71%	0.713	S	S	*	*			trans	-66.3	91.3	179.3	-80.2	-23.7	0	0	0	110	T501 F505 K506	T501-D503 PolarHBondContact O-N 3.21Å; D503-F505 PolarHBondContact O-N 3.4Å; D503-K506 HydrophobicContact CB-CB 4.34Å; D503-K506 PolarHBondContact O-N 2.68Å
504	F	43.4	Very low	45.9	Very low	194 Å²	194	141.5 Å²	141.5	85%	0.851	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-14.6	173.5	-159.9	-93.5	0	0	0	112.8	F502	F502-F504 PolarHBondContact O-N 3.37Å
505	F	41.2	Very low	48.5	Very low	193 Å²	193	137.9 Å²	137.9	85%	0.846	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-1.8	-176.7	-67.4	-72.2	0	0	0	115.1	D503 M507	D503-F505 PolarHBondContact O-N 3.4Å; F505-M507 VanDerWaalsContact C-N 3.33Å; F505-M507 PolarHBondContact O-N 3.34Å
506	K	42.1	Very low	51	Low	172 Å²	172	135.2 Å²	135.2	75%	0.748	66%	0.659	S	S	*	*			trans	-79.3	90.5	171.1	-154.5	171.5	-173.7	176.9	0	108.3	D503	D503-K506 HydrophobicContact CB-CB 4.34Å; D503-K506 PolarHBondContact O-N 2.68Å
507	M	41.4	Very low	53.3	Low	165 Å²	165	126.5 Å²	126.5	81%	0.813	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-53.6	123.7	174.3	-161	157.6	111.8	0	0	108	F505 D509	F505-M507 VanDerWaalsContact C-N 3.33Å; F505-M507 PolarHBondContact O-N 3.34Å; M507-D509 PolarHBondContact O-N 3.09Å
508	P	52.3	Low	55.8	Low	71 Å²	71	120 Å²	120	46%	0.461	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-56.2	139.6	-179	-21.8	30.2	0	0	0	109.6	I510	P508-I510 PolarHBondContact O-N 3.43Å
509	D	65.8	Low	58.6	Low	106 Å²	106	122.1 Å²	122.1	57%	0.567	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-53	133.9	174.3	-175	-10.8	0	0	0	109.1	M507 Y511 E512 L513	M507-D509 PolarHBondContact O-N 3.09Å; D509-Y511 PolarHBondContact O-N 3.4Å; D509-Y511 VanDerWaalsContact O-N 3.14Å; D509-Y511 PolarHBondContact OD1-N 2.83Å; D509-Y511 VanDerWaalsContact OD1-N 3.07Å; D509-E512 HydrophobicContact CB-CB 4.3Å; D509-E512 WeakPolarHBondContact O-CA 3.32Å; D509-E512 WeakPolarHBondContact O-CB 3.28Å; D509-E512 PolarHBondContact O-N 2.74Å; D509-L513 PolarHBondContact O-N 3.37Å
510	I	71	Confident	61.1	Low	120 Å²	120	123.6 Å²	123.6	62%	0.615	60%	0.604	S	S	*	*	H	α-helix	trans	-52.7	-36.8	178.2	-64.4	170.7	0	0	0	110	P508 L513 N514	P508-I510 PolarHBondContact O-N 3.43Å; I510-L513 PolarHBondContact O-N 2.6Å; I510-N514 WeakPolarHBondContact O-CB 3.32Å; I510-N514 VanDerWaalsContact O-CG 3.24Å; I510-N514 PolarHBondContact O-N 3.29Å; I510-N514 PolarHBondContact O-ND2 3.47Å
511	Y	70.4	Confident	63.8	Low	168 Å²	168	120 Å²	120	66%	0.659	59%	0.59	S	S	*	*	H	α-helix	trans	-61.9	-46	175.3	-176.6	-96.3	0	0	0	112	D509 L513 N514 V515	D509-Y511 PolarHBondContact O-N 3.4Å; D509-Y511 VanDerWaalsContact O-N 3.14Å; D509-Y511 PolarHBondContact OD1-N 2.83Å; D509-Y511 VanDerWaalsContact OD1-N 3.07Å; Y511-L513 VanDerWaalsContact C-N 3.33Å; Y511-L513 PolarHBondContact O-N 3.42Å; Y511-N514 PolarHBondContact O-N 3.1Å; Y511-V515 HydrophobicContact CD1-CG2 4.08Å; Y511-V515 HydrophobicContact CE1-CG2 3.68Å; Y511-V515 VanDerWaalsContact O-CG2 3.31Å; Y511-V515 WeakPolarHBondContact O-CG2 3.5Å; Y511-V515 PolarHBondContact O-N 3.43Å
512	E	76.5	Confident	66.4	Low	102 Å²	102	122 Å²	122	48%	0.477	59%	0.589	S	S	.	*	H	α-helix	trans	-63.2	-41.3	177.8	-165	-173.3	163.8	0	0	111.4	D509 N514 V515 Q516	D509-E512 HydrophobicContact CB-CB 4.3Å; D509-E512 WeakPolarHBondContact O-CA 3.32Å; D509-E512 WeakPolarHBondContact O-CB 3.28Å; D509-E512 PolarHBondContact O-N 2.74Å; E512-N514 PolarHBondContact O-N 3.33Å; E512-V515 PolarHBondContact O-N 3.35Å; E512-Q516 WeakPolarHBondContact O-CG 3.47Å; E512-Q516 PolarHBondContact O-N 3.45Å; E512-Q516 PolarHBondContact OE1-NE2 2.9Å
513	L	74.6	Confident	68.6	Low	88 Å²	88	115.6 Å²	115.6	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-40.6	177.6	-163.5	132.9	0	0	0	111.8	D509 I510 Y511 Q516 A517	D509-L513 PolarHBondContact O-N 3.37Å; I510-L513 PolarHBondContact O-N 2.6Å; Y511-L513 VanDerWaalsContact C-N 3.33Å; Y511-L513 PolarHBondContact O-N 3.42Å; L513-Q516 PolarHBondContact O-N 3.18Å; L513-A517 WeakPolarHBondContact O-CB 3.41Å; L513-A517 PolarHBondContact O-N 2.86Å
514	N	76.1	Confident	71	Confident	95 Å²	95	116.1 Å²	116.1	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-64.4	-42.3	173.7	-74.9	-20	0	0	0	111.9	I510 Y511 E512 A517 A518	I510-N514 WeakPolarHBondContact O-CB 3.32Å; I510-N514 VanDerWaalsContact O-CG 3.24Å; I510-N514 PolarHBondContact O-N 3.29Å; I510-N514 PolarHBondContact O-ND2 3.47Å; Y511-N514 PolarHBondContact O-N 3.1Å; E512-N514 PolarHBondContact O-N 3.33Å; N514-A517 PolarHBondContact O-N 3.22Å; N514-A518 WeakPolarHBondContact O-CB 3.39Å; N514-A518 PolarHBondContact O-N 2.74Å
515	V	83	Confident	72.9	Confident	47 Å²	47	110.6 Å²	110.6	29%	0.285	55%	0.548	S	S	.	.	H	α-helix	trans	-63	-41.9	174.8	170.6	0	0	0	0	110.9	Y511 E512 A518 K519	Y511-V515 HydrophobicContact CD1-CG2 4.08Å; Y511-V515 HydrophobicContact CE1-CG2 3.68Å; Y511-V515 VanDerWaalsContact O-CG2 3.31Å; Y511-V515 WeakPolarHBondContact O-CG2 3.5Å; Y511-V515 PolarHBondContact O-N 3.43Å; E512-V515 PolarHBondContact O-N 3.35Å; V515-A518 PolarHBondContact O-N 3.18Å; V515-K519 HydrophobicContact CG1-CD 4.3Å; V515-K519 WeakPolarHBondContact O-CB 3.33Å; V515-K519 WeakPolarHBondContact O-CG 3.42Å; V515-K519 PolarHBondContact O-N 3.14Å
516	Q	83.4	Confident	75	Confident	71 Å²	71	104.5 Å²	104.5	33%	0.332	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-41.6	175.4	-72.4	-174.5	16	0	0	112.1	E512 L513 K519 R520	E512-Q516 WeakPolarHBondContact O-CG 3.47Å; E512-Q516 PolarHBondContact O-N 3.45Å; E512-Q516 PolarHBondContact OE1-NE2 2.9Å; L513-Q516 PolarHBondContact O-N 3.18Å; Q516-K519 PolarHBondContact O-N 3.29Å; Q516-R520 WeakPolarHBondContact O-CG 3.1Å; Q516-R520 PolarHBondContact O-N 2.91Å
517	A	78.3	Confident	77.3	Confident	45 Å²	45	100.6 Å²	100.6	37%	0.372	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-45.5	175	0	0	0	0	0	111.4	L513 N514 K519 R520 L521	L513-A517 WeakPolarHBondContact O-CB 3.41Å; L513-A517 PolarHBondContact O-N 2.86Å; N514-A517 PolarHBondContact O-N 3.22Å; A517-K519 PolarHBondContact O-N 3.41Å; A517-R520 PolarHBondContact O-N 3.1Å; A517-L521 WeakPolarHBondContact O-CB 3.49Å; A517-L521 PolarHBondContact O-N 3.22Å
518	A	82.1	Confident	79.5	Confident	60 Å²	60	97.2 Å²	97.2	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-41.2	175.2	0	0	0	0	0	112.3	N514 V515 L521 K522	N514-A518 WeakPolarHBondContact O-CB 3.39Å; N514-A518 PolarHBondContact O-N 2.74Å; V515-A518 PolarHBondContact O-N 3.18Å; A518-L521 PolarHBondContact O-N 3.28Å; A518-K522 WeakPolarHBondContact O-CB 3.49Å; A518-K522 PolarHBondContact O-N 3.36Å
519	K	87.6	Confident	81.2	Confident	143 Å²	143	101 Å²	101	62%	0.622	50%	0.504	S	S	*	.	H	α-helix	trans	-61.8	-44.7	173.4	-75.8	174.9	-178.7	176.8	0	111.9	V515 Q516 A517 K522 S523	V515-K519 HydrophobicContact CG1-CD 4.3Å; V515-K519 WeakPolarHBondContact O-CB 3.33Å; V515-K519 WeakPolarHBondContact O-CG 3.42Å; V515-K519 PolarHBondContact O-N 3.14Å; Q516-K519 PolarHBondContact O-N 3.29Å; A517-K519 PolarHBondContact O-N 3.41Å; K519-K522 PolarHBondContact O-N 3.06Å; K519-S523 WeakPolarHBondContact O-CB 3.23Å; K519-S523 PolarHBondContact O-N 2.91Å
520	R	82.7	Confident	82.4	Confident	150 Å²	150	99.9 Å²	99.9	57%	0.566	49%	0.492	S	S	*	.	H	α-helix	trans	-60.4	-49.1	176.1	-73.3	177.9	-172.3	118.7	7.4	111.2	Q516 A517 K522 S523 E524	Q516-R520 WeakPolarHBondContact O-CG 3.1Å; Q516-R520 PolarHBondContact O-N 2.91Å; A517-R520 PolarHBondContact O-N 3.1Å; R520-K522 PolarHBondContact O-N 3.34Å; R520-S523 WeakPolarHBondContact O-CB 3.41Å; R520-S523 PolarHBondContact O-N 2.84Å; R520-S523 VanDerWaalsContact O-N 3.11Å; R520-S523 PolarHBondContact O-OG 3.47Å; R520-E524 PolarHBondContact O-N 3.02Å
521	L	84.8	Confident	83.3	Confident	100 Å²	100	97 Å²	97	52%	0.524	48%	0.475	S	S	.	.	H	α-helix	trans	-59.7	-45.9	178.2	-163.3	168	0	0	0	111.1	A517 A518 S523 E524 I525	A517-L521 WeakPolarHBondContact O-CB 3.49Å; A517-L521 PolarHBondContact O-N 3.22Å; A518-L521 PolarHBondContact O-N 3.28Å; L521-S523 VanDerWaalsContact C-N 3.3Å; L521-S523 PolarHBondContact O-N 3.09Å; L521-E524 PolarHBondContact O-N 3.23Å; L521-I525 HydrophobicContact CD2-CD1 3.31Å; L521-I525 HydrophobicContact CD2-CG1 3.9Å; L521-I525 WeakPolarHBondContact O-CG1 3.45Å; L521-I525 PolarHBondContact O-N 3.13Å
522	K	84.2	Confident	84.3	Confident	153 Å²	153	97.4 Å²	97.4	67%	0.665	48%	0.476	S	S	*	.	H	α-helix	trans	-59.4	-40.4	175.2	-172.1	177.7	-178.4	179.6	0	112.1	A518 K519 R520 S526	A518-K522 WeakPolarHBondContact O-CB 3.49Å; A518-K522 PolarHBondContact O-N 3.36Å; K519-K522 PolarHBondContact O-N 3.06Å; R520-K522 PolarHBondContact O-N 3.34Å; K522-S526 WeakPolarHBondContact O-CB 3.5Å; K522-S526 PolarHBondContact O-N 3.43Å; K522-S526 PolarHBondContact O-OG 3.25Å
523	S	85.6	Confident	84.9	Confident	72 Å²	72	97.9 Å²	97.9	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-66.7	-38.1	177.1	77.1	0	0	0	0	112.4	K519 R520 L521 S526 Y527	K519-S523 WeakPolarHBondContact O-CB 3.23Å; K519-S523 PolarHBondContact O-N 2.91Å; R520-S523 WeakPolarHBondContact O-CB 3.41Å; R520-S523 PolarHBondContact O-N 2.84Å; R520-S523 VanDerWaalsContact O-N 3.11Å; R520-S523 PolarHBondContact O-OG 3.47Å; L521-S523 VanDerWaalsContact C-N 3.3Å; L521-S523 PolarHBondContact O-N 3.09Å; S523-S526 PolarHBondContact O-N 2.98Å; S523-Y527 WeakPolarHBondContact O-CB 3.28Å; S523-Y527 PolarHBondContact O-N 3.05Å
524	E	85.4	Confident	85.7	Confident	124 Å²	124	94.4 Å²	94.4	58%	0.579	46%	0.459	S	S	*	.	H	α-helix	trans	-68	-44.9	177.5	-173.2	172.1	-169.4	0	0	111.8	R520 L521 S526 Y527 L528	R520-E524 PolarHBondContact O-N 3.02Å; L521-E524 PolarHBondContact O-N 3.23Å; E524-S526 VanDerWaalsContact C-N 3.28Å; E524-S526 PolarHBondContact O-N 3.3Å; E524-Y527 WeakPolarHBondContact O-CB 3.38Å; E524-Y527 PolarHBondContact O-N 3.45Å; E524-L528 WeakPolarHBondContact O-CG 3.5Å; E524-L528 PolarHBondContact O-N 2.99Å
525	I	83.3	Confident	86.5	Confident	78 Å²	78	92 Å²	92	40%	0.4	45%	0.445	S	S	.	.	H	α-helix	trans	-58.4	-43.5	172.4	-69.6	175.3	0	0	0	110.7	L521 Y527 L528 K529	L521-I525 HydrophobicContact CD2-CD1 3.31Å; L521-I525 HydrophobicContact CD2-CG1 3.9Å; L521-I525 WeakPolarHBondContact O-CG1 3.45Å; L521-I525 PolarHBondContact O-N 3.13Å; I525-Y527 VanDerWaalsContact C-N 3.33Å; I525-Y527 PolarHBondContact O-N 2.89Å; I525-L528 PolarHBondContact O-N 3.47Å; I525-K529 HydrophobicContact CG2-CD 4.17Å; I525-K529 HydrophobicContact CG2-CG 4.41Å; I525-K529 WeakPolarHBondContact O-CB 3.4Å; I525-K529 WeakPolarHBondContact O-CG 3.29Å; I525-K529 PolarHBondContact O-N 2.86Å
526	S	85	Confident	86.9	Confident	64 Å²	64	94.9 Å²	94.9	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-63.6	-41	179.4	-57.4	0	0	0	0	111.4	K522 S523 E524 K529 Y530	K522-S526 WeakPolarHBondContact O-CB 3.5Å; K522-S526 PolarHBondContact O-N 3.43Å; K522-S526 PolarHBondContact O-OG 3.25Å; S523-S526 PolarHBondContact O-N 2.98Å; E524-S526 VanDerWaalsContact C-N 3.28Å; E524-S526 PolarHBondContact O-N 3.3Å; S526-K529 PolarHBondContact O-N 2.93Å; S526-Y530 WeakPolarHBondContact O-CB 3.18Å; S526-Y530 PolarHBondContact O-N 2.91Å
527	Y	89.9	Confident	87.3	Confident	91 Å²	91	98.1 Å²	98.1	36%	0.357	47%	0.466	S	S	.	.	H	α-helix	trans	-61.2	-47.5	172.7	167.7	-97.2	0	0	0	112	S523 E524 I525 K529 Y530 K531 L589	S523-Y527 WeakPolarHBondContact O-CB 3.28Å; S523-Y527 PolarHBondContact O-N 3.05Å; E524-Y527 WeakPolarHBondContact O-CB 3.38Å; E524-Y527 PolarHBondContact O-N 3.45Å; I525-Y527 VanDerWaalsContact C-N 3.33Å; I525-Y527 PolarHBondContact O-N 2.89Å; Y527-K529 PolarHBondContact O-N 3.42Å; Y527-Y530 PolarHBondContact O-N 2.89Å; Y527-K531 WeakPolarHBondContact O-CB 3.35Å; Y527-K531 PolarHBondContact O-N 3.09Å; Y527-L589 HydrophobicContact CD2-CD1 3.8Å; Y527-L589 HydrophobicContact CD2-CG 4.43Å; Y527-L589 HydrophobicContact CE2-CD1 3.49Å; Y527-L589 VanDerWaalsContact CE2-CD1 3.49Å; Y527-L589 HydrophobicContact CE2-CD2 4.46Å; Y527-L589 HydrophobicContact CE2-CG 3.73Å; Y527-L589 PolarHBondContact OH-O 2.81Å
528	L	88	Confident	88	Confident	94 Å²	94	96.1 Å²	96.1	49%	0.492	45%	0.449	S	S	.	.	H	α-helix	trans	-63.2	-41.9	178.6	-69.9	176.2	0	0	0	112.2	E524 I525 K531 R532	E524-L528 WeakPolarHBondContact O-CG 3.5Å; E524-L528 PolarHBondContact O-N 2.99Å; I525-L528 PolarHBondContact O-N 3.47Å; L528-K531 PolarHBondContact O-N 3.31Å; L528-R532 WeakPolarHBondContact O-CB 3.38Å; L528-R532 PolarHBondContact O-N 3.15Å
529	K	88.5	Confident	88.5	Confident	151 Å²	151	94.8 Å²	94.8	66%	0.657	44%	0.435	S	S	*	.	H	α-helix	trans	-59.9	-45.5	173.4	-76.5	-179.4	179.5	-177.1	0	111.3	I525 S526 Y527 R532 K533	I525-K529 HydrophobicContact CG2-CD 4.17Å; I525-K529 HydrophobicContact CG2-CG 4.41Å; I525-K529 WeakPolarHBondContact O-CB 3.4Å; I525-K529 WeakPolarHBondContact O-CG 3.29Å; I525-K529 PolarHBondContact O-N 2.86Å; S526-K529 PolarHBondContact O-N 2.93Å; Y527-K529 PolarHBondContact O-N 3.42Å; K529-R532 PolarHBondContact O-N 3.02Å; K529-K533 WeakPolarHBondContact O-CB 3.47Å; K529-K533 PolarHBondContact O-N 3.29Å
530	Y	90.2	Very high	88.8	Confident	82 Å²	82	91 Å²	91	32%	0.322	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-44.1	177.9	-176.3	-103.8	0	0	0	112	S526 Y527 R532 K533 C534 K585 L589	S526-Y530 WeakPolarHBondContact O-CB 3.18Å; S526-Y530 PolarHBondContact O-N 2.91Å; Y527-Y530 PolarHBondContact O-N 2.89Å; Y530-R532 PolarHBondContact O-N 3.46Å; Y530-K533 PolarHBondContact O-N 3.4Å; Y530-C534 PolarHBondContact O-N 3.17Å; Y530-K585 WeakPolarHBondContact OH-CE 3.43Å; Y530-K585 PolarHBondContact OH-NZ 2.82Å; Y530-K585 VanDerWaalsContact OH-NZ 3.08Å; Y530-L589 HydrophobicContact CD1-CD1 3.69Å; Y530-L589 HydrophobicContact CD1-CD2 3.56Å; Y530-L589 HydrophobicContact CD1-CG 4.26Å; Y530-L589 HydrophobicContact CE1-CD1 3.85Å; Y530-L589 HydrophobicContact CE1-CD2 3.81Å; Y530-L589 HydrophobicContact CE1-CG 4.37Å
531	K	90.4	Very high	89.3	Confident	58 Å²	58	87.1 Å²	87.1	25%	0.252	42%	0.421	S	S	.	.	H	α-helix	trans	-56.2	-50	174.3	-175.8	-177.3	176.1	-176.2	0	111.2	Y527 L528 K533 C534 Q535 Y586 L589	Y527-K531 WeakPolarHBondContact O-CB 3.35Å; Y527-K531 PolarHBondContact O-N 3.09Å; L528-K531 PolarHBondContact O-N 3.31Å; K531-K533 PolarHBondContact O-N 3.49Å; K531-C534 WeakPolarHBondContact O-CB 3.47Å; K531-C534 PolarHBondContact O-N 3.07Å; K531-Q535 WeakPolarHBondContact O-CG 3.33Å; K531-Q535 PolarHBondContact O-N 3.09Å; K531-Y586 WeakPolarHBondContact CE-OH 3.47Å; K531-Y586 HydrophobicContact CG-CE2 4Å; K531-L589 HydrophobicContact CB-CD2 3.92Å; K531-L589 HydrophobicContact CG-CD2 4.3Å
532	R	91.1	Very high	89.7	Confident	178 Å²	178	82.3 Å²	82.3	67%	0.672	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-41.3	178.7	-168.8	172.5	-177.1	172.2	0.2	112.1	L528 K529 Y530 C534 Q535 I536	L528-R532 WeakPolarHBondContact O-CB 3.38Å; L528-R532 PolarHBondContact O-N 3.15Å; K529-R532 PolarHBondContact O-N 3.02Å; Y530-R532 PolarHBondContact O-N 3.46Å; R532-C534 VanDerWaalsContact C-N 3.33Å; R532-C534 PolarHBondContact O-N 3.06Å; R532-Q535 PolarHBondContact O-N 3.47Å; R532-I536 HydrophobicContact CG-CD1 4.19Å; R532-I536 WeakPolarHBondContact O-CG1 2.99Å; R532-I536 PolarHBondContact O-N 3.22Å
533	K	89.8	Confident	90.1	Very high	112 Å²	112	77.6 Å²	77.6	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174.9	-172	174.9	-175.6	175.2	0	112.1	K529 Y530 K531 R537	K529-K533 WeakPolarHBondContact O-CB 3.47Å; K529-K533 PolarHBondContact O-N 3.29Å; Y530-K533 PolarHBondContact O-N 3.4Å; K531-K533 PolarHBondContact O-N 3.49Å; K533-R537 VanDerWaalsContact CE-NH2 3.3Å; K533-R537 WeakPolarHBondContact O-CB 3.4Å; K533-R537 VanDerWaalsContact O-CG 3.29Å; K533-R537 WeakPolarHBondContact O-CG 3.4Å; K533-R537 PolarHBondContact O-N 3.05Å; K533-R537 VanDerWaalsContact O-N 3.17Å
534	C	91.4	Very high	90.4	Very high	15 Å²	15	78.9 Å²	78.9	10%	0.101	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-42.6	173.9	-74.8	0	0	0	0	112.2	Y530 K531 R532 R537 L538 Y586	Y530-C534 PolarHBondContact O-N 3.17Å; K531-C534 WeakPolarHBondContact O-CB 3.47Å; K531-C534 PolarHBondContact O-N 3.07Å; R532-C534 VanDerWaalsContact C-N 3.33Å; R532-C534 PolarHBondContact O-N 3.06Å; C534-R537 PolarHBondContact O-N 3.49Å; C534-L538 VanDerWaalsContact O-CB 3.31Å; C534-L538 WeakPolarHBondContact O-CB 3.3Å; C534-L538 PolarHBondContact O-N 2.95Å; C534-Y586 HydrophobicContact CB-CD2 3.85Å
535	Q	92.4	Very high	90.7	Very high	44 Å²	44	73.2 Å²	73.2	21%	0.206	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-49.2	177.9	-67.8	177.9	-51.9	0	0	111.6	K531 R532 R537 L538 T539 Y586 F623	K531-Q535 WeakPolarHBondContact O-CG 3.33Å; K531-Q535 PolarHBondContact O-N 3.09Å; R532-Q535 PolarHBondContact O-N 3.47Å; Q535-R537 PolarHBondContact O-N 3.5Å; Q535-L538 WeakPolarHBondContact O-CB 3.29Å; Q535-L538 PolarHBondContact O-N 2.9Å; Q535-L538 VanDerWaalsContact O-N 3.13Å; Q535-T539 PolarHBondContact O-N 2.99Å; Q535-T539 PolarHBondContact O-OG1 3.19Å; Q535-T539 VanDerWaalsContact O-OG1 3.09Å; Q535-Y586 HydrophobicContact CG-CD2 4.38Å; Q535-Y586 HydrophobicContact CG-CE2 3.49Å; Q535-Y586 VanDerWaalsContact CG-CE2 3.49Å; Q535-Y586 PolarHBondContact NE2-OH 3.17Å; Q535-F623 HydrophobicContact CB-CE1 3.95Å; Q535-F623 HydrophobicContact CB-CE2 3.99Å; Q535-F623 HydrophobicContact CB-CZ 3.62Å; Q535-F623 HydrophobicContact CG-CD1 3.82Å; Q535-F623 HydrophobicContact CG-CD2 4.47Å; Q535-F623 HydrophobicContact CG-CE1 3.56Å; Q535-F623 HydrophobicContact CG-CE2 4.24Å; Q535-F623 HydrophobicContact CG-CG 4.28Å; Q535-F623 HydrophobicContact CG-CZ 3.78Å
536	I	90	Very high	91.1	Very high	108 Å²	108	69.7 Å²	69.7	55%	0.554	34%	0.336	S	S	*	.	H	α-helix	trans	-59.1	-46.7	179	-66	165.3	0	0	0	111.2	R532 L538 T539 A540	R532-I536 HydrophobicContact CG-CD1 4.19Å; R532-I536 WeakPolarHBondContact O-CG1 2.99Å; R532-I536 PolarHBondContact O-N 3.22Å; I536-L538 VanDerWaalsContact C-N 3.27Å; I536-L538 PolarHBondContact O-N 3.18Å; I536-T539 PolarHBondContact O-N 3.39Å; I536-A540 WeakPolarHBondContact O-CB 3.47Å; I536-A540 PolarHBondContact O-N 3.47Å
537	R	92.3	Very high	91.3	Very high	138 Å²	138	70.9 Å²	70.9	52%	0.521	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-38.6	177.1	-75.7	173.6	171.3	-171.1	-9.5	112.3	K533 C534 Q535 L541	K533-R537 VanDerWaalsContact CE-NH2 3.3Å; K533-R537 WeakPolarHBondContact O-CB 3.4Å; K533-R537 VanDerWaalsContact O-CG 3.29Å; K533-R537 WeakPolarHBondContact O-CG 3.4Å; K533-R537 PolarHBondContact O-N 3.05Å; K533-R537 VanDerWaalsContact O-N 3.17Å; C534-R537 PolarHBondContact O-N 3.49Å; Q535-R537 PolarHBondContact O-N 3.5Å; R537-L541 WeakPolarHBondContact O-CB 3.38Å; R537-L541 WeakPolarHBondContact O-CG 3.4Å; R537-L541 PolarHBondContact O-N 2.73Å
538	L	94.1	Very high	91.2	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-69.7	-45	-178.8	-161.8	68.6	0	0	0	111.2	C534 Q535 I536 L541 I542 L579 P582 V583 L619 F623	C534-L538 VanDerWaalsContact O-CB 3.31Å; C534-L538 WeakPolarHBondContact O-CB 3.3Å; C534-L538 PolarHBondContact O-N 2.95Å; Q535-L538 WeakPolarHBondContact O-CB 3.29Å; Q535-L538 PolarHBondContact O-N 2.9Å; Q535-L538 VanDerWaalsContact O-N 3.13Å; I536-L538 VanDerWaalsContact C-N 3.27Å; I536-L538 PolarHBondContact O-N 3.18Å; L538-L541 PolarHBondContact O-N 3.11Å; L538-I542 WeakPolarHBondContact O-CG2 3.38Å; L538-I542 PolarHBondContact O-N 2.98Å; L538-L579 HydrophobicContact CD1-CD1 3.9Å; L538-P582 HydrophobicContact CD1-CB 3.75Å; L538-V583 HydrophobicContact CD1-CG2 3.67Å; L538-V583 HydrophobicContact CD2-CG2 4.17Å; L538-V583 HydrophobicContact CG-CG2 4.39Å; L538-L619 HydrophobicContact CB-CD1 4.35Å; L538-L619 HydrophobicContact CD2-CD1 4.35Å; L538-L619 HydrophobicContact CD2-CD2 3.44Å; L538-L619 VanDerWaalsContact CD2-CD2 3.44Å; L538-L619 HydrophobicContact CG-CD1 4.12Å; L538-L619 HydrophobicContact CG-CD2 3.77Å; L538-F623 HydrophobicContact CB-CZ 4.29Å; L538-F623 HydrophobicContact CD2-CE1 3.84Å; L538-F623 HydrophobicContact CD2-CZ 4.1Å
539	T	92.8	Very high	91.2	Very high	33 Å²	33	63.8 Å²	63.8	20%	0.202	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-49.1	175	-54	0	0	0	0	111.2	Q535 I536 L541 I542 T543 E616 L619	Q535-T539 PolarHBondContact O-N 2.99Å; Q535-T539 PolarHBondContact O-OG1 3.19Å; Q535-T539 VanDerWaalsContact O-OG1 3.09Å; I536-T539 PolarHBondContact O-N 3.39Å; T539-L541 PolarHBondContact O-N 3.34Å; T539-I542 VanDerWaalsContact O-CG2 3.32Å; T539-I542 WeakPolarHBondContact O-CG2 3.06Å; T539-I542 PolarHBondContact O-N 3.48Å; T539-T543 WeakPolarHBondContact O-CB 3.39Å; T539-T543 PolarHBondContact O-N 3.42Å; T539-T543 PolarHBondContact O-OG1 2.95Å; T539-E616 HydrophobicContact CG2-CG 4.25Å; T539-L619 VanDerWaalsContact CA-CD1 3.5Å
540	A	93	Very high	91	Very high	62 Å²	62	60.8 Å²	60.8	51%	0.512	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-44.9	178.2	0	0	0	0	0	112.3	I536 D544	I536-A540 WeakPolarHBondContact O-CB 3.47Å; I536-A540 PolarHBondContact O-N 3.47Å; A540-D544 WeakPolarHBondContact O-CB 3.44Å; A540-D544 PolarHBondContact O-N 3.32Å; A540-D544 VanDerWaalsContact O-N 3.15Å
541	L	93.8	Very high	90.6	Very high	69 Å²	69	62.2 Å²	62.2	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-46.8	177.6	-86.1	171	0	0	0	112.4	R537 L538 T539 D544 L545 P582	R537-L541 WeakPolarHBondContact O-CB 3.38Å; R537-L541 WeakPolarHBondContact O-CG 3.4Å; R537-L541 PolarHBondContact O-N 2.73Å; L538-L541 PolarHBondContact O-N 3.11Å; T539-L541 PolarHBondContact O-N 3.34Å; L541-D544 PolarHBondContact O-N 3.37Å; L541-L545 WeakPolarHBondContact O-CB 3.4Å; L541-L545 WeakPolarHBondContact O-CG 3.44Å; L541-L545 PolarHBondContact O-N 3Å; L541-P582 HydrophobicContact CD1-CB 4.06Å; L541-P582 HydrophobicContact CD1-CG 3.75Å
542	I	92.6	Very high	90	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-34.8	-175.5	-163	167.3	0	0	0	112.3	L538 T539 L545 F546 L579 A615 F618 L619	L538-I542 WeakPolarHBondContact O-CG2 3.38Å; L538-I542 PolarHBondContact O-N 2.98Å; T539-I542 VanDerWaalsContact O-CG2 3.32Å; T539-I542 WeakPolarHBondContact O-CG2 3.06Å; T539-I542 PolarHBondContact O-N 3.48Å; I542-L545 PolarHBondContact O-N 3.39Å; I542-F546 HydrophobicContact CD1-CE1 3.85Å; I542-F546 HydrophobicContact CD1-CZ 4.04Å; I542-F546 HydrophobicContact CG1-CD1 3.8Å; I542-F546 HydrophobicContact CG1-CE1 3.56Å; I542-F546 HydrophobicContact CG1-CZ 4.13Å; I542-F546 WeakPolarHBondContact O-CB 3.05Å; I542-F546 WeakPolarHBondContact O-CD1 3.31Å; I542-F546 PolarHBondContact O-N 2.95Å; I542-L579 HydrophobicContact CB-CD1 4.4Å; I542-L579 HydrophobicContact CD1-CD1 4.5Å; I542-L579 HydrophobicContact CD1-CD2 4.02Å; I542-A615 HydrophobicContact CB-CB 4.27Å; I542-A615 HydrophobicContact CG1-CB 4.13Å; I542-A615 HydrophobicContact CG2-CB 3.53Å; I542-F618 HydrophobicContact CD1-CB 4.21Å; I542-F618 HydrophobicContact CD1-CD1 3.07Å; I542-F618 HydrophobicContact CD1-CE1 3.49Å; I542-F618 VanDerWaalsContact CD1-CE1 3.49Å; I542-F618 HydrophobicContact CD1-CG 3.81Å; I542-L619 HydrophobicContact CD1-CD2 4.32Å; I542-L619 HydrophobicContact CD1-CG 4.32Å; I542-L619 HydrophobicContact CG2-CD1 3.46Å; I542-L619 VanDerWaalsContact CG2-CD1 3.46Å; I542-L619 HydrophobicContact CG2-CG 3.95Å
543	T	92.7	Very high	88.8	Confident	54 Å²	54	59.8 Å²	59.8	33%	0.331	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.2	-58.5	0	0	0	0	110.7	T539 L545 F546 N547	T539-T543 WeakPolarHBondContact O-CB 3.39Å; T539-T543 PolarHBondContact O-N 3.42Å; T539-T543 PolarHBondContact O-OG1 2.95Å; T543-L545 PolarHBondContact O-N 3.5Å; T543-F546 PolarHBondContact O-N 3.36Å; T543-N547 WeakPolarHBondContact O-CB 3.23Å; T543-N547 PolarHBondContact O-N 3.19Å; T543-N547 PolarHBondContact O-ND2 3.45Å
544	D	92.4	Very high	87.6	Confident	98 Å²	98	60.3 Å²	60.3	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-42.3	174.5	-177.6	56.5	0	0	0	112.4	A540 L541 N547 T548	A540-D544 WeakPolarHBondContact O-CB 3.44Å; A540-D544 PolarHBondContact O-N 3.32Å; A540-D544 VanDerWaalsContact O-N 3.15Å; L541-D544 PolarHBondContact O-N 3.37Å; D544-N547 PolarHBondContact O-N 3.36Å; D544-T548 WeakPolarHBondContact O-CB 3.39Å; D544-T548 PolarHBondContact O-N 2.86Å; D544-T548 PolarHBondContact O-OG1 3.26Å
545	L	92.2	Very high	86.3	Confident	5 Å²	5	61 Å²	61	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-43.7	177.3	-70.4	173.5	0	0	0	112.6	L541 I542 T543 T548 V549 V575 K578 L579	L541-L545 WeakPolarHBondContact O-CB 3.4Å; L541-L545 WeakPolarHBondContact O-CG 3.44Å; L541-L545 PolarHBondContact O-N 3Å; I542-L545 PolarHBondContact O-N 3.39Å; T543-L545 PolarHBondContact O-N 3.5Å; L545-T548 WeakPolarHBondContact O-CB 3.28Å; L545-T548 PolarHBondContact O-N 2.81Å; L545-V549 WeakPolarHBondContact O-CG2 3.49Å; L545-V549 PolarHBondContact O-N 3.4Å; L545-V575 HydrophobicContact CB-CG1 4.27Å; L545-V575 HydrophobicContact CB-CG2 4.45Å; L545-V575 HydrophobicContact CD1-CG1 4.15Å; L545-K578 HydrophobicContact CD1-CB 3.92Å; L545-K578 HydrophobicContact CD2-CB 3.74Å; L545-K578 HydrophobicContact CD2-CD 3.4Å; L545-K578 HydrophobicContact CD2-CG 4.16Å; L545-K578 HydrophobicContact CG-CB 4.5Å; L545-L579 HydrophobicContact CD1-CB 4.18Å
546	F	91.3	Very high	84.6	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-45.2	178.2	-82.6	28	0	0	0	110.3	I542 T543 T548 V549 Y550 V575 L605 L609 A615 F618	I542-F546 HydrophobicContact CD1-CE1 3.85Å; I542-F546 HydrophobicContact CD1-CZ 4.04Å; I542-F546 HydrophobicContact CG1-CD1 3.8Å; I542-F546 HydrophobicContact CG1-CE1 3.56Å; I542-F546 HydrophobicContact CG1-CZ 4.13Å; I542-F546 WeakPolarHBondContact O-CB 3.05Å; I542-F546 WeakPolarHBondContact O-CD1 3.31Å; I542-F546 PolarHBondContact O-N 2.95Å; T543-F546 PolarHBondContact O-N 3.36Å; F546-T548 VanDerWaalsContact C-N 3.29Å; F546-T548 PolarHBondContact O-N 3.04Å; F546-V549 PolarHBondContact O-N 3.25Å; F546-V549 VanDerWaalsContact O-N 3.11Å; F546-Y550 HydrophobicContact CB-CD2 4.42Å; F546-Y550 HydrophobicContact CB-CE2 3.93Å; F546-Y550 HydrophobicContact CD2-CE2 4.4Å; F546-Y550 WeakPolarHBondContact O-CD2 3.43Å; F546-Y550 PolarHBondContact O-N 3.37Å; F546-V575 HydrophobicContact CD1-CG1 4.48Å; F546-V575 HydrophobicContact CE1-CG1 4.16Å; F546-L605 HydrophobicContact CE1-CD2 3.98Å; F546-L605 HydrophobicContact CZ-CD2 4.22Å; F546-L609 HydrophobicContact CD1-CD2 4.28Å; F546-L609 HydrophobicContact CE1-CD2 4.33Å; F546-L609 HydrophobicContact CG-CD2 4.46Å; F546-A615 HydrophobicContact CD2-CB 3.89Å; F546-A615 HydrophobicContact CE2-CB 4.22Å; F546-A615 HydrophobicContact CG-CB 4.24Å; F546-F618 HydrophobicContact CZ-CB 4.44Å
547	N	88.1	Confident	83	Confident	89 Å²	89	59.7 Å²	59.7	48%	0.476	33%	0.331	S	S	.	.	H	α-helix	trans	-58.8	-40.3	174.2	-68.8	-12.4	0	0	0	111.9	T543 D544 V549 Y550 T551	T543-N547 WeakPolarHBondContact O-CB 3.23Å; T543-N547 PolarHBondContact O-N 3.19Å; T543-N547 PolarHBondContact O-ND2 3.45Å; D544-N547 PolarHBondContact O-N 3.36Å; N547-V549 VanDerWaalsContact C-N 3.34Å; N547-V549 PolarHBondContact O-N 3.12Å; N547-Y550 PolarHBondContact O-N 3.04Å; N547-T551 WeakPolarHBondContact O-CB 3.15Å; N547-T551 VanDerWaalsContact O-CG2 3.23Å; N547-T551 WeakPolarHBondContact O-CG2 3.45Å; N547-T551 PolarHBondContact O-N 3.39Å; N547-T551 PolarHBondContact O-OG1 3.43Å
548	T	89.4	Confident	81.1	Confident	29 Å²	29	59.6 Å²	59.6	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-38.4	176.2	-57.7	0	0	0	0	112.2	D544 L545 F546 T551 K552 Y574	D544-T548 WeakPolarHBondContact O-CB 3.39Å; D544-T548 PolarHBondContact O-N 2.86Å; D544-T548 PolarHBondContact O-OG1 3.26Å; L545-T548 WeakPolarHBondContact O-CB 3.28Å; L545-T548 PolarHBondContact O-N 2.81Å; F546-T548 VanDerWaalsContact C-N 3.29Å; F546-T548 PolarHBondContact O-N 3.04Å; T548-T551 WeakPolarHBondContact CA-OG1 3.44Å; T548-T551 PolarHBondContact O-OG1 2.75Å; T548-K552 HydrophobicContact CG2-CD 3.99Å; T548-K552 HydrophobicContact CG2-CG 4.42Å; T548-K552 WeakPolarHBondContact O-CB 3.43Å; T548-K552 WeakPolarHBondContact O-CG 3.25Å; T548-K552 PolarHBondContact O-N 3.5Å; T548-Y574 HydrophobicContact CG2-CE1 4.12Å
549	V	87.1	Confident	78.8	Confident	8 Å²	8	63.8 Å²	63.8	5%	0.048	38%	0.376	C	S	.	.	H	α-helix	trans	-69.6	-41.8	177.7	172.4	0	0	0	0	110.9	L545 F546 N547 T551 F555 Y574 V575 L609	L545-V549 WeakPolarHBondContact O-CG2 3.49Å; L545-V549 PolarHBondContact O-N 3.4Å; F546-V549 PolarHBondContact O-N 3.25Å; F546-V549 VanDerWaalsContact O-N 3.11Å; N547-V549 VanDerWaalsContact C-N 3.34Å; N547-V549 PolarHBondContact O-N 3.12Å; V549-T551 VanDerWaalsContact C-N 3.33Å; V549-T551 PolarHBondContact O-N 2.94Å; V549-F555 HydrophobicContact CB-CD2 4.44Å; V549-F555 HydrophobicContact CG1-CB 4.01Å; V549-F555 HydrophobicContact CG1-CD2 4.31Å; V549-F555 HydrophobicContact CG1-CG 4.28Å; V549-F555 HydrophobicContact CG2-CD2 4.37Å; V549-Y574 HydrophobicContact CG2-CD1 4.01Å; V549-Y574 HydrophobicContact CG2-CE1 4.35Å; V549-V575 HydrophobicContact CG2-CG2 3.53Å; V549-L609 HydrophobicContact CB-CD2 4.4Å; V549-L609 HydrophobicContact CG1-CD1 4.49Å; V549-L609 HydrophobicContact CG1-CD2 4.01Å
550	Y	84.4	Confident	76.8	Confident	87 Å²	87	67.3 Å²	67.3	34%	0.341	40%	0.397	S	S	.	.	H	α-helix	trans	-72.2	-24.5	179.4	-59.6	-44.3	0	0	0	113.8	F546 N547 L609 N612	F546-Y550 HydrophobicContact CB-CD2 4.42Å; F546-Y550 HydrophobicContact CB-CE2 3.93Å; F546-Y550 HydrophobicContact CD2-CE2 4.4Å; F546-Y550 WeakPolarHBondContact O-CD2 3.43Å; F546-Y550 PolarHBondContact O-N 3.37Å; N547-Y550 PolarHBondContact O-N 3.04Å; Y550-L609 HydrophobicContact CE1-CD2 4.2Å; Y550-N612 VanDerWaalsContact CE2-OD1 3.28Å; Y550-N612 WeakPolarHBondContact CE2-OD1 3.46Å; Y550-N612 WeakPolarHBondContact OH-CA 3.43Å; Y550-N612 PolarHBondContact OH-OD1 3.13Å
551	T	81.6	Confident	74.7	Confident	113 Å²	113	70.8 Å²	70.8	69%	0.693	41%	0.407	S	S	*	.	H	α-helix	trans	-89.3	-28.5	-179.8	49.4	0	0	0	0	114	N547 T548 V549 S553	N547-T551 WeakPolarHBondContact O-CB 3.15Å; N547-T551 VanDerWaalsContact O-CG2 3.23Å; N547-T551 WeakPolarHBondContact O-CG2 3.45Å; N547-T551 PolarHBondContact O-N 3.39Å; N547-T551 PolarHBondContact O-OG1 3.43Å; T548-T551 WeakPolarHBondContact CA-OG1 3.44Å; T548-T551 PolarHBondContact O-OG1 2.75Å; V549-T551 VanDerWaalsContact C-N 3.33Å; V549-T551 PolarHBondContact O-N 2.94Å; T551-S553 PolarHBondContact O-N 3.34Å
552	K	78.4	Confident	72.7	Confident	86 Å²	86	72.6 Å²	72.6	37%	0.374	43%	0.425	S	S	.	.			trans	-78.8	122	179.5	-79.1	-177.2	173.9	-164.7	0	111.3	T548 D554 F555	T548-K552 HydrophobicContact CG2-CD 3.99Å; T548-K552 HydrophobicContact CG2-CG 4.42Å; T548-K552 WeakPolarHBondContact O-CB 3.43Å; T548-K552 WeakPolarHBondContact O-CG 3.25Å; T548-K552 PolarHBondContact O-N 3.5Å; K552-D554 PolarHBondContact O-N 3.32Å; K552-F555 HydrophobicContact CB-CD2 3.76Å; K552-F555 HydrophobicContact CB-CE2 4.23Å; K552-F555 HydrophobicContact CD-CD2 4.25Å; K552-F555 HydrophobicContact CD-CE2 3.86Å; K552-F555 PolarHBondContact O-N 2.95Å; K552-F555 VanDerWaalsContact O-N 3.09Å
553	S	65	Low	71.1	Confident	99 Å²	99	75 Å²	75	69%	0.692	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-54.5	-31.7	174.4	52.3	0	0	0	0	113.6	T551 F555 A556	T551-S553 PolarHBondContact O-N 3.34Å; S553-F555 PolarHBondContact O-N 2.91Å; S553-A556 WeakPolarHBondContact O-CB 3.09Å; S553-A556 PolarHBondContact O-N 3.3Å; S553-A556 VanDerWaalsContact O-N 3.07Å
554	D	64.7	Low	69.8	Low	122 Å²	122	74.7 Å²	74.7	65%	0.652	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-59.1	-20.3	178.9	-61.2	-17.8	0	0	0	113.6	K552	K552-D554 PolarHBondContact O-N 3.32Å
555	F	64.8	Low	68.9	Low	30 Å²	30	76.5 Å²	76.5	13%	0.132	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-113.7	-2.6	-179.7	-57.1	-54.6	0	0	0	113.3	V549 K552 S553 V557 S571 Y574	V549-F555 HydrophobicContact CB-CD2 4.44Å; V549-F555 HydrophobicContact CG1-CB 4.01Å; V549-F555 HydrophobicContact CG1-CD2 4.31Å; V549-F555 HydrophobicContact CG1-CG 4.28Å; V549-F555 HydrophobicContact CG2-CD2 4.37Å; K552-F555 HydrophobicContact CB-CD2 3.76Å; K552-F555 HydrophobicContact CB-CE2 4.23Å; K552-F555 HydrophobicContact CD-CD2 4.25Å; K552-F555 HydrophobicContact CD-CE2 3.86Å; K552-F555 PolarHBondContact O-N 2.95Å; K552-F555 VanDerWaalsContact O-N 3.09Å; S553-F555 PolarHBondContact O-N 2.91Å; F555-V557 PolarHBondContact O-N 3.05Å; F555-S571 WeakPolarHBondContact CB-OG 3.42Å; F555-S571 WeakPolarHBondContact CD1-OG 3.43Å; F555-S571 WeakPolarHBondContact CG-OG 3.39Å; F555-Y574 HydrophobicContact CE2-CD1 4.15Å; F555-Y574 HydrophobicContact CE2-CE1 4.44Å; F555-Y574 HydrophobicContact CE2-CG 4.41Å; F555-Y574 HydrophobicContact CZ-CD1 4.13Å; F555-Y574 HydrophobicContact CZ-CD2 4.46Å; F555-Y574 AromaticContact CZ-CG 3.96Å; F555-Y574 HydrophobicContact CZ-CG 3.96Å
556	A	57.1	Low	68.1	Low	40 Å²	40	81.7 Å²	81.7	33%	0.331	48%	0.475	S	S	.	.			trans	-65.9	116.4	-176.6	0	0	0	0	0	110.1	S553 N558	S553-A556 WeakPolarHBondContact O-CB 3.09Å; S553-A556 PolarHBondContact O-N 3.3Å; S553-A556 VanDerWaalsContact O-N 3.07Å; A556-N558 VanDerWaalsContact C-N 3.26Å; A556-N558 PolarHBondContact O-N 3.44Å
557	V	55.2	Low	67.6	Low	85 Å²	85	84.1 Å²	84.1	52%	0.515	49%	0.486	S	S	.	.			trans	-72.7	82	177	-176	0	0	0	0	108.3	F555 A559	F555-V557 PolarHBondContact O-N 3.05Å; V557-A559 PolarHBondContact O-N 3.44Å
558	N	51.9	Low	67.4	Low	136 Å²	136	80.8 Å²	80.8	73%	0.727	47%	0.469	S	S	*	.			trans	-75.5	114	164.1	-73	-19.5	0	0	0	107.5	A556 V560	A556-N558 VanDerWaalsContact C-N 3.26Å; A556-N558 PolarHBondContact O-N 3.44Å; N558-V560 PolarHBondContact O-N 3.19Å
559	A	46.6	Very low	67.2	Low	91 Å²	91	82 Å²	82	75%	0.752	47%	0.472	S	S	*	.	S	Bend	trans	-72.6	85.1	-167.1	0	0	0	0	0	113.2	V557	V557-A559 PolarHBondContact O-N 3.44Å
560	V	50.9	Low	67.2	Low	107 Å²	107	88.4 Å²	88.4	65%	0.648	50%	0.499	S	S	*	.	S	Bend	trans	-153.3	115.6	154.6	-173.3	0	0	0	0	109.6	N558 S563	N558-V560 PolarHBondContact O-N 3.19Å; V560-S563 PolarHBondContact O-OG 2.91Å
561	D	48.4	Very low	67.4	Low	135 Å²	135	84.5 Å²	84.5	72%	0.722	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.4	121.8	154.9	-54.2	-28.8	0	0	0	121.5	S563	D561-S563 PolarHBondContact O-N 3.28Å
562	S	51.6	Low	67.8	Low	107 Å²	107	79.1 Å²	79.1	75%	0.748	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-30.7	169.3	73.2	0	0	0	0	118.5	S564	S562-S564 VanDerWaalsContact C-N 3.33Å
563	S	58.9	Low	68.4	Low	51 Å²	51	78.7 Å²	78.7	36%	0.357	45%	0.451	S	S	.	.	H	α-helix	trans	-72.1	-27.9	177.9	67.6	0	0	0	0	112.9	V560 D561 E565 N566 Q567	V560-S563 PolarHBondContact O-OG 2.91Å; D561-S563 PolarHBondContact O-N 3.28Å; S563-E565 PolarHBondContact O-N 2.88Å; S563-N566 PolarHBondContact O-N 3.32Å; S563-Q567 WeakPolarHBondContact O-CG 3.24Å; S563-Q567 PolarHBondContact O-N 3.41Å
564	S	66.3	Low	69.6	Low	46 Å²	46	76.5 Å²	76.5	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-65.3	-38	-175.5	60.6	0	0	0	0	113.5	S562 Q567 L568	S562-S564 VanDerWaalsContact C-N 3.33Å; S564-Q567 PolarHBondContact O-N 2.9Å; S564-L568 WeakPolarHBondContact O-CB 3.49Å; S564-L568 PolarHBondContact O-N 3.41Å
565	E	72.2	Confident	70.9	Confident	137 Å²	137	70.7 Å²	70.7	64%	0.64	40%	0.397	S	S	*	.	H	α-helix	trans	-69.7	-41.3	179.5	-171.5	172.1	-172.2	0	0	111.7	S563 L568 Q569	S563-E565 PolarHBondContact O-N 2.88Å; E565-L568 PolarHBondContact O-N 3.11Å; E565-Q569 WeakPolarHBondContact O-CB 3.32Å; E565-Q569 PolarHBondContact O-N 2.73Å
566	N	77.2	Confident	72.3	Confident	114 Å²	114	69.4 Å²	69.4	61%	0.61	39%	0.391	S	S	*	.	H	α-helix	trans	-64.8	-38.9	175.2	-80	-30.1	0	0	0	112	S563 K570	S563-N566 PolarHBondContact O-N 3.32Å; N566-K570 WeakPolarHBondContact O-CG 3.46Å; N566-K570 PolarHBondContact O-N 3.33Å; N566-K570 VanDerWaalsContact O-N 3.14Å
567	Q	80.3	Confident	73.9	Confident	55 Å²	55	73.5 Å²	73.5	26%	0.257	40%	0.403	S	S	.	.	H	α-helix	trans	-65.3	-46.3	173.4	-74.1	175.3	-12.9	0	0	111.4	S563 S564 Q569 K570 S571	S563-Q567 WeakPolarHBondContact O-CG 3.24Å; S563-Q567 PolarHBondContact O-N 3.41Å; S564-Q567 PolarHBondContact O-N 2.9Å; Q567-Q569 VanDerWaalsContact C-N 3.29Å; Q567-Q569 PolarHBondContact O-N 2.74Å; Q567-K570 WeakPolarHBondContact O-CB 3.2Å; Q567-K570 PolarHBondContact O-N 3.29Å; Q567-K570 VanDerWaalsContact O-N 3.1Å; Q567-S571 PolarHBondContact O-N 2.87Å; Q567-S571 PolarHBondContact O-OG 3.15Å
568	L	83.7	Confident	75.6	Confident	19 Å²	19	74.7 Å²	74.7	10%	0.099	40%	0.402	C	S	.	.	H	α-helix	trans	-60.3	-39.1	178	-166.9	78	0	0	0	111.9	S564 E565 S571 S572 K606 L609 Q610	S564-L568 WeakPolarHBondContact O-CB 3.49Å; S564-L568 PolarHBondContact O-N 3.41Å; E565-L568 PolarHBondContact O-N 3.11Å; L568-S571 PolarHBondContact O-N 3.32Å; L568-S572 VanDerWaalsContact O-CB 3.3Å; L568-S572 WeakPolarHBondContact O-CB 3.43Å; L568-S572 PolarHBondContact O-N 3.05Å; L568-S572 PolarHBondContact O-OG 3.36Å; L568-K606 HydrophobicContact CD2-CB 3.8Å; L568-K606 HydrophobicContact CD2-CG 4.33Å; L568-K606 HydrophobicContact CG-CB 4.21Å; L568-K606 HydrophobicContact CG-CG 4.45Å; L568-L609 HydrophobicContact CD1-CB 3.94Å; L568-Q610 HydrophobicContact CD1-CB 4.02Å; L568-Q610 HydrophobicContact CD2-CB 4.04Å
569	Q	85.6	Confident	77.5	Confident	55 Å²	55	68.3 Å²	68.3	26%	0.257	37%	0.368	S	S	.	.	H	α-helix	trans	-57.5	-53.7	172	-178.1	68.2	25.1	0	0	110.6	E565 Q567 S571 S572 E573	E565-Q569 WeakPolarHBondContact O-CB 3.32Å; E565-Q569 PolarHBondContact O-N 2.73Å; Q567-Q569 VanDerWaalsContact C-N 3.29Å; Q567-Q569 PolarHBondContact O-N 2.74Å; Q569-S571 VanDerWaalsContact C-N 3.35Å; Q569-S571 PolarHBondContact O-N 3.12Å; Q569-S572 PolarHBondContact O-N 3.23Å; Q569-S572 PolarHBondContact O-OG 2.95Å; Q569-E573 PolarHBondContact NE2-OE1 2.79Å; Q569-E573 WeakPolarHBondContact O-CG 3.4Å; Q569-E573 PolarHBondContact O-N 3.01Å
570	K	86.3	Confident	79.6	Confident	142 Å²	142	68.3 Å²	68.3	62%	0.617	35%	0.351	S	S	*	.	H	α-helix	trans	-58.9	-43.3	179.2	-71.5	176.1	-178.9	-178.6	0	112.2	N566 Q567 E573 Y574	N566-K570 WeakPolarHBondContact O-CG 3.46Å; N566-K570 PolarHBondContact O-N 3.33Å; N566-K570 VanDerWaalsContact O-N 3.14Å; Q567-K570 WeakPolarHBondContact O-CB 3.2Å; Q567-K570 PolarHBondContact O-N 3.29Å; Q567-K570 VanDerWaalsContact O-N 3.1Å; K570-E573 PolarHBondContact O-N 2.9Å; K570-Y574 WeakPolarHBondContact O-CB 3.44Å; K570-Y574 PolarHBondContact O-N 3.38Å
571	S	88	Confident	81.4	Confident	5 Å²	5	65.3 Å²	65.3	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-47.8	176.7	-55.8	0	0	0	0	111.8	F555 Q567 L568 Q569 E573 Y574 V575	F555-S571 WeakPolarHBondContact CB-OG 3.42Å; F555-S571 WeakPolarHBondContact CD1-OG 3.43Å; F555-S571 WeakPolarHBondContact CG-OG 3.39Å; Q567-S571 PolarHBondContact O-N 2.87Å; Q567-S571 PolarHBondContact O-OG 3.15Å; L568-S571 PolarHBondContact O-N 3.32Å; Q569-S571 VanDerWaalsContact C-N 3.35Å; Q569-S571 PolarHBondContact O-N 3.12Å; S571-E573 VanDerWaalsContact C-N 3.33Å; S571-E573 PolarHBondContact O-N 2.97Å; S571-Y574 PolarHBondContact O-N 3.01Å; S571-V575 WeakPolarHBondContact O-CG2 3.48Å; S571-V575 PolarHBondContact O-N 3.42Å
572	S	90.2	Very high	83.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-36.9	180	73	0	0	0	0	112.3	L568 Q569 F576	L568-S572 VanDerWaalsContact O-CB 3.3Å; L568-S572 WeakPolarHBondContact O-CB 3.43Å; L568-S572 PolarHBondContact O-N 3.05Å; L568-S572 PolarHBondContact O-OG 3.36Å; Q569-S572 PolarHBondContact O-N 3.23Å; Q569-S572 PolarHBondContact O-OG 2.95Å; S572-F576 VanDerWaalsContact O-CB 3.25Å; S572-F576 WeakPolarHBondContact O-CB 3.36Å; S572-F576 PolarHBondContact O-N 3.42Å
573	E	91.1	Very high	85.3	Confident	77 Å²	77	56.2 Å²	56.2	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-67.8	-43.9	174.6	-75.6	-176.5	-177.7	0	0	111.8	Q569 K570 S571 V575 F576 Q577 L602	Q569-E573 PolarHBondContact NE2-OE1 2.79Å; Q569-E573 WeakPolarHBondContact O-CG 3.4Å; Q569-E573 PolarHBondContact O-N 3.01Å; K570-E573 PolarHBondContact O-N 2.9Å; S571-E573 VanDerWaalsContact C-N 3.33Å; S571-E573 PolarHBondContact O-N 2.97Å; E573-V575 VanDerWaalsContact C-N 3.33Å; E573-V575 PolarHBondContact O-N 2.96Å; E573-F576 PolarHBondContact O-N 3.09Å; E573-Q577 VanDerWaalsContact O-CG 3.24Å; E573-Q577 WeakPolarHBondContact O-CG 3.49Å; E573-Q577 PolarHBondContact O-N 3.43Å; E573-L602 HydrophobicContact CG-CD2 4.27Å
574	Y	91.2	Very high	86.7	Confident	52 Å²	52	55 Å²	55	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-56.3	-47	175.1	171.2	-100	0	0	0	111.9	T548 V549 F555 K570 S571 K578	T548-Y574 HydrophobicContact CG2-CE1 4.12Å; V549-Y574 HydrophobicContact CG2-CD1 4.01Å; V549-Y574 HydrophobicContact CG2-CE1 4.35Å; F555-Y574 HydrophobicContact CE2-CD1 4.15Å; F555-Y574 HydrophobicContact CE2-CE1 4.44Å; F555-Y574 HydrophobicContact CE2-CG 4.41Å; F555-Y574 HydrophobicContact CZ-CD1 4.13Å; F555-Y574 HydrophobicContact CZ-CD2 4.46Å; F555-Y574 AromaticContact CZ-CG 3.96Å; F555-Y574 HydrophobicContact CZ-CG 3.96Å; K570-Y574 WeakPolarHBondContact O-CB 3.44Å; K570-Y574 PolarHBondContact O-N 3.38Å; S571-Y574 PolarHBondContact O-N 3.01Å; Y574-K578 HydrophobicContact CE2-CD 4.35Å; Y574-K578 PolarHBondContact OH-NZ 3.04Å
575	V	91.9	Very high	87.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-46.6	175.8	176.5	0	0	0	0	110.6	L545 F546 V549 S571 E573 Q577 K578 L579 L605 L609	L545-V575 HydrophobicContact CB-CG1 4.27Å; L545-V575 HydrophobicContact CB-CG2 4.45Å; L545-V575 HydrophobicContact CD1-CG1 4.15Å; F546-V575 HydrophobicContact CD1-CG1 4.48Å; F546-V575 HydrophobicContact CE1-CG1 4.16Å; V549-V575 HydrophobicContact CG2-CG2 3.53Å; S571-V575 WeakPolarHBondContact O-CG2 3.48Å; S571-V575 PolarHBondContact O-N 3.42Å; E573-V575 VanDerWaalsContact C-N 3.33Å; E573-V575 PolarHBondContact O-N 2.96Å; V575-Q577 PolarHBondContact O-N 2.93Å; V575-K578 PolarHBondContact O-N 3.42Å; V575-L579 HydrophobicContact CG1-CB 4.5Å; V575-L579 HydrophobicContact CG1-CD2 4.32Å; V575-L579 WeakPolarHBondContact O-CB 3.32Å; V575-L579 PolarHBondContact O-N 3.13Å; V575-L605 HydrophobicContact CB-CD1 4.4Å; V575-L605 HydrophobicContact CG1-CD1 4.12Å; V575-L605 HydrophobicContact CG1-CD2 3.79Å; V575-L609 HydrophobicContact CG2-CD1 4.42Å
576	F	93	Very high	88.6	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-42.6	-178.6	-178.9	-94.7	0	0	0	112.8	S572 E573 K578 L579 F580 R598 I601 L602 L605	S572-F576 VanDerWaalsContact O-CB 3.25Å; S572-F576 WeakPolarHBondContact O-CB 3.36Å; S572-F576 PolarHBondContact O-N 3.42Å; E573-F576 PolarHBondContact O-N 3.09Å; F576-K578 VanDerWaalsContact C-N 3.27Å; F576-K578 PolarHBondContact O-N 3Å; F576-L579 PolarHBondContact O-N 2.95Å; F576-F580 HydrophobicContact CD1-CB 4.44Å; F576-F580 HydrophobicContact CE1-CB 4.09Å; F576-F580 AromaticContact CE1-CD2 3.84Å; F576-F580 HydrophobicContact CE1-CD2 3.84Å; F576-F580 HydrophobicContact CE1-CE2 4.48Å; F576-F580 HydrophobicContact CE1-CG 4.07Å; F576-F580 HydrophobicContact CE2-CB 4.45Å; F576-F580 AromaticContact CE2-CD2 3.73Å; F576-F580 HydrophobicContact CE2-CD2 3.73Å; F576-F580 HydrophobicContact CE2-CE2 4.47Å; F576-F580 HydrophobicContact CZ-CB 4.1Å; F576-F580 AromaticContact CZ-CD2 3.17Å; F576-F580 HydrophobicContact CZ-CD2 3.17Å; F576-F580 AromaticContact CZ-CE2 3.73Å; F576-F580 HydrophobicContact CZ-CE2 3.73Å; F576-F580 AromaticContact CZ-CG 3.86Å; F576-F580 HydrophobicContact CZ-CG 3.86Å; F576-F580 VanDerWaalsContact O-CB 3.22Å; F576-F580 WeakPolarHBondContact O-CB 3.47Å; F576-F580 PolarHBondContact O-N 3.17Å; F576-R598 HydrophobicContact CE1-CG 3.9Å; F576-R598 HydrophobicContact CE2-CG 4.19Å; F576-R598 HydrophobicContact CZ-CB 4.04Å; F576-R598 HydrophobicContact CZ-CG 3.49Å; F576-R598 VanDerWaalsContact CZ-CG 3.49Å; F576-I601 HydrophobicContact CD2-CB 4.28Å; F576-I601 HydrophobicContact CD2-CG2 3.79Å; F576-I601 HydrophobicContact CE2-CB 3.97Å; F576-I601 HydrophobicContact CE2-CD1 4.39Å; F576-I601 HydrophobicContact CE2-CG2 3.85Å; F576-L602 HydrophobicContact CB-CD2 3.43Å; F576-L602 VanDerWaalsContact CB-CD2 3.43Å; F576-L602 HydrophobicContact CB-CG 4.31Å; F576-L602 HydrophobicContact CD1-CD2 4.17Å; F576-L602 HydrophobicContact CD1-CG 4.41Å; F576-L602 HydrophobicContact CD2-CD2 3.98Å; F576-L602 HydrophobicContact CD2-CG 3.92Å; F576-L602 HydrophobicContact CE2-CG 4.36Å; F576-L602 HydrophobicContact CG-CD2 3.59Å; F576-L602 HydrophobicContact CG-CG 3.95Å; F576-L605 HydrophobicContact CB-CD1 3.89Å; F576-L605 HydrophobicContact CD2-CD1 4.3Å
577	Q	92.3	Very high	89.2	Confident	126 Å²	126	46.9 Å²	46.9	59%	0.589	23%	0.23	S	C	*	.	H	α-helix	trans	-59.7	-38.3	-179.8	-69.9	-68.2	1.1	0	0	112.1	E573 V575	E573-Q577 VanDerWaalsContact O-CG 3.24Å; E573-Q577 WeakPolarHBondContact O-CG 3.49Å; E573-Q577 PolarHBondContact O-N 3.43Å; V575-Q577 PolarHBondContact O-N 2.93Å
578	K	90.9	Very high	89.5	Confident	111 Å²	111	52.9 Å²	52.9	48%	0.483	25%	0.25	S	S	.	.	H	α-helix	trans	-80.4	-31.3	176.6	-67.7	-173.6	170.6	-170.3	0	112.9	L545 Y574 V575 F576	L545-K578 HydrophobicContact CD1-CB 3.92Å; L545-K578 HydrophobicContact CD2-CB 3.74Å; L545-K578 HydrophobicContact CD2-CD 3.4Å; L545-K578 HydrophobicContact CD2-CG 4.16Å; L545-K578 HydrophobicContact CG-CB 4.5Å; Y574-K578 HydrophobicContact CE2-CD 4.35Å; Y574-K578 PolarHBondContact OH-NZ 3.04Å; V575-K578 PolarHBondContact O-N 3.42Å; F576-K578 VanDerWaalsContact C-N 3.27Å; F576-K578 PolarHBondContact O-N 3Å
579	L	91.7	Very high	89.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-85.6	-27.3	-174.3	-176.6	65.5	0	0	0	113.8	L538 I542 L545 V575 F576 G581 P582 V583 L605 F618	L538-L579 HydrophobicContact CD1-CD1 3.9Å; I542-L579 HydrophobicContact CB-CD1 4.4Å; I542-L579 HydrophobicContact CD1-CD1 4.5Å; I542-L579 HydrophobicContact CD1-CD2 4.02Å; L545-L579 HydrophobicContact CD1-CB 4.18Å; V575-L579 HydrophobicContact CG1-CB 4.5Å; V575-L579 HydrophobicContact CG1-CD2 4.32Å; V575-L579 WeakPolarHBondContact O-CB 3.32Å; V575-L579 PolarHBondContact O-N 3.13Å; F576-L579 PolarHBondContact O-N 2.95Å; L579-G581 PolarHBondContact O-N 3.45Å; L579-P582 WeakPolarHBondContact O-CD 3.41Å; L579-V583 HydrophobicContact CD1-CG2 3.55Å; L579-V583 HydrophobicContact CD2-CG2 4.06Å; L579-V583 HydrophobicContact CG-CG2 3.46Å; L579-V583 VanDerWaalsContact CG-CG2 3.46Å; L579-V583 WeakPolarHBondContact O-CB 3.39Å; L579-V583 WeakPolarHBondContact O-CG2 3.48Å; L579-V583 PolarHBondContact O-N 2.85Å; L579-L605 HydrophobicContact CD2-CD1 4.38Å; L579-L605 HydrophobicContact CD2-CD2 4.22Å; L579-F618 HydrophobicContact CD2-CE1 3.82Å; L579-F618 HydrophobicContact CD2-CZ 4.11Å
580	F	89.2	Confident	89.8	Confident	91 Å²	91	52.4 Å²	52.4	40%	0.399	25%	0.25	S	S	.	.	H	α-helix	trans	-59.1	-50.4	-168.4	179.6	-109.8	0	0	0	113.6	F576 V583 C584	F576-F580 HydrophobicContact CD1-CB 4.44Å; F576-F580 HydrophobicContact CE1-CB 4.09Å; F576-F580 AromaticContact CE1-CD2 3.84Å; F576-F580 HydrophobicContact CE1-CD2 3.84Å; F576-F580 HydrophobicContact CE1-CE2 4.48Å; F576-F580 HydrophobicContact CE1-CG 4.07Å; F576-F580 HydrophobicContact CE2-CB 4.45Å; F576-F580 AromaticContact CE2-CD2 3.73Å; F576-F580 HydrophobicContact CE2-CD2 3.73Å; F576-F580 HydrophobicContact CE2-CE2 4.47Å; F576-F580 HydrophobicContact CZ-CB 4.1Å; F576-F580 AromaticContact CZ-CD2 3.17Å; F576-F580 HydrophobicContact CZ-CD2 3.17Å; F576-F580 AromaticContact CZ-CE2 3.73Å; F576-F580 HydrophobicContact CZ-CE2 3.73Å; F576-F580 AromaticContact CZ-CG 3.86Å; F576-F580 HydrophobicContact CZ-CG 3.86Å; F576-F580 VanDerWaalsContact O-CB 3.22Å; F576-F580 WeakPolarHBondContact O-CB 3.47Å; F576-F580 PolarHBondContact O-N 3.17Å; F580-V583 PolarHBondContact O-N 3.01Å; F580-C584 VanDerWaalsContact CD2-SG 3.56Å; F580-C584 WeakPolarHBondContact CE2-SG 3.48Å; F580-C584 WeakPolarHBondContact CZ-SG 3.31Å; F580-C584 VanDerWaalsContact O-CB 3.26Å; F580-C584 WeakPolarHBondContact O-CB 3.37Å; F580-C584 PolarHBondContact O-N 2.95Å; F580-C584 PolarHBondContact O-SG 2.89Å; F580-C584 VanDerWaalsContact O-SG 3.4Å
581	G	89.7	Confident	89.6	Confident	44 Å²	44	53.5 Å²	53.5	45%	0.454	26%	0.255	S	S	.	.	H	α-helix	trans	-56.6	-54.9	179.8	0	0	0	0	0	112.9	L579 C584 K585	L579-G581 PolarHBondContact O-N 3.45Å; G581-C584 PolarHBondContact O-N 2.94Å; G581-K585 PolarHBondContact O-N 2.75Å
582	P	91.4	Very high	89.2	Confident	49 Å²	49	54 Å²	54	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-58	-46.3	175.5	-27.9	35.3	0	0	0	114.5	L538 L541 L579 K585 Y586	L538-P582 HydrophobicContact CD1-CB 3.75Å; L541-P582 HydrophobicContact CD1-CB 4.06Å; L541-P582 HydrophobicContact CD1-CG 3.75Å; L579-P582 WeakPolarHBondContact O-CD 3.41Å; P582-K585 PolarHBondContact O-N 3.31Å; P582-Y586 PolarHBondContact O-N 3.4Å; P582-Y586 VanDerWaalsContact O-N 3.13Å
583	V	89.9	Confident	88.6	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-49.1	178	170.2	0	0	0	0	110.5	L538 L579 F580 K585 Y586 L587 I601	L538-V583 HydrophobicContact CD1-CG2 3.67Å; L538-V583 HydrophobicContact CD2-CG2 4.17Å; L538-V583 HydrophobicContact CG-CG2 4.39Å; L579-V583 HydrophobicContact CD1-CG2 3.55Å; L579-V583 HydrophobicContact CD2-CG2 4.06Å; L579-V583 HydrophobicContact CG-CG2 3.46Å; L579-V583 VanDerWaalsContact CG-CG2 3.46Å; L579-V583 WeakPolarHBondContact O-CB 3.39Å; L579-V583 WeakPolarHBondContact O-CG2 3.48Å; L579-V583 PolarHBondContact O-N 2.85Å; F580-V583 PolarHBondContact O-N 3.01Å; V583-K585 VanDerWaalsContact C-N 3.27Å; V583-K585 PolarHBondContact O-N 3.31Å; V583-Y586 CarbonylContact O-C 3.48Å; V583-Y586 WeakPolarHBondContact O-CA 3.46Å; V583-Y586 WeakPolarHBondContact O-CB 3.47Å; V583-Y586 PolarHBondContact O-N 3.23Å; V583-L587 HydrophobicContact CG1-CD1 3.63Å; V583-L587 HydrophobicContact CG1-CG 3.87Å; V583-L587 VanDerWaalsContact O-CG 3.32Å; V583-L587 WeakPolarHBondContact O-CG 3.31Å; V583-L587 PolarHBondContact O-N 3.4Å; V583-I601 HydrophobicContact CG1-CD1 4.4Å
584	C	88.6	Confident	87.9	Confident	27 Å²	27	59.2 Å²	59.2	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-37.5	179.5	-77.6	0	0	0	0	112.5	F580 G581 Y586 L587 R588	F580-C584 VanDerWaalsContact CD2-SG 3.56Å; F580-C584 WeakPolarHBondContact CE2-SG 3.48Å; F580-C584 WeakPolarHBondContact CZ-SG 3.31Å; F580-C584 VanDerWaalsContact O-CB 3.26Å; F580-C584 WeakPolarHBondContact O-CB 3.37Å; F580-C584 PolarHBondContact O-N 2.95Å; F580-C584 PolarHBondContact O-SG 2.89Å; F580-C584 VanDerWaalsContact O-SG 3.4Å; G581-C584 PolarHBondContact O-N 2.94Å; C584-Y586 VanDerWaalsContact C-N 3.33Å; C584-Y586 PolarHBondContact O-N 3.43Å; C584-L587 PolarHBondContact O-N 2.84Å; C584-R588 WeakPolarHBondContact O-CB 3.42Å; C584-R588 WeakPolarHBondContact O-CG 3.46Å; C584-R588 PolarHBondContact O-N 3.41Å
585	K	87.9	Confident	87.1	Confident	121 Å²	121	60.6 Å²	60.6	53%	0.526	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-42.7	174.4	-161.8	-178.1	-158.9	-168.4	0	111.5	Y530 G581 P582 V583 L589	Y530-K585 WeakPolarHBondContact OH-CE 3.43Å; Y530-K585 PolarHBondContact OH-NZ 2.82Å; Y530-K585 VanDerWaalsContact OH-NZ 3.08Å; G581-K585 PolarHBondContact O-N 2.75Å; P582-K585 PolarHBondContact O-N 3.31Å; V583-K585 VanDerWaalsContact C-N 3.27Å; V583-K585 PolarHBondContact O-N 3.31Å; K585-L589 PolarHBondContact O-N 3.43Å; K585-L589 VanDerWaalsContact O-N 3.13Å
586	Y	91.5	Very high	86.5	Confident	3 Å²	3	61.5 Å²	61.5	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-46.2	175.4	-177.7	-98.9	0	0	0	112	K531 C534 Q535 P582 V583 C584 R588 L589 T590 F623	K531-Y586 WeakPolarHBondContact CE-OH 3.47Å; K531-Y586 HydrophobicContact CG-CE2 4Å; C534-Y586 HydrophobicContact CB-CD2 3.85Å; Q535-Y586 HydrophobicContact CG-CD2 4.38Å; Q535-Y586 HydrophobicContact CG-CE2 3.49Å; Q535-Y586 VanDerWaalsContact CG-CE2 3.49Å; Q535-Y586 PolarHBondContact NE2-OH 3.17Å; P582-Y586 PolarHBondContact O-N 3.4Å; P582-Y586 VanDerWaalsContact O-N 3.13Å; V583-Y586 CarbonylContact O-C 3.48Å; V583-Y586 WeakPolarHBondContact O-CA 3.46Å; V583-Y586 WeakPolarHBondContact O-CB 3.47Å; V583-Y586 PolarHBondContact O-N 3.23Å; C584-Y586 VanDerWaalsContact C-N 3.33Å; C584-Y586 PolarHBondContact O-N 3.43Å; Y586-R588 VanDerWaalsContact C-N 3.29Å; Y586-R588 PolarHBondContact O-N 2.9Å; Y586-L589 WeakPolarHBondContact O-CA 3.49Å; Y586-L589 VanDerWaalsContact O-CB 3.3Å; Y586-L589 WeakPolarHBondContact O-CB 3.22Å; Y586-L589 PolarHBondContact O-N 3.4Å; Y586-T590 HydrophobicContact CD1-CG2 4.29Å; Y586-T590 HydrophobicContact CE1-CG2 3.75Å; Y586-T590 HydrophobicContact CE2-CG2 4.06Å; Y586-T590 PolarHBondContact O-N 3.29Å; Y586-T590 PolarHBondContact O-OG1 3.04Å; Y586-T590 VanDerWaalsContact O-OG1 3.12Å; Y586-F623 HydrophobicContact CD1-CE1 4.47Å; Y586-F623 AromaticContact CE1-CD1 3.72Å; Y586-F623 HydrophobicContact CE1-CD1 3.72Å; Y586-F623 HydrophobicContact CE1-CE1 4.01Å; Y586-F623 HydrophobicContact CE2-CD1 4.38Å; Y586-F623 HydrophobicContact CE2-CE1 4.29Å; Y586-F623 AromaticContact CZ-CD1 3.59Å; Y586-F623 AromaticContact CZ-CE1 3.89Å; Y586-F623 WeakPolarHBondContact OH-CD1 3.39Å
587	L	88.2	Confident	86	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-31.1	179.4	-65.9	-178.1	0	0	0	112.9	V583 C584 T590 K591 Q592 H593 H596 Y622	V583-L587 HydrophobicContact CG1-CD1 3.63Å; V583-L587 HydrophobicContact CG1-CG 3.87Å; V583-L587 VanDerWaalsContact O-CG 3.32Å; V583-L587 WeakPolarHBondContact O-CG 3.31Å; V583-L587 PolarHBondContact O-N 3.4Å; C584-L587 PolarHBondContact O-N 2.84Å; L587-T590 WeakPolarHBondContact CA-OG1 3.19Å; L587-T590 PolarHBondContact O-OG1 3.47Å; L587-K591 CarbonylContact O-C 3.59Å; L587-K591 WeakPolarHBondContact O-CA 3.22Å; L587-K591 PolarHBondContact O-N 3.39Å; L587-Q592 HydrophobicContact CB-CB 4.5Å; L587-Q592 HydrophobicContact CD2-CB 3.82Å; L587-Q592 PolarHBondContact O-N 3.04Å; L587-H593 HydrophobicContact CB-CB 4.07Å; L587-H593 PolarHBondContact O-N 2.87Å; L587-H593 VanDerWaalsContact O-N 3.11Å; L587-H596 HydrophobicContact CD1-CB 3.87Å; L587-Y622 HydrophobicContact CD2-CD1 3.82Å; L587-Y622 HydrophobicContact CD2-CG 4.4Å
588	R	87.3	Confident	85.8	Confident	181 Å²	181	65.6 Å²	65.6	68%	0.683	32%	0.316	S	S	*	.	H	α-helix	trans	-70.2	-41.9	170.7	-74.7	179	-178.5	177.8	1.8	111.3	C584 Y586 T590 K591 H593	C584-R588 WeakPolarHBondContact O-CB 3.42Å; C584-R588 WeakPolarHBondContact O-CG 3.46Å; C584-R588 PolarHBondContact O-N 3.41Å; Y586-R588 VanDerWaalsContact C-N 3.29Å; Y586-R588 PolarHBondContact O-N 2.9Å; R588-T590 VanDerWaalsContact C-N 3.33Å; R588-T590 PolarHBondContact O-N 3.35Å; R588-K591 PolarHBondContact O-N 3.5Å; R588-K591 VanDerWaalsContact O-N 3.14Å; R588-H593 HydrophobicContact CG-CB 4.08Å
589	L	88.1	Confident	85.3	Confident	36 Å²	36	62.6 Å²	62.6	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-43	176.7	-176.5	71.5	0	0	0	111.8	Y527 Y530 K531 K585 Y586 K591	Y527-L589 HydrophobicContact CD2-CD1 3.8Å; Y527-L589 HydrophobicContact CD2-CG 4.43Å; Y527-L589 HydrophobicContact CE2-CD1 3.49Å; Y527-L589 VanDerWaalsContact CE2-CD1 3.49Å; Y527-L589 HydrophobicContact CE2-CD2 4.46Å; Y527-L589 HydrophobicContact CE2-CG 3.73Å; Y527-L589 PolarHBondContact OH-O 2.81Å; Y530-L589 HydrophobicContact CD1-CD1 3.69Å; Y530-L589 HydrophobicContact CD1-CD2 3.56Å; Y530-L589 HydrophobicContact CD1-CG 4.26Å; Y530-L589 HydrophobicContact CE1-CD1 3.85Å; Y530-L589 HydrophobicContact CE1-CD2 3.81Å; Y530-L589 HydrophobicContact CE1-CG 4.37Å; K531-L589 HydrophobicContact CB-CD2 3.92Å; K531-L589 HydrophobicContact CG-CD2 4.3Å; K585-L589 PolarHBondContact O-N 3.43Å; K585-L589 VanDerWaalsContact O-N 3.13Å; Y586-L589 WeakPolarHBondContact O-CA 3.49Å; Y586-L589 VanDerWaalsContact O-CB 3.3Å; Y586-L589 WeakPolarHBondContact O-CB 3.22Å; Y586-L589 PolarHBondContact O-N 3.4Å; L589-K591 VanDerWaalsContact C-N 3.32Å
590	T	86.5	Confident	84.9	Confident	27 Å²	27	66 Å²	66	17%	0.166	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-0.2	178.2	57.6	0	0	0	0	113.9	Y586 L587 R588 Q592	Y586-T590 HydrophobicContact CD1-CG2 4.29Å; Y586-T590 HydrophobicContact CE1-CG2 3.75Å; Y586-T590 HydrophobicContact CE2-CG2 4.06Å; Y586-T590 PolarHBondContact O-N 3.29Å; Y586-T590 PolarHBondContact O-OG1 3.04Å; Y586-T590 VanDerWaalsContact O-OG1 3.12Å; L587-T590 WeakPolarHBondContact CA-OG1 3.19Å; L587-T590 PolarHBondContact O-OG1 3.47Å; R588-T590 VanDerWaalsContact C-N 3.33Å; R588-T590 PolarHBondContact O-N 3.35Å; T590-Q592 PolarHBondContact O-N 3.14Å; T590-Q592 VanDerWaalsContact OG1-CD 3.28Å; T590-Q592 WeakPolarHBondContact OG1-CG 3.26Å; T590-Q592 PolarHBondContact OG1-OE1 3.44Å
591	K	82.1	Confident	84.8	Confident	166 Å²	166	62 Å²	62	72%	0.722	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	30.9	-174.8	-54	-179	179.2	-178.5	0	113.9	L587 R588 L589	L587-K591 CarbonylContact O-C 3.59Å; L587-K591 WeakPolarHBondContact O-CA 3.22Å; L587-K591 PolarHBondContact O-N 3.39Å; R588-K591 PolarHBondContact O-N 3.5Å; R588-K591 VanDerWaalsContact O-N 3.14Å; L589-K591 VanDerWaalsContact C-N 3.32Å
592	Q	79.9	Confident	84.8	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.07	30%	0.299	C	S	.	.			trans	-98.8	-3.8	177.6	-69.4	169	-34.2	0	0	114.2	L587 T590 T594 Y595 Y622 P625	L587-Q592 HydrophobicContact CB-CB 4.5Å; L587-Q592 HydrophobicContact CD2-CB 3.82Å; L587-Q592 PolarHBondContact O-N 3.04Å; T590-Q592 PolarHBondContact O-N 3.14Å; T590-Q592 VanDerWaalsContact OG1-CD 3.28Å; T590-Q592 WeakPolarHBondContact OG1-CG 3.26Å; T590-Q592 PolarHBondContact OG1-OE1 3.44Å; Q592-T594 PolarHBondContact O-N 3.13Å; Q592-T594 VanDerWaalsContact O-N 3.13Å; Q592-Y595 HydrophobicContact CB-CD2 4.4Å; Q592-Y595 PolarHBondContact O-N 3.13Å; Q592-Y622 PolarHBondContact NE2-O 3.07Å; Q592-Y622 PolarHBondContact OE1-O 3.43Å; Q592-P625 VanDerWaalsContact NE2-CG 3.29Å
593	H	78.3	Confident	84.4	Confident	99 Å²	99	62.9 Å²	62.9	46%	0.458	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.2	-173.9	69.5	-76.9	0	0	0	114.8	L587 R588 Y595	L587-H593 HydrophobicContact CB-CB 4.07Å; L587-H593 PolarHBondContact O-N 2.87Å; L587-H593 VanDerWaalsContact O-N 3.11Å; R588-H593 HydrophobicContact CG-CB 4.08Å; H593-Y595 PolarHBondContact O-N 3Å
594	T	76	Confident	84.3	Confident	88 Å²	88	65.1 Å²	65.1	54%	0.54	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-19	178.2	48.8	0	0	0	0	113.2	Q592	Q592-T594 PolarHBondContact O-N 3.13Å; Q592-T594 VanDerWaalsContact O-N 3.13Å
595	Y	75.3	Confident	84.3	Confident	80 Å²	80	63.8 Å²	63.8	31%	0.314	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-9.1	-169.3	-47.1	-67.3	0	0	0	114.9	Q592 H593 F630	Q592-Y595 HydrophobicContact CB-CD2 4.4Å; Q592-Y595 PolarHBondContact O-N 3.13Å; H593-Y595 PolarHBondContact O-N 3Å; Y595-F630 VanDerWaalsContact CB-CD1 3.41Å; Y595-F630 HydrophobicContact CD1-CB 4.05Å; Y595-F630 AromaticContact CD1-CD1 3.03Å; Y595-F630 HydrophobicContact CD1-CD1 3.03Å; Y595-F630 AromaticContact CD1-CE1 3.67Å; Y595-F630 HydrophobicContact CD1-CE1 3.67Å; Y595-F630 AromaticContact CD1-CG 3.59Å; Y595-F630 HydrophobicContact CD1-CG 3.59Å; Y595-F630 HydrophobicContact CD2-CB 4.5Å; Y595-F630 AromaticContact CD2-CD1 3.36Å; Y595-F630 HydrophobicContact CD2-CD1 3.36Å; Y595-F630 AromaticContact CD2-CD2 3.62Å; Y595-F630 HydrophobicContact CD2-CD2 3.62Å; Y595-F630 AromaticContact CD2-CE1 3.41Å; Y595-F630 HydrophobicContact CD2-CE1 3.41Å; Y595-F630 VanDerWaalsContact CD2-CE1 3.41Å; Y595-F630 AromaticContact CD2-CE2 3.58Å; Y595-F630 HydrophobicContact CD2-CE2 3.58Å; Y595-F630 AromaticContact CD2-CG 3.52Å; Y595-F630 HydrophobicContact CD2-CG 3.52Å; Y595-F630 AromaticContact CD2-CZ 3.48Å; Y595-F630 HydrophobicContact CD2-CZ 3.48Å; Y595-F630 VanDerWaalsContact CD2-CZ 3.48Å; Y595-F630 HydrophobicContact CE1-CB 3.46Å; Y595-F630 VanDerWaalsContact CE1-CB 3.46Å; Y595-F630 AromaticContact CE1-CD1 3.43Å; Y595-F630 HydrophobicContact CE1-CD1 3.43Å; Y595-F630 VanDerWaalsContact CE1-CD1 3.43Å; Y595-F630 HydrophobicContact CE1-CD2 4.37Å; Y595-F630 HydrophobicContact CE1-CE1 4.39Å; Y595-F630 AromaticContact CE1-CG 3.46Å; Y595-F630 HydrophobicContact CE1-CG 3.46Å; Y595-F630 VanDerWaalsContact CE1-CG 3.46Å; Y595-F630 HydrophobicContact CE2-CB 4.01Å; Y595-F630 AromaticContact CE2-CD1 3.76Å; Y595-F630 HydrophobicContact CE2-CD1 3.76Å; Y595-F630 AromaticContact CE2-CD2 3.47Å; Y595-F630 HydrophobicContact CE2-CD2 3.47Å; Y595-F630 VanDerWaalsContact CE2-CD2 3.47Å; Y595-F630 HydrophobicContact CE2-CE1 4.21Å; Y595-F630 AromaticContact CE2-CE2 3.87Å; Y595-F630 HydrophobicContact CE2-CE2 3.87Å; Y595-F630 AromaticContact CE2-CG 3.41Å; Y595-F630 HydrophobicContact CE2-CG 3.41Å; Y595-F630 VanDerWaalsContact CE2-CG 3.41Å; Y595-F630 HydrophobicContact CE2-CZ 4.22Å; Y595-F630 AromaticContact CG-CD1 2.97Å; Y595-F630 HydrophobicContact CG-CD1 2.97Å; Y595-F630 HydrophobicContact CG-CD2 4.16Å; Y595-F630 AromaticContact CG-CE1 3.09Å; Y595-F630 HydrophobicContact CG-CE1 3.09Å; Y595-F630 HydrophobicContact CG-CE2 4.17Å; Y595-F630 AromaticContact CG-CG 3.61Å; Y595-F630 HydrophobicContact CG-CG 3.61Å; Y595-F630 AromaticContact CG-CZ 3.68Å; Y595-F630 HydrophobicContact CG-CZ 3.68Å; Y595-F630 VanDerWaalsContact CZ-CB 3.43Å; Y595-F630 AromaticContact CZ-CD1 3.77Å; Y595-F630 AromaticContact CZ-CD2 3.86Å; Y595-F630 AromaticContact CZ-CG 3.35Å
596	H	78.9	Confident	84.1	Confident	20 Å²	20	60.3 Å²	60.3	9%	0.093	29%	0.292	C	S	.	.			trans	-117.9	91.2	177.5	-60.1	-61.5	0	0	0	108.1	L587 I601 Y622	L587-H596 HydrophobicContact CD1-CB 3.87Å; H596-I601 HydrophobicContact CB-CD1 4.2Å; H596-I601 HydrophobicContact CB-CG1 4.22Å; H596-Y622 HydrophobicContact CB-CE1 4.37Å; H596-Y622 AromaticContact CD2-CD1 3.81Å; H596-Y622 AromaticContact CD2-CE1 3.84Å; H596-Y622 AromaticContact CE1-CD1 3.97Å; H596-Y622 AromaticContact CE1-CE1 3.83Å; H596-Y622 AromaticContact CG-CE1 3.72Å; H596-Y622 AromaticContact ND1-CE1 3.73Å; H596-Y622 AromaticContact NE2-CD1 3.64Å; H596-Y622 AromaticContact NE2-CE1 3.88Å
597	T	83.6	Confident	83.7	Confident	81 Å²	81	63.2 Å²	63.2	50%	0.497	31%	0.307	S	S	.	.			trans	-69.8	157.4	172.7	64.9	0	0	0	0	110	G599 M600 I601	T597-G599 PolarHBondContact O-N 2.93Å; T597-M600 PolarHBondContact O-N 3.44Å; T597-M600 VanDerWaalsContact O-N 3.13Å; T597-M600 WeakPolarHBondContact OG1-CG 3.5Å; T597-I601 PolarHBondContact O-N 3.32Å
598	R	86	Confident	83.6	Confident	134 Å²	134	64.7 Å²	64.7	51%	0.506	31%	0.312	S	S	.	.	H	α-helix	trans	-50.5	-45.1	175.4	168.2	166.6	-176.3	164.2	1.7	112.3	F576 M600 I601 L602	F576-R598 HydrophobicContact CE1-CG 3.9Å; F576-R598 HydrophobicContact CE2-CG 4.19Å; F576-R598 HydrophobicContact CZ-CB 4.04Å; F576-R598 HydrophobicContact CZ-CG 3.49Å; F576-R598 VanDerWaalsContact CZ-CG 3.49Å; R598-M600 PolarHBondContact O-N 3.07Å; R598-I601 PolarHBondContact O-N 3.39Å; R598-L602 HydrophobicContact CG-CD1 3.88Å; R598-L602 PolarHBondContact O-N 2.94Å
599	G	82.1	Confident	83.5	Confident	48 Å²	48	56.7 Å²	56.7	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-40.6	-179.7	0	0	0	0	0	113.1	T597 L602 N603	T597-G599 PolarHBondContact O-N 2.93Å; G599-L602 PolarHBondContact O-N 2.99Å; G599-N603 WeakPolarHBondContact O-CB 3.42Å; G599-N603 PolarHBondContact O-N 3.21Å
600	M	82.9	Confident	83.2	Confident	73 Å²	73	60.4 Å²	60.4	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-40.8	178	-68.6	172.1	73.9	0	0	112.5	T597 R598 R604	T597-M600 PolarHBondContact O-N 3.44Å; T597-M600 VanDerWaalsContact O-N 3.13Å; T597-M600 WeakPolarHBondContact OG1-CG 3.5Å; R598-M600 PolarHBondContact O-N 3.07Å; M600-R604 WeakPolarHBondContact O-CB 3.35Å; M600-R604 PolarHBondContact O-N 3.47Å
601	I	87.4	Confident	82.9	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-46.3	179	-59.4	173.6	0	0	0	109.7	F576 V583 H596 T597 R598 R604 L605 F618	F576-I601 HydrophobicContact CD2-CB 4.28Å; F576-I601 HydrophobicContact CD2-CG2 3.79Å; F576-I601 HydrophobicContact CE2-CB 3.97Å; F576-I601 HydrophobicContact CE2-CD1 4.39Å; F576-I601 HydrophobicContact CE2-CG2 3.85Å; V583-I601 HydrophobicContact CG1-CD1 4.4Å; H596-I601 HydrophobicContact CB-CD1 4.2Å; H596-I601 HydrophobicContact CB-CG1 4.22Å; T597-I601 PolarHBondContact O-N 3.32Å; R598-I601 PolarHBondContact O-N 3.39Å; I601-R604 PolarHBondContact O-N 3.39Å; I601-L605 HydrophobicContact CG2-CD1 4.28Å; I601-L605 WeakPolarHBondContact O-CG 3.45Å; I601-L605 PolarHBondContact O-N 3.26Å; I601-F618 HydrophobicContact CG2-CZ 4.15Å
602	L	88.8	Confident	82.8	Confident	20 Å²	20	63.9 Å²	63.9	11%	0.105	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-49.7	177.1	-80.1	169.1	0	0	0	112.1	E573 F576 R598 G599 R604 L605 K606	E573-L602 HydrophobicContact CG-CD2 4.27Å; F576-L602 HydrophobicContact CB-CD2 3.43Å; F576-L602 VanDerWaalsContact CB-CD2 3.43Å; F576-L602 HydrophobicContact CB-CG 4.31Å; F576-L602 HydrophobicContact CD1-CD2 4.17Å; F576-L602 HydrophobicContact CD1-CG 4.41Å; F576-L602 HydrophobicContact CD2-CD2 3.98Å; F576-L602 HydrophobicContact CD2-CG 3.92Å; F576-L602 HydrophobicContact CE2-CG 4.36Å; F576-L602 HydrophobicContact CG-CD2 3.59Å; F576-L602 HydrophobicContact CG-CG 3.95Å; R598-L602 HydrophobicContact CG-CD1 3.88Å; R598-L602 PolarHBondContact O-N 2.94Å; G599-L602 PolarHBondContact O-N 2.99Å; L602-R604 PolarHBondContact O-N 2.81Å; L602-L605 WeakPolarHBondContact O-CB 3.45Å; L602-L605 PolarHBondContact O-N 3.22Å; L602-L605 VanDerWaalsContact O-N 3.09Å; L602-K606 WeakPolarHBondContact O-CG 3.3Å; L602-K606 PolarHBondContact O-N 3.4Å
603	N	83.9	Confident	82.9	Confident	92 Å²	92	66.1 Å²	66.1	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-39	179.5	-168.2	34.3	0	0	0	111.6	G599 K606 I607	G599-N603 WeakPolarHBondContact O-CB 3.42Å; G599-N603 PolarHBondContact O-N 3.21Å; N603-K606 WeakPolarHBondContact O-CB 3.33Å; N603-K606 PolarHBondContact O-N 3.45Å; N603-I607 WeakPolarHBondContact O-CG1 3.48Å; N603-I607 PolarHBondContact O-N 2.93Å
604	R	86.2	Confident	83.2	Confident	49 Å²	49	64.7 Å²	64.7	19%	0.185	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-44.3	174.7	-170.1	175.8	-67.5	160.7	-1.7	112.1	M600 I601 L602 K606 I607 Y608 F618 I621 Y622	M600-R604 WeakPolarHBondContact O-CB 3.35Å; M600-R604 PolarHBondContact O-N 3.47Å; I601-R604 PolarHBondContact O-N 3.39Å; L602-R604 PolarHBondContact O-N 2.81Å; R604-K606 VanDerWaalsContact C-N 3.27Å; R604-K606 PolarHBondContact O-N 3.46Å; R604-I607 PolarHBondContact O-N 3.17Å; R604-Y608 HydrophobicContact CG-CD2 3.58Å; R604-Y608 HydrophobicContact CG-CE2 3.36Å; R604-Y608 WeakPolarHBondContact O-CD2 3.4Å; R604-Y608 PolarHBondContact O-N 2.96Å; R604-F618 HydrophobicContact CB-CE2 4.08Å; R604-F618 HydrophobicContact CG-CD2 3.84Å; R604-F618 HydrophobicContact CG-CE2 3.8Å; R604-I621 VanDerWaalsContact NH1-CG2 3.26Å; R604-Y622 PolarHBondContact NH1-OH 2.71Å
605	L	89.2	Confident	83.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.9	-42.5	175.9	-75.6	170.9	0	0	0	111.6	F546 V575 F576 L579 I601 L602 I607 Y608 L609 F618	F546-L605 HydrophobicContact CE1-CD2 3.98Å; F546-L605 HydrophobicContact CZ-CD2 4.22Å; V575-L605 HydrophobicContact CB-CD1 4.4Å; V575-L605 HydrophobicContact CG1-CD1 4.12Å; V575-L605 HydrophobicContact CG1-CD2 3.79Å; F576-L605 HydrophobicContact CB-CD1 3.89Å; F576-L605 HydrophobicContact CD2-CD1 4.3Å; L579-L605 HydrophobicContact CD2-CD1 4.38Å; L579-L605 HydrophobicContact CD2-CD2 4.22Å; I601-L605 HydrophobicContact CG2-CD1 4.28Å; I601-L605 WeakPolarHBondContact O-CG 3.45Å; I601-L605 PolarHBondContact O-N 3.26Å; L602-L605 WeakPolarHBondContact O-CB 3.45Å; L602-L605 PolarHBondContact O-N 3.22Å; L602-L605 VanDerWaalsContact O-N 3.09Å; L605-I607 PolarHBondContact O-N 2.96Å; L605-Y608 PolarHBondContact O-N 2.9Å; L605-L609 WeakPolarHBondContact O-CB 3.5Å; L605-L609 VanDerWaalsContact O-CG 3.29Å; L605-L609 WeakPolarHBondContact O-CG 3.48Å; L605-L609 PolarHBondContact O-N 3.48Å; L605-F618 HydrophobicContact CD2-CD2 4.03Å; L605-F618 HydrophobicContact CD2-CE1 4.24Å; L605-F618 HydrophobicContact CD2-CE2 3.51Å; L605-F618 HydrophobicContact CD2-CZ 3.61Å; L605-F618 HydrophobicContact CG-CE2 3.72Å; L605-F618 HydrophobicContact CG-CZ 3.89Å
606	K	84.7	Confident	84	Confident	47 Å²	47	63.7 Å²	63.7	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-55.6	-52.7	174.8	-66.2	-173.2	-163.2	-168.6	0	112.1	L568 L602 N603 R604 Y608 L609 Q610	L568-K606 HydrophobicContact CD2-CB 3.8Å; L568-K606 HydrophobicContact CD2-CG 4.33Å; L568-K606 HydrophobicContact CG-CB 4.21Å; L568-K606 HydrophobicContact CG-CG 4.45Å; L602-K606 WeakPolarHBondContact O-CG 3.3Å; L602-K606 PolarHBondContact O-N 3.4Å; N603-K606 WeakPolarHBondContact O-CB 3.33Å; N603-K606 PolarHBondContact O-N 3.45Å; R604-K606 VanDerWaalsContact C-N 3.27Å; R604-K606 PolarHBondContact O-N 3.46Å; K606-Y608 VanDerWaalsContact C-N 3.31Å; K606-Y608 PolarHBondContact O-N 3.49Å; K606-L609 PolarHBondContact O-N 3.23Å; K606-Q610 VanDerWaalsContact O-CB 3.27Å; K606-Q610 WeakPolarHBondContact O-CB 3.47Å; K606-Q610 PolarHBondContact O-N 3.3Å
607	I	81.7	Confident	84.1	Confident	65 Å²	65	64.4 Å²	64.4	33%	0.333	33%	0.328	S	S	.	.	H	α-helix	trans	-58	-46	-179.7	-66.8	166.8	0	0	0	110.4	N603 R604 L605 L609 Q610 Y611 M613	N603-I607 WeakPolarHBondContact O-CG1 3.48Å; N603-I607 PolarHBondContact O-N 2.93Å; R604-I607 PolarHBondContact O-N 3.17Å; L605-I607 PolarHBondContact O-N 2.96Å; I607-L609 PolarHBondContact O-N 3.44Å; I607-Q610 PolarHBondContact O-N 2.88Å; I607-Y611 HydrophobicContact CG2-CD2 3.89Å; I607-Y611 HydrophobicContact CG2-CE2 4.14Å; I607-Y611 WeakPolarHBondContact O-CD2 3.42Å; I607-Y611 PolarHBondContact O-N 2.94Å; I607-Y611 VanDerWaalsContact O-N 3.1Å; I607-M613 HydrophobicContact CG2-CE 3.85Å
608	Y	86.3	Confident	84.3	Confident	32 Å²	32	60.6 Å²	60.6	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-70.1	-34.7	-175.9	-80.8	-113	0	0	0	112.4	R604 L605 K606 N612 M613 S617 F618 I621	R604-Y608 HydrophobicContact CG-CD2 3.58Å; R604-Y608 HydrophobicContact CG-CE2 3.36Å; R604-Y608 WeakPolarHBondContact O-CD2 3.4Å; R604-Y608 PolarHBondContact O-N 2.96Å; L605-Y608 PolarHBondContact O-N 2.9Å; K606-Y608 VanDerWaalsContact C-N 3.31Å; K606-Y608 PolarHBondContact O-N 3.49Å; Y608-N612 PolarHBondContact O-N 2.81Å; Y608-M613 HydrophobicContact CD1-CB 3.53Å; Y608-M613 HydrophobicContact CD1-CG 4.22Å; Y608-M613 HydrophobicContact CD1-SD 3.79Å; Y608-M613 HydrophobicContact CD2-SD 4.26Å; Y608-M613 HydrophobicContact CE1-CB 4.18Å; Y608-M613 HydrophobicContact CE1-SD 3.78Å; Y608-M613 HydrophobicContact CE2-SD 4.31Å; Y608-M613 HydrophobicContact CG-CB 4.09Å; Y608-M613 HydrophobicContact CG-SD 4.06Å; Y608-M613 PolarHBondContact O-N 3.26Å; Y608-S617 VanDerWaalsContact CE1-C 3.42Å; Y608-S617 VanDerWaalsContact CE1-OG 3.23Å; Y608-S617 WeakPolarHBondContact CE1-OG 3.35Å; Y608-S617 PolarHBondContact OH-O 3.35Å; Y608-F618 HydrophobicContact CD1-CB 3.62Å; Y608-F618 HydrophobicContact CD1-CD2 4.36Å; Y608-F618 HydrophobicContact CD2-CD2 4.36Å; Y608-F618 HydrophobicContact CE1-CB 3.81Å; Y608-F618 HydrophobicContact CG-CB 4.24Å; Y608-F618 HydrophobicContact CG-CD2 4.17Å; Y608-I621 WeakPolarHBondContact OH-CD1 3.39Å
609	L	85.5	Confident	84.5	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-71.6	-40.5	173.1	-70	174	0	0	0	111.9	F546 V549 Y550 L568 V575 L605 K606 I607 Y611 N612	F546-L609 HydrophobicContact CD1-CD2 4.28Å; F546-L609 HydrophobicContact CE1-CD2 4.33Å; F546-L609 HydrophobicContact CG-CD2 4.46Å; V549-L609 HydrophobicContact CB-CD2 4.4Å; V549-L609 HydrophobicContact CG1-CD1 4.49Å; V549-L609 HydrophobicContact CG1-CD2 4.01Å; Y550-L609 HydrophobicContact CE1-CD2 4.2Å; L568-L609 HydrophobicContact CD1-CB 3.94Å; V575-L609 HydrophobicContact CG2-CD1 4.42Å; L605-L609 WeakPolarHBondContact O-CB 3.5Å; L605-L609 VanDerWaalsContact O-CG 3.29Å; L605-L609 WeakPolarHBondContact O-CG 3.48Å; L605-L609 PolarHBondContact O-N 3.48Å; K606-L609 PolarHBondContact O-N 3.23Å; I607-L609 PolarHBondContact O-N 3.44Å; L609-Y611 VanDerWaalsContact C-N 3.32Å; L609-Y611 PolarHBondContact O-N 3.38Å; L609-N612 PolarHBondContact O-N 2.92Å
610	Q	81.8	Confident	84.5	Confident	114 Å²	114	54.3 Å²	54.3	53%	0.533	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-40.2	179.9	-178	178.5	2.2	0	0	112.1	L568 K606 I607	L568-Q610 HydrophobicContact CD1-CB 4.02Å; L568-Q610 HydrophobicContact CD2-CB 4.04Å; K606-Q610 VanDerWaalsContact O-CB 3.27Å; K606-Q610 WeakPolarHBondContact O-CB 3.47Å; K606-Q610 PolarHBondContact O-N 3.3Å; I607-Q610 PolarHBondContact O-N 2.88Å
611	Y	81.2	Confident	84.4	Confident	152 Å²	152	52.5 Å²	52.5	60%	0.596	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	11.7	-179	-65.5	-68.2	0	0	0	113.8	I607 L609 M613	I607-Y611 HydrophobicContact CG2-CD2 3.89Å; I607-Y611 HydrophobicContact CG2-CE2 4.14Å; I607-Y611 WeakPolarHBondContact O-CD2 3.42Å; I607-Y611 PolarHBondContact O-N 2.94Å; I607-Y611 VanDerWaalsContact O-N 3.1Å; L609-Y611 VanDerWaalsContact C-N 3.32Å; L609-Y611 PolarHBondContact O-N 3.38Å; Y611-M613 HydrophobicContact CD2-CE 3.83Å; Y611-M613 HydrophobicContact CG-CE 4.12Å; Y611-M613 PolarHBondContact O-N 2.95Å
612	N	79.2	Confident	84.2	Confident	114 Å²	114	52.3 Å²	52.3	61%	0.61	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	43.1	-178.7	-164.7	17	0	0	0	113.5	Y550 Y608 L609	Y550-N612 VanDerWaalsContact CE2-OD1 3.28Å; Y550-N612 WeakPolarHBondContact CE2-OD1 3.46Å; Y550-N612 WeakPolarHBondContact OH-CA 3.43Å; Y550-N612 PolarHBondContact OH-OD1 3.13Å; Y608-N612 PolarHBondContact O-N 2.81Å; L609-N612 PolarHBondContact O-N 2.92Å
613	M	81.6	Confident	84.2	Confident	62 Å²	62	53 Å²	53	31%	0.305	27%	0.266	S	S	.	.			trans	-77.1	153.2	-179.9	-63.4	-167.3	-145.7	0	0	111.4	I607 Y608 Y611	I607-M613 HydrophobicContact CG2-CE 3.85Å; Y608-M613 HydrophobicContact CD1-CB 3.53Å; Y608-M613 HydrophobicContact CD1-CG 4.22Å; Y608-M613 HydrophobicContact CD1-SD 3.79Å; Y608-M613 HydrophobicContact CD2-SD 4.26Å; Y608-M613 HydrophobicContact CE1-CB 4.18Å; Y608-M613 HydrophobicContact CE1-SD 3.78Å; Y608-M613 HydrophobicContact CE2-SD 4.31Å; Y608-M613 HydrophobicContact CG-CB 4.09Å; Y608-M613 HydrophobicContact CG-SD 4.06Å; Y608-M613 PolarHBondContact O-N 3.26Å; Y611-M613 HydrophobicContact CD2-CE 3.83Å; Y611-M613 HydrophobicContact CG-CE 4.12Å; Y611-M613 PolarHBondContact O-N 2.95Å
614	S	84.4	Confident	83.9	Confident	68 Å²	68	54.6 Å²	54.6	48%	0.476	27%	0.274	S	S	.	.			trans	-67.9	149.5	-178.6	75	0	0	0	0	112.4	E616 S617 F618	S614-E616 PolarHBondContact O-N 3.21Å; S614-S617 PolarHBondContact N-OG 3.31Å; S614-S617 PolarHBondContact O-N 3.4Å; S614-S617 VanDerWaalsContact O-N 3.1Å; S614-S617 PolarHBondContact O-OG 2.81Å; S614-S617 WeakPolarHBondContact OG-CB 3.29Å; S614-S617 PolarHBondContact OG-N 3.01Å; S614-S617 PolarHBondContact OG-OG 3.02Å; S614-F618 PolarHBondContact O-N 3.39Å
615	A	83.6	Confident	83	Confident	9 Å²	9	54.6 Å²	54.6	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-29.8	178.9	0	0	0	0	0	112.5	I542 F546 F618 L619	I542-A615 HydrophobicContact CB-CB 4.27Å; I542-A615 HydrophobicContact CG1-CB 4.13Å; I542-A615 HydrophobicContact CG2-CB 3.53Å; F546-A615 HydrophobicContact CD2-CB 3.89Å; F546-A615 HydrophobicContact CE2-CB 4.22Å; F546-A615 HydrophobicContact CG-CB 4.24Å; A615-F618 PolarHBondContact O-N 3.08Å; A615-L619 PolarHBondContact O-N 3.22Å
616	E	85.7	Confident	81.2	Confident	138 Å²	138	58.6 Å²	58.6	65%	0.645	31%	0.307	S	S	*	.	H	α-helix	trans	-65.6	-39.9	172.8	-64.2	-166.9	155.9	0	0	112.3	T539 S614 F618 L619 S620	T539-E616 HydrophobicContact CG2-CG 4.25Å; S614-E616 PolarHBondContact O-N 3.21Å; E616-F618 VanDerWaalsContact C-N 3.27Å; E616-F618 PolarHBondContact O-N 3.49Å; E616-L619 PolarHBondContact O-N 2.89Å; E616-S620 PolarHBondContact O-N 3.18Å
617	S	81.5	Confident	79.4	Confident	36 Å²	36	59.6 Å²	59.6	25%	0.252	32%	0.32	S	S	.	.	H	α-helix	trans	-63	-35.5	177.8	71.3	0	0	0	0	111.6	Y608 S614 S620	Y608-S617 VanDerWaalsContact CE1-C 3.42Å; Y608-S617 VanDerWaalsContact CE1-OG 3.23Å; Y608-S617 WeakPolarHBondContact CE1-OG 3.35Å; Y608-S617 PolarHBondContact OH-O 3.35Å; S614-S617 PolarHBondContact N-OG 3.31Å; S614-S617 PolarHBondContact O-N 3.4Å; S614-S617 VanDerWaalsContact O-N 3.1Å; S614-S617 PolarHBondContact O-OG 2.81Å; S614-S617 WeakPolarHBondContact OG-CB 3.29Å; S614-S617 PolarHBondContact OG-N 3.01Å; S614-S617 PolarHBondContact OG-OG 3.02Å; S617-S620 PolarHBondContact O-OG 3.43Å
618	F	86.7	Confident	77.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66	-44.2	174.5	173.6	-91.2	0	0	0	111.6	I542 F546 L579 I601 R604 L605 Y608 S614 A615 E616 S620 Y622	I542-F618 HydrophobicContact CD1-CB 4.21Å; I542-F618 HydrophobicContact CD1-CD1 3.07Å; I542-F618 HydrophobicContact CD1-CE1 3.49Å; I542-F618 VanDerWaalsContact CD1-CE1 3.49Å; I542-F618 HydrophobicContact CD1-CG 3.81Å; F546-F618 HydrophobicContact CZ-CB 4.44Å; L579-F618 HydrophobicContact CD2-CE1 3.82Å; L579-F618 HydrophobicContact CD2-CZ 4.11Å; I601-F618 HydrophobicContact CG2-CZ 4.15Å; R604-F618 HydrophobicContact CB-CE2 4.08Å; R604-F618 HydrophobicContact CG-CD2 3.84Å; R604-F618 HydrophobicContact CG-CE2 3.8Å; L605-F618 HydrophobicContact CD2-CD2 4.03Å; L605-F618 HydrophobicContact CD2-CE1 4.24Å; L605-F618 HydrophobicContact CD2-CE2 3.51Å; L605-F618 HydrophobicContact CD2-CZ 3.61Å; L605-F618 HydrophobicContact CG-CE2 3.72Å; L605-F618 HydrophobicContact CG-CZ 3.89Å; Y608-F618 HydrophobicContact CD1-CB 3.62Å; Y608-F618 HydrophobicContact CD1-CD2 4.36Å; Y608-F618 HydrophobicContact CD2-CD2 4.36Å; Y608-F618 HydrophobicContact CE1-CB 3.81Å; Y608-F618 HydrophobicContact CG-CB 4.24Å; Y608-F618 HydrophobicContact CG-CD2 4.17Å; S614-F618 PolarHBondContact O-N 3.39Å; A615-F618 PolarHBondContact O-N 3.08Å; E616-F618 VanDerWaalsContact C-N 3.27Å; E616-F618 PolarHBondContact O-N 3.49Å; F618-S620 VanDerWaalsContact C-N 3.33Å; F618-S620 PolarHBondContact O-N 2.93Å; F618-Y622 HydrophobicContact CD1-CE2 4.03Å; F618-Y622 HydrophobicContact CE1-CD2 4.4Å; F618-Y622 AromaticContact CE1-CE2 3.51Å; F618-Y622 HydrophobicContact CE1-CE2 3.51Å; F618-Y622 HydrophobicContact CE2-CE2 4.49Å; F618-Y622 AromaticContact CZ-CE2 3.78Å; F618-Y622 HydrophobicContact CZ-CE2 3.78Å
619	L	89.9	Confident	74.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-74.7	-22.7	-177.6	-70.4	-177.9	0	0	0	114.2	L538 T539 I542 A615 E616 I621 Y622 F623	L538-L619 HydrophobicContact CB-CD1 4.35Å; L538-L619 HydrophobicContact CD2-CD1 4.35Å; L538-L619 HydrophobicContact CD2-CD2 3.44Å; L538-L619 VanDerWaalsContact CD2-CD2 3.44Å; L538-L619 HydrophobicContact CG-CD1 4.12Å; L538-L619 HydrophobicContact CG-CD2 3.77Å; T539-L619 VanDerWaalsContact CA-CD1 3.5Å; I542-L619 HydrophobicContact CD1-CD2 4.32Å; I542-L619 HydrophobicContact CD1-CG 4.32Å; I542-L619 HydrophobicContact CG2-CD1 3.46Å; I542-L619 VanDerWaalsContact CG2-CD1 3.46Å; I542-L619 HydrophobicContact CG2-CG 3.95Å; A615-L619 PolarHBondContact O-N 3.22Å; E616-L619 PolarHBondContact O-N 2.89Å; L619-I621 PolarHBondContact O-N 3.31Å; L619-I621 VanDerWaalsContact O-N 3.09Å; L619-Y622 HydrophobicContact CD2-CD2 4.08Å; L619-Y622 PolarHBondContact O-N 2.89Å; L619-F623 HydrophobicContact CB-CD2 4.26Å; L619-F623 HydrophobicContact CB-CE2 3.93Å; L619-F623 HydrophobicContact CB-CZ 4.12Å; L619-F623 HydrophobicContact CD1-CE2 4.08Å; L619-F623 HydrophobicContact CD1-CZ 3.88Å; L619-F623 HydrophobicContact CG-CZ 4.44Å; L619-F623 PolarHBondContact O-N 3.02Å
620	S	83.4	Confident	72.3	Confident	49 Å²	49	66.5 Å²	66.5	34%	0.343	35%	0.353	S	S	.	.	H	α-helix	trans	-50.7	-37.2	-179.5	72.2	0	0	0	0	112.5	E616 S617 F618 Y622 F623 N624	E616-S620 PolarHBondContact O-N 3.18Å; S617-S620 PolarHBondContact O-OG 3.43Å; F618-S620 VanDerWaalsContact C-N 3.33Å; F618-S620 PolarHBondContact O-N 2.93Å; S620-Y622 VanDerWaalsContact C-N 3.33Å; S620-Y622 PolarHBondContact O-N 2.64Å; S620-F623 PolarHBondContact O-N 3.32Å; S620-N624 CarbonylContact O-C 3.49Å; S620-N624 WeakPolarHBondContact O-CA 3.39Å; S620-N624 WeakPolarHBondContact O-CB 3.46Å; S620-N624 PolarHBondContact O-N 3.11Å
621	I	80.3	Confident	69.7	Low	35 Å²	35	69.4 Å²	69.4	18%	0.179	37%	0.367	C	S	.	.	H	α-helix	trans	-68.8	-30.5	-178.4	-58.6	167.5	0	0	0	112.1	R604 Y608 L619 P625	R604-I621 VanDerWaalsContact NH1-CG2 3.26Å; Y608-I621 WeakPolarHBondContact OH-CD1 3.39Å; L619-I621 PolarHBondContact O-N 3.31Å; L619-I621 VanDerWaalsContact O-N 3.09Å; I621-P625 VanDerWaalsContact O-CA 3.29Å; I621-P625 WeakPolarHBondContact O-CA 3.48Å
622	Y	83.7	Confident	67.2	Low	2 Å²	2	68.7 Å²	68.7	1%	0.008	37%	0.372	C	S	.	.	H	α-helix	trans	-86.3	-37.6	178.4	-52.5	-64.4	0	0	0	111.6	L587 Q592 H596 R604 F618 L619 S620	L587-Y622 HydrophobicContact CD2-CD1 3.82Å; L587-Y622 HydrophobicContact CD2-CG 4.4Å; Q592-Y622 PolarHBondContact NE2-O 3.07Å; Q592-Y622 PolarHBondContact OE1-O 3.43Å; H596-Y622 HydrophobicContact CB-CE1 4.37Å; H596-Y622 AromaticContact CD2-CD1 3.81Å; H596-Y622 AromaticContact CD2-CE1 3.84Å; H596-Y622 AromaticContact CE1-CD1 3.97Å; H596-Y622 AromaticContact CE1-CE1 3.83Å; H596-Y622 AromaticContact CG-CE1 3.72Å; H596-Y622 AromaticContact ND1-CE1 3.73Å; H596-Y622 AromaticContact NE2-CD1 3.64Å; H596-Y622 AromaticContact NE2-CE1 3.88Å; R604-Y622 PolarHBondContact NH1-OH 2.71Å; F618-Y622 HydrophobicContact CD1-CE2 4.03Å; F618-Y622 HydrophobicContact CE1-CD2 4.4Å; F618-Y622 AromaticContact CE1-CE2 3.51Å; F618-Y622 HydrophobicContact CE1-CE2 3.51Å; F618-Y622 HydrophobicContact CE2-CE2 4.49Å; F618-Y622 AromaticContact CZ-CE2 3.78Å; F618-Y622 HydrophobicContact CZ-CE2 3.78Å; L619-Y622 HydrophobicContact CD2-CD2 4.08Å; L619-Y622 PolarHBondContact O-N 2.89Å; S620-Y622 VanDerWaalsContact C-N 3.33Å; S620-Y622 PolarHBondContact O-N 2.64Å
623	F	87.2	Confident	64.6	Low	35 Å²	35	70.2 Å²	70.2	15%	0.154	38%	0.376	C	S	.	.	H	α-helix	trans	-74	-38.7	-179.6	-65.5	-8.5	0	0	0	112	Q535 L538 Y586 L619 S620	Q535-F623 HydrophobicContact CB-CE1 3.95Å; Q535-F623 HydrophobicContact CB-CE2 3.99Å; Q535-F623 HydrophobicContact CB-CZ 3.62Å; Q535-F623 HydrophobicContact CG-CD1 3.82Å; Q535-F623 HydrophobicContact CG-CD2 4.47Å; Q535-F623 HydrophobicContact CG-CE1 3.56Å; Q535-F623 HydrophobicContact CG-CE2 4.24Å; Q535-F623 HydrophobicContact CG-CG 4.28Å; Q535-F623 HydrophobicContact CG-CZ 3.78Å; L538-F623 HydrophobicContact CB-CZ 4.29Å; L538-F623 HydrophobicContact CD2-CE1 3.84Å; L538-F623 HydrophobicContact CD2-CZ 4.1Å; Y586-F623 HydrophobicContact CD1-CE1 4.47Å; Y586-F623 AromaticContact CE1-CD1 3.72Å; Y586-F623 HydrophobicContact CE1-CD1 3.72Å; Y586-F623 HydrophobicContact CE1-CE1 4.01Å; Y586-F623 HydrophobicContact CE2-CD1 4.38Å; Y586-F623 HydrophobicContact CE2-CE1 4.29Å; Y586-F623 AromaticContact CZ-CD1 3.59Å; Y586-F623 AromaticContact CZ-CE1 3.89Å; Y586-F623 WeakPolarHBondContact OH-CD1 3.39Å; L619-F623 HydrophobicContact CB-CD2 4.26Å; L619-F623 HydrophobicContact CB-CE2 3.93Å; L619-F623 HydrophobicContact CB-CZ 4.12Å; L619-F623 HydrophobicContact CD1-CE2 4.08Å; L619-F623 HydrophobicContact CD1-CZ 3.88Å; L619-F623 HydrophobicContact CG-CZ 4.44Å; L619-F623 PolarHBondContact O-N 3.02Å; S620-F623 PolarHBondContact O-N 3.32Å
624	N	78.2	Confident	61.8	Low	124 Å²	124	73 Å²	73	66%	0.663	40%	0.4	S	S	*	.	S	Bend	trans	-123.8	76.1	177.8	-57.6	-38.9	0	0	0	108.2	S620	S620-N624 CarbonylContact O-C 3.49Å; S620-N624 WeakPolarHBondContact O-CA 3.39Å; S620-N624 WeakPolarHBondContact O-CB 3.46Å; S620-N624 PolarHBondContact O-N 3.11Å
625	P	67.3	Low	59	Low	49 Å²	49	79.1 Å²	79.1	32%	0.318	41%	0.414	S	S	.	.			trans	-56.3	134.9	175.1	27.9	-36.9	0	0	0	109.3	Q592 I621 S627 F630	Q592-P625 VanDerWaalsContact NE2-CG 3.29Å; I621-P625 VanDerWaalsContact O-CA 3.29Å; I621-P625 WeakPolarHBondContact O-CA 3.48Å; P625-S627 PolarHBondContact O-N 2.95Å; P625-F630 HydrophobicContact CB-CE2 4.37Å
626	P	51.7	Low	56.1	Low	84 Å²	84	86.2 Å²	86.2	55%	0.545	45%	0.445	S	S	.	.			trans	-56.4	135.7	170.7	22.6	-30.4	0	0	0	108.9	E628	P626-E628 PolarHBondContact O-N 3.36Å; P626-E628 VanDerWaalsContact O-N 3.07Å
627	S	47.3	Very low	53	Low	69 Å²	69	88 Å²	88	48%	0.483	45%	0.453	S	S	.	.	S	Bend	trans	-65.4	-9	-178.3	-53.4	0	0	0	0	113.2	P625	P625-S627 PolarHBondContact O-N 2.95Å
628	E	37.9	Very low	50.2	Low	67 Å²	67	93.2 Å²	93.2	31%	0.313	47%	0.474	S	S	.	.	S	Bend	trans	-104	138	173.1	-66	-176.7	177	0	0	109.8	P626 R722	P626-E628 PolarHBondContact O-N 3.36Å; P626-E628 VanDerWaalsContact O-N 3.07Å; E628-R722 WeakPolarHBondContact OE1-CD 3.49Å; E628-R722 IonicContact OE2-CZ 3.95Å; E628-R722 IonicContact OE2-NE 2.65Å; E628-R722 IonicContact OE2-NH1 3.25Å; E628-R722 PolarHBondContact OE2-NH1 3.3Å
629	L	31.6	Very low	47.1	Very low	108 Å²	108	98 Å²	98	57%	0.565	51%	0.506	S	S	*	.			trans	74.3	86.3	-168.9	-72.5	116.6	0	0	0	114.9
630	F	33.3	Very low	43.8	Very low	81 Å²	81	104.3 Å²	104.3	36%	0.355	54%	0.54	S	S	.	.	S	Bend		-139.5	10.8	118.1	-70.9	-43.6	0	0	0	113.7	Y595 P625	Y595-F630 VanDerWaalsContact CB-CD1 3.41Å; Y595-F630 HydrophobicContact CD1-CB 4.05Å; Y595-F630 AromaticContact CD1-CD1 3.03Å; Y595-F630 HydrophobicContact CD1-CD1 3.03Å; Y595-F630 AromaticContact CD1-CE1 3.67Å; Y595-F630 HydrophobicContact CD1-CE1 3.67Å; Y595-F630 AromaticContact CD1-CG 3.59Å; Y595-F630 HydrophobicContact CD1-CG 3.59Å; Y595-F630 HydrophobicContact CD2-CB 4.5Å; Y595-F630 AromaticContact CD2-CD1 3.36Å; Y595-F630 HydrophobicContact CD2-CD1 3.36Å; Y595-F630 AromaticContact CD2-CD2 3.62Å; Y595-F630 HydrophobicContact CD2-CD2 3.62Å; Y595-F630 AromaticContact CD2-CE1 3.41Å; Y595-F630 HydrophobicContact CD2-CE1 3.41Å; Y595-F630 VanDerWaalsContact CD2-CE1 3.41Å; Y595-F630 AromaticContact CD2-CE2 3.58Å; Y595-F630 HydrophobicContact CD2-CE2 3.58Å; Y595-F630 AromaticContact CD2-CG 3.52Å; Y595-F630 HydrophobicContact CD2-CG 3.52Å; Y595-F630 AromaticContact CD2-CZ 3.48Å; Y595-F630 HydrophobicContact CD2-CZ 3.48Å; Y595-F630 VanDerWaalsContact CD2-CZ 3.48Å; Y595-F630 HydrophobicContact CE1-CB 3.46Å; Y595-F630 VanDerWaalsContact CE1-CB 3.46Å; Y595-F630 AromaticContact CE1-CD1 3.43Å; Y595-F630 HydrophobicContact CE1-CD1 3.43Å; Y595-F630 VanDerWaalsContact CE1-CD1 3.43Å; Y595-F630 HydrophobicContact CE1-CD2 4.37Å; Y595-F630 HydrophobicContact CE1-CE1 4.39Å; Y595-F630 AromaticContact CE1-CG 3.46Å; Y595-F630 HydrophobicContact CE1-CG 3.46Å; Y595-F630 VanDerWaalsContact CE1-CG 3.46Å; Y595-F630 HydrophobicContact CE2-CB 4.01Å; Y595-F630 AromaticContact CE2-CD1 3.76Å; Y595-F630 HydrophobicContact CE2-CD1 3.76Å; Y595-F630 AromaticContact CE2-CD2 3.47Å; Y595-F630 HydrophobicContact CE2-CD2 3.47Å; Y595-F630 VanDerWaalsContact CE2-CD2 3.47Å; Y595-F630 HydrophobicContact CE2-CE1 4.21Å; Y595-F630 AromaticContact CE2-CE2 3.87Å; Y595-F630 HydrophobicContact CE2-CE2 3.87Å; Y595-F630 AromaticContact CE2-CG 3.41Å; Y595-F630 HydrophobicContact CE2-CG 3.41Å; Y595-F630 VanDerWaalsContact CE2-CG 3.41Å; Y595-F630 HydrophobicContact CE2-CZ 4.22Å; Y595-F630 AromaticContact CG-CD1 2.97Å; Y595-F630 HydrophobicContact CG-CD1 2.97Å; Y595-F630 HydrophobicContact CG-CD2 4.16Å; Y595-F630 AromaticContact CG-CE1 3.09Å; Y595-F630 HydrophobicContact CG-CE1 3.09Å; Y595-F630 HydrophobicContact CG-CE2 4.17Å; Y595-F630 AromaticContact CG-CG 3.61Å; Y595-F630 HydrophobicContact CG-CG 3.61Å; Y595-F630 AromaticContact CG-CZ 3.68Å; Y595-F630 HydrophobicContact CG-CZ 3.68Å; Y595-F630 VanDerWaalsContact CZ-CB 3.43Å; Y595-F630 AromaticContact CZ-CD1 3.77Å; Y595-F630 AromaticContact CZ-CD2 3.86Å; Y595-F630 AromaticContact CZ-CG 3.35Å; P625-F630 HydrophobicContact CB-CE2 4.37Å
631	H	28.8	Very low	40.9	Very low	175 Å²	175	108.4 Å²	108.4	81%	0.81	56%	0.558	S	S	*	*	S	Bend	trans	-96.7	4.2	177.6	-140.3	-58.3	0	0	0	114.6
632	L	27.7	Very low	38.1	Very low	136 Å²	136	116.4 Å²	116.4	71%	0.712	59%	0.591	S	S	*	*	S	Bend	trans	-129.3	16.2	-169.2	-85.3	164.8	0	0	0	117.1
633	Q	24.1	Very low	35.4	Very low	146 Å²	146	122.5 Å²	122.5	68%	0.682	63%	0.628	S	S	*	*	S	Bend	trans	-119.2	4.2	168.7	-99.2	176.5	-18.5	0	0	115.7
634	C	23.4	Very low	32.3	Very low	120 Å²	120	127.7 Å²	127.7	81%	0.811	66%	0.657	S	S	*	*	S	Bend	trans	-89.8	-0.4	166.2	-66.1	0	0	0	0	113.9
635	Y	25.3	Very low	29.8	Very low	197 Å²	197	129.4 Å²	129.4	77%	0.773	67%	0.667	S	S	*	*	S	Bend	trans	-115.5	80.4	164.4	-79.9	-82.4	0	0	0	107.8
636	H	22.1	Very low	27.9	Very low	158 Å²	158	132.3 Å²	132.3	73%	0.731	69%	0.685	S	S	*	*			trans	-179.6	51	146.8	-95.6	42.3	0	0	0	108.3	Q638	H636-Q638 VanDerWaalsContact C-N 3.32Å
637	H	21.8	Very low	26.5	Very low	175 Å²	175	139.4 Å²	139.4	81%	0.81	70%	0.702	S	S	*	*			trans	-96	82.4	139.2	-88.6	-71	0	0	0	105.5	C639	H637-C639 PolarHBondContact O-N 3.42Å
638	Q	21.5	Very low	25.4	Very low	147 Å²	147	143.2 Å²	143.2	69%	0.687	72%	0.716	S	S	*	*			trans	-58.1	84.9	143.5	-93.2	163.4	-43.2	0	0	105.6	H636 N640	H636-Q638 VanDerWaalsContact C-N 3.32Å; Q638-N640 PolarHBondContact O-N 2.92Å
639	C	22.2	Very low	24.7	Very low	99 Å²	99	147.1 Å²	147.1	67%	0.669	74%	0.739	S	S	*	*			trans	-67	84.2	149.5	-76.1	0	0	0	0	105.5	H637 D641	H637-C639 PolarHBondContact O-N 3.42Å; C639-D641 PolarHBondContact O-N 3.47Å
640	N	20.1	Very low	24.3	Very low	135 Å²	135	146.3 Å²	146.3	72%	0.722	74%	0.743	S	S	*	*			trans	-60	87.8	143.1	-81.4	-24.6	0	0	0	106.3	Q638	Q638-N640 PolarHBondContact O-N 2.92Å
641	D	23.1	Very low	23.9	Very low	135 Å²	135	150.3 Å²	150.3	72%	0.722	76%	0.763	S	S	*	*			trans	-120.4	102.3	149.8	-82.4	-38.2	0	0	0	107.3	C639 V643	C639-D641 PolarHBondContact O-N 3.47Å; D641-V643 VanDerWaalsContact C-N 3.32Å; D641-V643 PolarHBondContact O-N 2.89Å
642	K	21.6	Very low	23.6	Very low	203 Å²	203	148.4 Å²	148.4	88%	0.883	76%	0.758	S	S	*	*			trans	-52	97.3	158.6	-66	173.4	176.3	178.4	0	107.7
643	V	26.9	Very low	23.6	Very low	129 Å²	129	153 Å²	153	78%	0.782	77%	0.768	S	S	*	*			trans	-130.4	108.9	156.5	-176.5	0	0	0	0	107.8	D641	D641-V643 VanDerWaalsContact C-N 3.32Å; D641-V643 PolarHBondContact O-N 2.89Å
644	N	22.8	Very low	23.5	Very low	144 Å²	144	157 Å²	157	77%	0.77	78%	0.777	S	S	*	*			trans	-49.4	130.1	173.7	-58.4	-39	0	0	0	111.4
645	N	26	Very low	23.4	Very low	161 Å²	161	162.2 Å²	162.2	86%	0.861	78%	0.781	S	S	*	*				-165.5	128.4	122.1	-113.4	-25.3	0	0	0	112.5
646	P	27	Very low	23.3	Very low	109 Å²	109	162.3 Å²	162.3	71%	0.708	79%	0.785	S	S	*	*			trans	-94	133.3	179.1	35.3	-28.2	0	0	0	111.2
647	R	20.9	Very low	23.3	Very low	234 Å²	234	161.4 Å²	161.4	88%	0.883	78%	0.784	S	S	*	*			trans	145.3	104.7	150	-91.3	176.5	165.5	165.2	-3.8	110.6
648	N	25	Very low	23.3	Very low	148 Å²	148	159.4 Å²	159.4	79%	0.791	79%	0.789	S	S	*	*				176	112.6	105.9	-91.1	-19.1	0	0	0	110.9
649	N	22.6	Very low	23.3	Very low	149 Å²	149	159.9 Å²	159.9	80%	0.797	79%	0.791	S	S	*	*			trans	-4.2	128.8	147.1	-78.4	-10.5	0	0	0	118
650	S	23	Very low	23.3	Very low	92 Å²	92	161.2 Å²	161.2	64%	0.643	79%	0.791	S	S	*	*				27.5	117.9	129.8	66	0	0	0	0	117.9
651	Q	25.9	Very low	23.6	Very low	164 Å²	164	163 Å²	163	77%	0.766	80%	0.801	S	S	*	*				178.2	125.1	122	-94.8	164.1	26.3	0	0	112
652	N	22.3	Very low	23.5	Very low	135 Å²	135	162 Å²	162	72%	0.722	80%	0.8	S	S	*	*			trans	50.3	96.2	137.5	-63.6	-28.2	0	0	0	120
653	Y	28.1	Very low	23.6	Very low	234 Å²	234	159.7 Å²	159.7	92%	0.918	80%	0.797	S	S	*	*			trans	-105.6	92	143.5	-77.1	-75.5	0	0	0	110.2
654	R	21.4	Very low	23.4	Very low	229 Å²	229	161.4 Å²	161.4	86%	0.864	80%	0.801	S	S	*	*			trans	-68.4	124.1	172.4	-157.9	175	-165.4	145.9	0.3	108.7	K656	R654-K656 PolarHBondContact O-N 3.22Å
655	Y	21.5	Very low	23.5	Very low	229 Å²	229	160.7 Å²	160.7	90%	0.898	80%	0.797	S	S	*	*			trans	-57.7	115.5	168.1	-81.3	-98.6	0	0	0	109.7
656	K	23	Very low	23.2	Very low	199 Å²	199	161.1 Å²	161.1	87%	0.865	80%	0.799	S	S	*	*			trans	-87.7	113.3	167.1	-94.4	-177.1	175.4	179.9	0	109.2	R654	R654-K656 PolarHBondContact O-N 3.22Å
657	I	22	Very low	23.1	Very low	139 Å²	139	164.7 Å²	164.7	71%	0.713	80%	0.804	S	S	*	*			trans	-68.1	118.9	165.3	-67.5	163.8	0	0	0	107.3	Q659	I657-Q659 HydrophobicContact CG2-CG 3.9Å; I657-Q659 PolarHBondContact O-N 3.45Å
658	C	23.1	Very low	23.1	Very low	134 Å²	134	161.8 Å²	161.8	91%	0.905	80%	0.8	S	S	*	*			trans	-87.1	94.5	163.6	-67.8	0	0	0	0	107.7
659	Q	20.9	Very low	22.8	Very low	156 Å²	156	163.3 Å²	163.3	73%	0.729	80%	0.8	S	S	*	*			trans	-85.4	150.9	155.8	-85.5	173.9	-10.5	0	0	108.8	I657	I657-Q659 HydrophobicContact CG2-CG 3.9Å; I657-Q659 PolarHBondContact O-N 3.45Å
660	N	22.7	Very low	22.7	Very low	127 Å²	127	162.3 Å²	162.3	68%	0.679	80%	0.799	S	S	*	*			trans	83.9	95.5	164.9	-58.3	-7.6	0	0	0	117.3
661	D	25.2	Very low	22.6	Very low	174 Å²	174	168 Å²	168	93%	0.93	81%	0.808	S	S	*	*				-140.7	66.4	128.5	-84.2	-33	0	0	0	108.1
662	T	21.9	Very low	22.5	Very low	113 Å²	113	165.5 Å²	165.5	69%	0.693	81%	0.809	S	S	*	*			trans	-90.3	97.5	153.2	47.9	0	0	0	0	105.9
663	N	23.2	Very low	22.4	Very low	154 Å²	154	165 Å²	165	82%	0.824	81%	0.811	S	S	*	*			trans	162.6	80.2	152.5	-80.6	-14.5	0	0	0	110.3
664	L	23.6	Very low	22.1	Very low	165 Å²	165	160.7 Å²	160.7	86%	0.864	80%	0.799	S	S	*	*			trans	-163.2	141.6	145.6	-118	134.2	0	0	0	109.7
665	L	23.7	Very low	22.1	Very low	129 Å²	129	159.9 Å²	159.9	68%	0.675	80%	0.796	S	S	*	*			trans	92.5	54.4	174.5	-48.3	166.9	0	0	0	115.7	F667	L665-F667 HydrophobicContact CB-CD2 4.43Å; L665-F667 HydrophobicContact CD2-CD2 3.76Å; L665-F667 HydrophobicContact CD2-CE2 3.51Å; L665-F667 PolarHBondContact O-N 3.45Å
666	N	19.8	Very low	22.1	Very low	171 Å²	171	155.9 Å²	155.9	91%	0.914	79%	0.79	S	S	*	*			trans	-63.6	104	134.4	-72.6	-19.3	0	0	0	107.5
667	F	24.2	Very low	22.3	Very low	183 Å²	183	152.6 Å²	152.6	80%	0.803	79%	0.787	S	S	*	*			trans	-103.7	105.7	159.8	-100.5	-79	0	0	0	108	L665	L665-F667 HydrophobicContact CB-CD2 4.43Å; L665-F667 HydrophobicContact CD2-CD2 3.76Å; L665-F667 HydrophobicContact CD2-CE2 3.51Å; L665-F667 PolarHBondContact O-N 3.45Å
668	E	21.3	Very low	22.3	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	79%	0.788	S	S	*	*			trans	-62.8	139.2	177.4	-156.7	168	-164.6	0	0	110.5	T670	E668-T670 PolarHBondContact O-N 2.88Å
669	K	19.8	Very low	22.5	Very low	179 Å²	179	153.5 Å²	153.5	78%	0.778	78%	0.784	S	S	*	*			trans	-70	112.4	175.8	-70.9	171.1	177.5	174.3	0	109.1
670	T	20.3	Very low	22.5	Very low	129 Å²	129	152 Å²	152	79%	0.791	79%	0.786	S	S	*	*			trans	-106	115.7	161.6	44.9	0	0	0	0	109.5	E668	E668-T670 PolarHBondContact O-N 2.88Å
671	Y	20.3	Very low	22.5	Very low	210 Å²	210	153.3 Å²	153.3	82%	0.824	79%	0.792	S	S	*	*			trans	-75.4	126	165.1	-72.5	-94.6	0	0	0	108.1
672	S	24.3	Very low	22.4	Very low	113 Å²	113	152 Å²	152	79%	0.79	78%	0.78	S	S	*	*			trans	-135.8	104.5	156.2	48.2	0	0	0	0	109.2
673	T	19.8	Very low	22.5	Very low	125 Å²	125	154.2 Å²	154.2	77%	0.767	78%	0.783	S	S	*	*			trans	-55.9	134	155.1	40.7	0	0	0	0	110
674	E	21.7	Very low	22.5	Very low	143 Å²	143	152.9 Å²	152.9	67%	0.668	79%	0.785	S	S	*	*				157.7	139.9	115.6	-86.9	-167.7	-178	0	0	113.9
675	R	21.3	Very low	22.5	Very low	211 Å²	211	148 Å²	148	80%	0.796	78%	0.776	S	S	*	*			trans	79.8	93.1	151.2	-71.3	174.3	-135.7	-168.5	4.3	119.9
676	N	21.4	Very low	22.5	Very low	145 Å²	145	153 Å²	153	78%	0.775	79%	0.785	S	S	*	*				11.7	116.4	111.9	-75.2	-13.3	0	0	0	117
677	V	28	Very low	22.7	Very low	130 Å²	130	150.8 Å²	150.8	79%	0.788	77%	0.773	S	S	*	*				-146	104	126.2	179.2	0	0	0	0	107.1
678	N	22.1	Very low	22.7	Very low	140 Å²	140	148.6 Å²	148.6	75%	0.749	76%	0.763	S	S	*	*			trans	-78.3	130.7	163.2	-72	-29	0	0	0	107.5
679	N	26	Very low	22.9	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	76%	0.764	S	S	*	*			trans	-138.8	113	151.9	-89.9	-23.8	0	0	0	109.6
680	T	21.2	Very low	23.3	Very low	124 Å²	124	146.1 Å²	146.1	76%	0.761	76%	0.763	S	S	*	*			trans	-64.3	141.1	168.1	43.6	0	0	0	0	112.5
681	L	24.4	Very low	23.4	Very low	154 Å²	154	149.5 Å²	149.5	81%	0.806	77%	0.767	S	S	*	*			trans	-171.5	96.2	135.8	-153.8	65.7	0	0	0	106.2
682	E	22.2	Very low	23.8	Very low	147 Å²	147	146.3 Å²	146.3	69%	0.687	76%	0.764	S	S	*	*				85.9	146.9	77.6	-90.6	-150.5	178.9	0	0	114.5
683	Q	23.4	Very low	23.9	Very low	160 Å²	160	149 Å²	149	75%	0.748	76%	0.764	S	S	*	*			trans	86.5	104.3	151	-78.6	169.8	40.8	0	0	118.7
684	S	22.8	Very low	24.4	Very low	125 Å²	125	152.3 Å²	152.3	87%	0.874	77%	0.768	S	S	*	*				137.1	137.7	86.9	-174.7	0	0	0	0	114.1
685	G	24.3	Very low	24.7	Very low	64 Å²	64	152.8 Å²	152.8	66%	0.66	78%	0.775	S	S	*	*			trans	112.8	80.1	147.3	0	0	0	0	0	116.1
686	R	23	Very low	25.1	Very low	233 Å²	233	146 Å²	146	88%	0.879	76%	0.76	S	S	*	*				71.2	122	95.4	-98.8	-175.6	174.5	157.7	-0.7	117.8
687	N	24.1	Very low	25.7	Very low	124 Å²	124	146.9 Å²	146.9	66%	0.663	77%	0.765	S	S	*	*			trans	86.6	98.7	136	-68	-8.8	0	0	0	121
688	K	25	Very low	25.9	Very low	137 Å²	137	146.1 Å²	146.1	60%	0.596	76%	0.76	S	S	*	*				28	115.8	119	-68.9	-179.4	173.2	179.4	0	117.4	H24	H24-K688 VanDerWaalsContact CD2-CE 3.44Å; H24-K688 WeakPolarHBondContact CD2-CE 3.48Å; H24-K688 WeakPolarHBondContact CE1-CE 3.3Å; H24-K688 PolarHBondContact CE1-NZ 3.33Å; H24-K688 VanDerWaalsContact CE1-NZ 3.29Å; H24-K688 WeakPolarHBondContact NE2-CE 3.44Å; H24-K688 PolarHBondContact NE2-NZ 2.84Å
689	N	25.9	Very low	26.5	Very low	153 Å²	153	146.6 Å²	146.6	82%	0.818	76%	0.756	S	S	*	*				-166.1	130.4	121.5	-96.2	-17	0	0	0	112.9
690	I	28.4	Very low	27.4	Very low	148 Å²	148	145.3 Å²	145.3	76%	0.759	75%	0.753	S	S	*	*			trans	78.3	96.6	152.9	-53.4	164	0	0	0	117.5
691	K	22.7	Very low	28.7	Very low	201 Å²	201	144.5 Å²	144.5	87%	0.874	74%	0.739	S	S	*	*			trans	-62.4	128.6	149.1	-67	175.5	173.7	-175.9	0	109.1
692	N	27.8	Very low	30.4	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	71%	0.714	S	S	*	*			trans	-148.2	123.6	141.5	-93.6	-13.2	0	0	0	107.4	F694	N692-F694 PolarHBondContact O-N 3.32Å
693	E	25.7	Very low	32.3	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.794	70%	0.699	S	S	*	*			trans	-51.3	123.7	-178.8	-69.8	159.3	122.7	0	0	112
694	F	30	Very low	34.7	Very low	193 Å²	193	128.7 Å²	128.7	85%	0.846	67%	0.665	S	S	*	*			trans	-101.9	69.8	156.9	-89.9	-81.6	0	0	0	109.1	N692 S696	N692-F694 PolarHBondContact O-N 3.32Å; F694-S696 VanDerWaalsContact C-N 3.26Å; F694-S696 PolarHBondContact O-N 3.35Å; F694-S696 VanDerWaalsContact O-N 3.15Å
695	N	28.1	Very low	37.2	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	65%	0.646	S	S	*	*			trans	-77.8	83	155.6	-88.3	-17.6	0	0	0	107.8
696	S	31.2	Very low	39.6	Very low	70 Å²	70	125.3 Å²	125.3	49%	0.49	62%	0.617	S	S	.	*			trans	-126.7	112.9	165.5	69.6	0	0	0	0	109.8	F694 T698	F694-S696 VanDerWaalsContact C-N 3.26Å; F694-S696 PolarHBondContact O-N 3.35Å; F694-S696 VanDerWaalsContact O-N 3.15Å; S696-T698 PolarHBondContact O-N 3.21Å
697	N	32.8	Very low	41.9	Very low	163 Å²	163	118.4 Å²	118.4	87%	0.872	59%	0.591	S	S	*	*			trans	-49.5	86.9	163.2	-73	-35.5	0	0	0	109.4	K699	N697-K699 PolarHBondContact O-N 3.44Å
698	T	32.2	Very low	44.2	Very low	113 Å²	113	115.1 Å²	115.1	69%	0.693	57%	0.573	S	S	*	*			trans	-71.8	94.4	176.7	44.9	0	0	0	0	107.9	S696 V700	S696-T698 PolarHBondContact O-N 3.21Å; T698-V700 PolarHBondContact O-N 3.03Å; T698-V700 VanDerWaalsContact O-N 3.12Å
699	K	36.2	Very low	46.1	Very low	151 Å²	151	111.1 Å²	111.1	66%	0.657	56%	0.562	S	S	*	*			trans	-64.2	111.5	170.6	-71.8	179.8	180	176.1	0	108.2	N697 F701	N697-K699 PolarHBondContact O-N 3.44Å; K699-F701 HydrophobicContact CB-CE2 4.05Å; K699-F701 HydrophobicContact CB-CZ 4.01Å; K699-F701 HydrophobicContact CD-CZ 4.46Å; K699-F701 WeakPolarHBondContact O-CD2 3.36Å; K699-F701 PolarHBondContact O-N 2.89Å
700	V	44.8	Very low	47.8	Very low	125 Å²	125	104.8 Å²	104.8	76%	0.758	53%	0.528	S	S	*	.			trans	-81.5	104.6	175.3	-179.1	0	0	0	0	108.6	T698	T698-V700 PolarHBondContact O-N 3.03Å; T698-V700 VanDerWaalsContact O-N 3.12Å
701	F	48.3	Very low	48.9	Very low	107 Å²	107	102.3 Å²	102.3	47%	0.469	52%	0.522	S	S	.	.			trans	-79.8	142.2	174.6	-62	-77.7	0	0	0	111.3	K699 T769 L785	K699-F701 HydrophobicContact CB-CE2 4.05Å; K699-F701 HydrophobicContact CB-CZ 4.01Å; K699-F701 HydrophobicContact CD-CZ 4.46Å; K699-F701 WeakPolarHBondContact O-CD2 3.36Å; K699-F701 PolarHBondContact O-N 2.89Å; F701-T769 HydrophobicContact CE1-CG2 3.68Å; F701-T769 HydrophobicContact CZ-CG2 4.11Å; F701-L785 CarbonylContact C-O 3.58Å; F701-L785 VanDerWaalsContact CA-O 3.31Å; F701-L785 WeakPolarHBondContact CA-O 3.35Å
702	Q	60.2	Low	50	Low	58 Å²	58	98.2 Å²	98.2	27%	0.271	51%	0.508	S	S	.	.			trans	-105.4	121.8	171.6	-59.4	-168.6	-1.4	0	0	109.9	L785	Q702-L785 PolarHBondContact N-O 3.41Å; Q702-L785 PolarHBondContact O-N 3.49Å
703	T	62.1	Low	50.8	Low	61 Å²	61	97.2 Å²	97.2	37%	0.374	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.1	177.7	63.8	0	0	0	0	111.5	E782 I783 K784	T703-E782 WeakPolarHBondContact CB-OE1 3.48Å; T703-I783 WeakPolarHBondContact CA-O 3.33Å; T703-K784 HydrophobicContact CG2-CB 4.48Å; T703-K784 HydrophobicContact CG2-CD 4.4Å; T703-K784 HydrophobicContact CG2-CG 3.87Å
704	W	74.1	Confident	51.8	Low	10 Å²	10	95.3 Å²	95.3	4%	0.038	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.1	175.9	-72.4	81	0	0	0	109.2	V364 L725 R727 L732 I783	V364-W704 HydrophobicContact CG1-CD2 4.12Å; V364-W704 HydrophobicContact CG1-CG 4.17Å; V364-W704 HydrophobicContact CG1-CZ2 4.1Å; V364-W704 VanDerWaalsContact CG1-NE1 3.32Å; V364-W704 HydrophobicContact CG2-CD2 4.01Å; V364-W704 HydrophobicContact CG2-CE3 4.36Å; V364-W704 HydrophobicContact CG2-CG 4.12Å; W704-L725 HydrophobicContact CE3-CB 3.99Å; W704-L725 HydrophobicContact CZ3-CB 4.3Å; W704-R727 HydrophobicContact CD2-CB 3.74Å; W704-R727 HydrophobicContact CE3-CB 3.67Å; W704-R727 HydrophobicContact CG-CB 4.32Å; W704-R727 HydrophobicContact CH2-CB 4.26Å; W704-R727 HydrophobicContact CZ2-CB 4.3Å; W704-R727 HydrophobicContact CZ3-CB 3.95Å; W704-L732 HydrophobicContact CH2-CD1 4Å; W704-L732 HydrophobicContact CZ3-CD1 3.88Å; W704-L732 HydrophobicContact CZ3-CG 4.23Å; W704-I783 HydrophobicContact CB-CB 4.47Å; W704-I783 PolarHBondContact N-O 3.3Å; W704-I783 PolarHBondContact O-N 3.49Å
705	K	73.6	Confident	52.8	Low	108 Å²	108	90.7 Å²	90.7	47%	0.47	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.6	173.7	-64.5	-175.1	179	-174.6	0	109.1	L725 V726 M780	K705-L725 WeakPolarHBondContact O-CA 3.44Å; K705-V726 HydrophobicContact CB-CB 4.4Å; K705-V726 PolarHBondContact N-O 2.96Å; K705-V726 PolarHBondContact O-N 3.39Å; K705-M780 HydrophobicContact CD-CE 4.3Å
706	L	75.4	Confident	54.3	Low	10 Å²	10	86.7 Å²	86.7	5%	0.052	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.5	168.3	176.4	66.8	0	0	0	108.6	L356 A360 L708 F723 L725 M780 A781 I783	L356-L706 HydrophobicContact CD2-CD2 4.04Å; L356-L706 HydrophobicContact CG-CD2 4.21Å; A360-L706 HydrophobicContact CB-CD1 4.5Å; L706-L708 HydrophobicContact CD2-CD2 4.48Å; L706-L708 HydrophobicContact CG-CD2 4.35Å; L706-F723 HydrophobicContact CD1-CB 4.02Å; L706-F723 HydrophobicContact CD1-CD2 3.38Å; L706-F723 HydrophobicContact CD1-CE2 4.14Å; L706-F723 HydrophobicContact CD1-CG 3.98Å; L706-L725 HydrophobicContact CB-CD2 4.22Å; L706-L725 HydrophobicContact CD1-CD2 3.72Å; L706-M780 WeakPolarHBondContact O-CA 3.26Å; L706-A781 HydrophobicContact CB-CB 4.31Å; L706-A781 WeakPolarHBondContact CB-O 3.38Å; L706-A781 HydrophobicContact CD2-CB 4.33Å; L706-A781 PolarHBondContact N-O 2.67Å; L706-A781 PolarHBondContact O-N 3.04Å; L706-I783 HydrophobicContact CB-CD1 4.32Å
707	R	71.3	Confident	55.9	Low	88 Å²	88	83.7 Å²	83.7	33%	0.332	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.5	174.2	-69	178.7	175.8	-173.4	-10	109.3	F723 E724 M780	R707-F723 CarbonylContact O-C 3.49Å; R707-F723 WeakPolarHBondContact O-CA 3.35Å; R707-F723 WeakPolarHBondContact O-CB 3.38Å; R707-E724 HydrophobicContact CB-CB 4.2Å; R707-E724 WeakPolarHBondContact CD-OE2 3.5Å; R707-E724 PolarHBondContact N-O 2.98Å; R707-E724 IonicContact NH1-OE2 3.84Å; R707-E724 PolarHBondContact O-N 3.45Å; R707-M780 HydrophobicContact CG-CE 3.73Å
708	L	71.7	Confident	57.6	Low	55 Å²	55	80.2 Å²	80.2	29%	0.288	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.9	173.7	-52.3	-176	0	0	0	109	L356 L706 F721 F723 N779	L356-L708 HydrophobicContact CD2-CD2 3.52Å; L706-L708 HydrophobicContact CD2-CD2 4.48Å; L706-L708 HydrophobicContact CG-CD2 4.35Å; L708-F721 HydrophobicContact CD2-CE1 4.48Å; L708-F721 HydrophobicContact CD2-CZ 4.03Å; L708-F723 HydrophobicContact CD2-CB 4.36Å; L708-N779 HydrophobicContact CB-CB 4.47Å; L708-N779 PolarHBondContact N-O 3.49Å; L708-N779 VanDerWaalsContact N-O 3.12Å
709	C	65.6	Low	59.5	Low	53 Å²	53	79.3 Å²	79.3	36%	0.358	42%	0.424	S	S	.	.	S	Bend	trans	-84.4	-28.4	177	-65.3	0	0	0	0	111.7	R722	C709-R722 HydrophobicContact CB-CB 3.83Å; C709-R722 WeakPolarHBondContact CB-O 3.01Å; C709-R722 PolarHBondContact N-O 3.4Å
710	D	61.6	Low	61.2	Low	21 Å²	21	73.7 Å²	73.7	11%	0.112	41%	0.408	C	S	.	.			trans	-98.4	119.4	178.1	-58	-47.7	0	0	0	109.2	L712 R722	D710-L712 PolarHBondContact O-N 3.34Å; D710-R722 IonicContact OD1-CZ 2.81Å; D710-R722 IonicContact OD1-NE 2.74Å; D710-R722 IonicContact OD1-NH2 2.77Å; D710-R722 PolarHBondContact OD1-NH2 2.93Å; D710-R722 PolarHBondContact OD2-N 3.42Å; D710-R722 IonicContact OD2-NE 3.32Å
711	P	52.3	Low	62.7	Low	96 Å²	96	68.3 Å²	68.3	62%	0.623	38%	0.375	S	S	*	.			trans	-74.9	2.9	-178.3	28.1	-33.4	0	0	0	114
712	L	45.1	Very low	64.2	Low	114 Å²	114	67.3 Å²	67.3	60%	0.597	37%	0.368	S	S	*	.			trans	-110.3	110	-167.6	-72.8	153.2	0	0	0	112.6	D710	D710-L712 PolarHBondContact O-N 3.34Å
713	I	43.9	Very low	65.2	Low	122 Å²	122	64.7 Å²	64.7	63%	0.626	36%	0.355	S	S	*	.	S	Bend	trans	71.4	112.2	132	-55.3	163.8	0	0	0	117.1
714	N	46.5	Very low	66.1	Low	130 Å²	130	62.1 Å²	62.1	70%	0.695	34%	0.339	S	S	*	.			trans	66.7	128	163.7	-56.7	-15.6	0	0	0	114.9	S716	N714-S716 PolarHBondContact O-N 2.94Å
715	A	52.2	Low	66.5	Low	96 Å²	96	61.6 Å²	61.6	79%	0.793	34%	0.337	S	S	*	.	S	Bend	trans	-58.9	6.3	-177.1	0	0	0	0	0	116.2
716	S	60.2	Low	66.7	Low	69 Å²	69	57.1 Å²	57.1	48%	0.483	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-79.3	127.3	175	51.7	0	0	0	0	111.7	N714	N714-S716 PolarHBondContact O-N 2.94Å
717	V	64.9	Low	66.7	Low	7 Å²	7	60.2 Å²	60.2	4%	0.042	33%	0.33	C	S	.	.			trans	-78.5	124.5	179.2	-179.4	0	0	0	0	110.3	Y334 V354 L356 I359 F721 V736	Y334-V717 HydrophobicContact CD1-CG1 4.33Å; Y334-V717 HydrophobicContact CE1-CG1 4.13Å; Y334-V717 PolarHBondContact OH-O 2.85Å; Y334-V717 VanDerWaalsContact OH-O 3.09Å; V354-V717 VanDerWaalsContact O-CG2 3.3Å; V354-V717 WeakPolarHBondContact O-CG2 3.35Å; L356-V717 HydrophobicContact CB-CG2 3.8Å; L356-V717 HydrophobicContact CD1-CG2 4.34Å; I359-V717 HydrophobicContact CD1-CB 4.35Å; I359-V717 HydrophobicContact CD1-CG1 3.97Å; I359-V717 HydrophobicContact CD1-CG2 3.9Å; V717-F721 HydrophobicContact CG1-CB 4.45Å; V717-V736 HydrophobicContact CG1-CB 4.15Å; V717-V736 HydrophobicContact CG1-CG1 3.66Å; V717-V736 HydrophobicContact CG1-CG2 4.04Å
718	Y	68.5	Low	66.7	Low	90 Å²	90	60.7 Å²	60.7	35%	0.353	35%	0.347	S	S	.	.			trans	-115.4	170.8	178	58.9	-95.2	0	0	0	112.5	G720 F721	Y718-G720 PolarHBondContact O-N 2.91Å; Y718-F721 AromaticContact CD1-CD2 3.99Å; Y718-F721 HydrophobicContact CD1-CD2 3.99Å; Y718-F721 HydrophobicContact CD2-CB 4.28Å; Y718-F721 AromaticContact CE1-CD2 3.46Å; Y718-F721 HydrophobicContact CE1-CD2 3.46Å; Y718-F721 VanDerWaalsContact CE1-CD2 3.46Å; Y718-F721 HydrophobicContact CE1-CE2 4.08Å; Y718-F721 HydrophobicContact CE1-CG 4.44Å; Y718-F721 HydrophobicContact CE2-CB 4.27Å; Y718-F721 HydrophobicContact CE2-CD2 4.31Å; Y718-F721 HydrophobicContact CG-CB 4.4Å; Y718-F721 AromaticContact CZ-CD2 3.64Å; Y718-F721 VanDerWaalsContact O-CB 3.23Å; Y718-F721 WeakPolarHBondContact O-CB 3.38Å; Y718-F721 PolarHBondContact O-N 3.27Å
719	D	71.6	Confident	66.4	Low	95 Å²	95	64.5 Å²	64.5	51%	0.508	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	128.4	177.7	-168.5	27.2	0	0	0	111.9	F721 K737 Q738	D719-F721 VanDerWaalsContact C-N 3.34Å; D719-K737 WeakPolarHBondContact OD1-CA 3.4Å; D719-Q738 HydrophobicContact CB-CB 3.75Å; D719-Q738 PolarHBondContact OD1-N 3.37Å
720	G	70.5	Confident	66.7	Low	32 Å²	32	64.5 Å²	64.5	33%	0.33	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	3	-174.9	0	0	0	0	0	114.8	Y718 R722 V736	Y718-G720 PolarHBondContact O-N 2.91Å; G720-R722 WeakPolarHBondContact O-CG 3.49Å; G720-R722 PolarHBondContact O-N 3.49Å; G720-V736 CarbonylContact C-O 3.57Å; G720-V736 WeakPolarHBondContact CA-O 3.46Å; G720-V736 PolarHBondContact N-O 3.03Å
721	F	76.5	Confident	67.5	Low	13 Å²	13	68.4 Å²	68.4	6%	0.057	38%	0.376	C	S	.	.			trans	-60.1	132	179.8	-175.5	-102	0	0	0	112.2	L356 L708 V717 Y718 D719 F723 V736	L356-F721 HydrophobicContact CD1-CD1 4.22Å; L356-F721 HydrophobicContact CD1-CE1 3.59Å; L356-F721 HydrophobicContact CD2-CE1 3.73Å; L356-F721 HydrophobicContact CD2-CZ 3.9Å; L356-F721 HydrophobicContact CG-CE1 4.27Å; L708-F721 HydrophobicContact CD2-CE1 4.48Å; L708-F721 HydrophobicContact CD2-CZ 4.03Å; V717-F721 HydrophobicContact CG1-CB 4.45Å; Y718-F721 AromaticContact CD1-CD2 3.99Å; Y718-F721 HydrophobicContact CD1-CD2 3.99Å; Y718-F721 HydrophobicContact CD2-CB 4.28Å; Y718-F721 AromaticContact CE1-CD2 3.46Å; Y718-F721 HydrophobicContact CE1-CD2 3.46Å; Y718-F721 VanDerWaalsContact CE1-CD2 3.46Å; Y718-F721 HydrophobicContact CE1-CE2 4.08Å; Y718-F721 HydrophobicContact CE1-CG 4.44Å; Y718-F721 HydrophobicContact CE2-CB 4.27Å; Y718-F721 HydrophobicContact CE2-CD2 4.31Å; Y718-F721 HydrophobicContact CG-CB 4.4Å; Y718-F721 AromaticContact CZ-CD2 3.64Å; Y718-F721 VanDerWaalsContact O-CB 3.23Å; Y718-F721 WeakPolarHBondContact O-CB 3.38Å; Y718-F721 PolarHBondContact O-N 3.27Å; D719-F721 VanDerWaalsContact C-N 3.34Å; F721-F723 AromaticContact CD1-CD1 3.87Å; F721-F723 HydrophobicContact CD1-CD1 3.87Å; F721-F723 HydrophobicContact CE1-CB 4.18Å; F721-F723 AromaticContact CE1-CD1 3.84Å; F721-F723 HydrophobicContact CE1-CD1 3.84Å; F721-F723 HydrophobicContact CE1-CG 4.4Å; F721-V736 HydrophobicContact CB-CB 4.21Å; F721-V736 HydrophobicContact CB-CG2 4.37Å; F721-V736 HydrophobicContact CD1-CG2 4.31Å; F721-V736 PolarHBondContact N-O 2.8Å; F721-V736 PolarHBondContact O-N 3.29Å
722	R	79.7	Confident	69	Low	86 Å²	86	64 Å²	64	33%	0.325	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.9	-176.6	-64.9	170.6	-64	-175.3	-0.3	112.4	E628 C709 D710 G720 C734 V735	E628-R722 WeakPolarHBondContact OE1-CD 3.49Å; E628-R722 IonicContact OE2-CZ 3.95Å; E628-R722 IonicContact OE2-NE 2.65Å; E628-R722 IonicContact OE2-NH1 3.25Å; E628-R722 PolarHBondContact OE2-NH1 3.3Å; C709-R722 HydrophobicContact CB-CB 3.83Å; C709-R722 WeakPolarHBondContact CB-O 3.01Å; C709-R722 PolarHBondContact N-O 3.4Å; D710-R722 IonicContact OD1-CZ 2.81Å; D710-R722 IonicContact OD1-NE 2.74Å; D710-R722 IonicContact OD1-NH2 2.77Å; D710-R722 PolarHBondContact OD1-NH2 2.93Å; D710-R722 PolarHBondContact OD2-N 3.42Å; D710-R722 IonicContact OD2-NE 3.32Å; G720-R722 WeakPolarHBondContact O-CG 3.49Å; G720-R722 PolarHBondContact O-N 3.49Å; R722-C734 WeakPolarHBondContact CA-O 3.4Å; R722-V735 HydrophobicContact CG-CG1 4.39Å; R722-V735 HydrophobicContact CG-CG2 4.27Å
723	F	82.5	Confident	70.8	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.009	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	154.6	172.5	66	-86.6	0	0	0	111.8	L356 I359 A360 I363 L706 R707 L708 F721 L725 C734 V736	L356-F723 HydrophobicContact CD1-CD1 3.6Å; L356-F723 HydrophobicContact CD1-CD2 4.46Å; L356-F723 HydrophobicContact CD1-CE1 3.68Å; L356-F723 HydrophobicContact CD1-CG 4.01Å; L356-F723 HydrophobicContact CD1-CZ 4.15Å; I359-F723 HydrophobicContact CG2-CE1 4.17Å; I359-F723 HydrophobicContact CG2-CZ 3.8Å; A360-F723 HydrophobicContact CB-CE2 4.46Å; I363-F723 HydrophobicContact CD1-CE2 4.24Å; I363-F723 HydrophobicContact CD1-CZ 3.69Å; L706-F723 HydrophobicContact CD1-CB 4.02Å; L706-F723 HydrophobicContact CD1-CD2 3.38Å; L706-F723 HydrophobicContact CD1-CE2 4.14Å; L706-F723 HydrophobicContact CD1-CG 3.98Å; R707-F723 CarbonylContact O-C 3.49Å; R707-F723 WeakPolarHBondContact O-CA 3.35Å; R707-F723 WeakPolarHBondContact O-CB 3.38Å; L708-F723 HydrophobicContact CD2-CB 4.36Å; F721-F723 AromaticContact CD1-CD1 3.87Å; F721-F723 HydrophobicContact CD1-CD1 3.87Å; F721-F723 HydrophobicContact CE1-CB 4.18Å; F721-F723 AromaticContact CE1-CD1 3.84Å; F721-F723 HydrophobicContact CE1-CD1 3.84Å; F721-F723 HydrophobicContact CE1-CG 4.4Å; F723-L725 HydrophobicContact CD2-CG 4.19Å; F723-L725 HydrophobicContact CE2-CD1 4.06Å; F723-L725 HydrophobicContact CE2-CD2 4.44Å; F723-L725 HydrophobicContact CE2-CG 4.01Å; F723-C734 HydrophobicContact CD1-CB 3.95Å; F723-C734 HydrophobicContact CD2-CB 3.84Å; F723-C734 HydrophobicContact CE1-CB 3.6Å; F723-C734 HydrophobicContact CE2-CB 3.48Å; F723-C734 VanDerWaalsContact CE2-CB 3.48Å; F723-C734 VanDerWaalsContact CE2-SG 3.53Å; F723-C734 HydrophobicContact CG-CB 4.07Å; F723-C734 HydrophobicContact CZ-CB 3.34Å; F723-C734 PolarHBondContact N-O 3.41Å; F723-C734 WeakPolarHBondContact O-CA 3.49Å; F723-C734 WeakPolarHBondContact O-CB 3.31Å; F723-C734 PolarHBondContact O-N 2.8Å; F723-V736 HydrophobicContact CD1-CG2 4.31Å; F723-V736 HydrophobicContact CE1-CG2 3.74Å
724	E	81.1	Confident	72.7	Confident	7 Å²	7	55.2 Å²	55.2	3%	0.033	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.4	179.1	-174.6	-169.7	-165.2	0	0	109.7	R707 V726 R731 L732 F733	R707-E724 HydrophobicContact CB-CB 4.2Å; R707-E724 WeakPolarHBondContact CD-OE2 3.5Å; R707-E724 PolarHBondContact N-O 2.98Å; R707-E724 IonicContact NH1-OE2 3.84Å; R707-E724 PolarHBondContact O-N 3.45Å; E724-V726 HydrophobicContact CG-CG2 3.61Å; E724-R731 VanDerWaalsContact OE1-CD 3.3Å; E724-R731 WeakPolarHBondContact OE1-CD 3.35Å; E724-L732 CarbonylContact C-O 3.55Å; E724-L732 WeakPolarHBondContact CA-O 3.5Å; E724-F733 HydrophobicContact CB-CD1 4.38Å; E724-F733 HydrophobicContact CG-CD1 4.06Å; E724-F733 HydrophobicContact CG-CE1 4.01Å
725	L	82.4	Confident	74.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119	169.7	-64.5	166.6	0	0	0	108.7	A360 I363 V364 W704 K705 L706 F723 R731 L732 I783	A360-L725 HydrophobicContact CB-CD2 4.05Å; I363-L725 HydrophobicContact CB-CD1 4.3Å; I363-L725 HydrophobicContact CG2-CD1 3.92Å; V364-L725 HydrophobicContact CG2-CD1 3.87Å; W704-L725 HydrophobicContact CE3-CB 3.99Å; W704-L725 HydrophobicContact CZ3-CB 4.3Å; K705-L725 WeakPolarHBondContact O-CA 3.44Å; L706-L725 HydrophobicContact CB-CD2 4.22Å; L706-L725 HydrophobicContact CD1-CD2 3.72Å; F723-L725 HydrophobicContact CD2-CG 4.19Å; F723-L725 HydrophobicContact CE2-CD1 4.06Å; F723-L725 HydrophobicContact CE2-CD2 4.44Å; F723-L725 HydrophobicContact CE2-CG 4.01Å; L725-R731 WeakPolarHBondContact O-CA 3.38Å; L725-L732 HydrophobicContact CB-CB 4.22Å; L725-L732 PolarHBondContact N-O 2.68Å; L725-L732 PolarHBondContact O-N 3.39Å; L725-I783 HydrophobicContact CD2-CD1 4.32Å
726	V	77.2	Confident	75.8	Confident	14 Å²	14	46.5 Å²	46.5	9%	0.085	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.1	-174.2	-177	0	0	0	0	110.5	K705 E724 R731	K705-V726 HydrophobicContact CB-CB 4.4Å; K705-V726 PolarHBondContact N-O 2.96Å; K705-V726 PolarHBondContact O-N 3.39Å; E724-V726 HydrophobicContact CG-CG2 3.61Å; V726-R731 HydrophobicContact CG1-CG 4.18Å; V726-R731 HydrophobicContact CG2-CG 4.24Å
727	R	76.2	Confident	76.7	Confident	75 Å²	75	49.3 Å²	49.3	28%	0.283	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	123.5	168.7	174.9	179.8	175.7	-174.1	4.1	109.3	W704 D729 M730	W704-R727 HydrophobicContact CD2-CB 3.74Å; W704-R727 HydrophobicContact CE3-CB 3.67Å; W704-R727 HydrophobicContact CG-CB 4.32Å; W704-R727 HydrophobicContact CH2-CB 4.26Å; W704-R727 HydrophobicContact CZ2-CB 4.3Å; W704-R727 HydrophobicContact CZ3-CB 3.95Å; R727-D729 PolarHBondContact O-N 2.91Å; R727-M730 PolarHBondContact N-O 3.14Å; R727-M730 CarbonylContact O-C 3.48Å; R727-M730 WeakPolarHBondContact O-CA 3.26Å; R727-M730 WeakPolarHBondContact O-CB 3.48Å; R727-M730 PolarHBondContact O-N 3.37Å
728	S	69.7	Low	77.1	Confident	98 Å²	98	52.5 Å²	52.5	69%	0.685	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.6	-109.3	-177.8	55.9	0	0	0	0	112
729	D	66.9	Low	77.1	Confident	135 Å²	135	52.2 Å²	52.2	72%	0.722	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-13.8	-179.5	-61.2	-22.4	0	0	0	113.2	Q342 R727	Q342-D729 PolarHBondContact NE2-O 3.07Å; R727-D729 PolarHBondContact O-N 2.91Å
730	M	71.6	Confident	76.1	Confident	53 Å²	53	53.4 Å²	53.4	26%	0.261	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.6	-178.6	-60.2	-71.2	-69.8	0	0	110.5	R340 Q342 R727	R340-M730 VanDerWaalsContact CD-CE 3.43Å; R340-M730 HydrophobicContact CG-CE 4.41Å; Q342-M730 PolarHBondContact NE2-SD 3.4Å; Q342-M730 PolarHBondContact OE1-SD 3.45Å; R727-M730 PolarHBondContact N-O 3.14Å; R727-M730 CarbonylContact O-C 3.48Å; R727-M730 WeakPolarHBondContact O-CA 3.26Å; R727-M730 WeakPolarHBondContact O-CB 3.48Å; R727-M730 PolarHBondContact O-N 3.37Å
731	R	78.7	Confident	74.9	Confident	103 Å²	103	57.3 Å²	57.3	39%	0.389	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130.6	174.9	-62.1	175.5	-178.5	-162.1	7	109.7	R340 A341 E724 L725 V726	R340-R731 WeakPolarHBondContact CA-O 3.16Å; A341-R731 HydrophobicContact CB-CB 3.73Å; A341-R731 PolarHBondContact N-O 2.77Å; E724-R731 VanDerWaalsContact OE1-CD 3.3Å; E724-R731 WeakPolarHBondContact OE1-CD 3.35Å; L725-R731 WeakPolarHBondContact O-CA 3.38Å; V726-R731 HydrophobicContact CG1-CG 4.18Å; V726-R731 HydrophobicContact CG2-CG 4.24Å
732	L	83.1	Confident	73.1	Confident	4 Å²	4	64 Å²	64	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.2	175.6	-57.9	174.5	0	0	0	108.9	V338 V339 R340 I363 A367 F371 W704 E724 L725	V338-L732 HydrophobicContact CG1-CB 3.96Å; V338-L732 HydrophobicContact CG1-CD1 4.43Å; V338-L732 HydrophobicContact CG1-CD2 4.25Å; V338-L732 HydrophobicContact CG1-CG 4.45Å; V339-L732 CarbonylContact O-C 3.52Å; V339-L732 WeakPolarHBondContact O-CA 3.42Å; R340-L732 HydrophobicContact CB-CD2 3.85Å; R340-L732 HydrophobicContact CG-CD2 4.23Å; I363-L732 HydrophobicContact CG2-CD1 4.46Å; A367-L732 HydrophobicContact CB-CD1 3.98Å; F371-L732 HydrophobicContact CE1-CD2 4.23Å; F371-L732 HydrophobicContact CZ-CD2 4.37Å; W704-L732 HydrophobicContact CH2-CD1 4Å; W704-L732 HydrophobicContact CZ3-CD1 3.88Å; W704-L732 HydrophobicContact CZ3-CG 4.23Å; E724-L732 CarbonylContact C-O 3.55Å; E724-L732 WeakPolarHBondContact CA-O 3.5Å; L725-L732 HydrophobicContact CB-CB 4.22Å; L725-L732 PolarHBondContact N-O 2.68Å; L725-L732 PolarHBondContact O-N 3.39Å
733	F	82.8	Confident	70.9	Confident	48 Å²	48	69.1 Å²	69.1	21%	0.211	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.6	172.1	-62.6	-69.4	0	0	0	109.2	V338 V339 A341 E724	V338-F733 CarbonylContact C-O 3.52Å; V338-F733 VanDerWaalsContact CA-O 3.26Å; V338-F733 WeakPolarHBondContact CA-O 3.35Å; V339-F733 HydrophobicContact CB-CB 4.45Å; V339-F733 PolarHBondContact N-O 3.27Å; V339-F733 PolarHBondContact O-N 2.87Å; A341-F733 HydrophobicContact CB-CD2 4.17Å; A341-F733 HydrophobicContact CB-CE2 3.5Å; A341-F733 HydrophobicContact CB-CZ 4.31Å; E724-F733 HydrophobicContact CB-CD1 4.38Å; E724-F733 HydrophobicContact CG-CD1 4.06Å; E724-F733 HydrophobicContact CG-CE1 4.01Å
734	C	84.6	Confident	68.6	Low	2 Å²	2	76.6 Å²	76.6	1%	0.014	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.5	-176.6	-53.9	0	0	0	0	109.3	V336 H337 V338 R722 F723	V336-C734 HydrophobicContact CG1-CB 3.95Å; H337-C734 WeakPolarHBondContact O-CA 3.33Å; V338-C734 HydrophobicContact CG2-CB 4.36Å; R722-C734 WeakPolarHBondContact CA-O 3.4Å; F723-C734 HydrophobicContact CD1-CB 3.95Å; F723-C734 HydrophobicContact CD2-CB 3.84Å; F723-C734 HydrophobicContact CE1-CB 3.6Å; F723-C734 HydrophobicContact CE2-CB 3.48Å; F723-C734 VanDerWaalsContact CE2-CB 3.48Å; F723-C734 VanDerWaalsContact CE2-SG 3.53Å; F723-C734 HydrophobicContact CG-CB 4.07Å; F723-C734 HydrophobicContact CZ-CB 3.34Å; F723-C734 PolarHBondContact N-O 3.41Å; F723-C734 WeakPolarHBondContact O-CA 3.49Å; F723-C734 WeakPolarHBondContact O-CB 3.31Å; F723-C734 PolarHBondContact O-N 2.8Å
735	V	81.5	Confident	66.2	Low	44 Å²	44	83.3 Å²	83.3	27%	0.267	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.8	172.5	-175.2	0	0	0	0	108.2	V336 H337 R722	V336-V735 CarbonylContact C-O 3.51Å; V336-V735 WeakPolarHBondContact CA-O 3.4Å; H337-V735 PolarHBondContact N-O 3.25Å; H337-V735 PolarHBondContact O-N 3.32Å; R722-V735 HydrophobicContact CG-CG1 4.39Å; R722-V735 HydrophobicContact CG-CG2 4.27Å
736	V	82.2	Confident	63.7	Low	0 Å²	0	93 Å²	93	0%	0	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.3	176.9	-174	0	0	0	0	109.2	Y334 V336 V717 G720 F721 F723	Y334-V736 HydrophobicContact CD1-CG1 3.63Å; Y334-V736 HydrophobicContact CG-CG1 4.03Å; V336-V736 HydrophobicContact CG1-CG2 4.22Å; V336-V736 HydrophobicContact CG2-CB 4.41Å; V336-V736 HydrophobicContact CG2-CG1 4.2Å; V336-V736 HydrophobicContact CG2-CG2 3.97Å; V717-V736 HydrophobicContact CG1-CB 4.15Å; V717-V736 HydrophobicContact CG1-CG1 3.66Å; V717-V736 HydrophobicContact CG1-CG2 4.04Å; G720-V736 CarbonylContact C-O 3.57Å; G720-V736 WeakPolarHBondContact CA-O 3.46Å; G720-V736 PolarHBondContact N-O 3.03Å; F721-V736 HydrophobicContact CB-CB 4.21Å; F721-V736 HydrophobicContact CB-CG2 4.37Å; F721-V736 HydrophobicContact CD1-CG2 4.31Å; F721-V736 PolarHBondContact N-O 2.8Å; F721-V736 PolarHBondContact O-N 3.29Å; F723-V736 HydrophobicContact CD1-CG2 4.31Å; F723-V736 HydrophobicContact CE1-CG2 3.74Å
737	K	78.5	Confident	61.5	Low	127 Å²	127	95.8 Å²	95.8	55%	0.552	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.9	165.5	-69.5	-169.8	175	-171	0	109.9	Y334 N335 D719	Y334-K737 CarbonylContact C-O 3.55Å; Y334-K737 WeakPolarHBondContact CA-O 3.27Å; N335-K737 PolarHBondContact N-O 3.16Å; N335-K737 PolarHBondContact O-N 3.35Å; D719-K737 WeakPolarHBondContact OD1-CA 3.4Å
738	Q	74.1	Confident	59.3	Low	74 Å²	74	100 Å²	100	35%	0.346	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138	175.1	-170.6	175.9	-20.2	0	0	109.8	Y334 D719 S740	Y334-Q738 HydrophobicContact CD1-CB 3.84Å; Y334-Q738 HydrophobicContact CD1-CG 3.93Å; Y334-Q738 HydrophobicContact CE1-CB 3.89Å; Y334-Q738 HydrophobicContact CE1-CG 3.69Å; D719-Q738 HydrophobicContact CB-CB 3.75Å; D719-Q738 PolarHBondContact OD1-N 3.37Å; Q738-S740 PolarHBondContact O-N 3.38Å
739	F	67.1	Low	57.7	Low	85 Å²	85	99.8 Å²	99.8	37%	0.373	51%	0.513	S	S	.	.			trans	-77.5	122.4	166.6	-67.9	-72.2	0	0	0	109.1	C332 K333 N335 M741	C332-F739 WeakPolarHBondContact O-CD2 3.21Å; K333-F739 PolarHBondContact O-N 3.05Å; N335-F739 HydrophobicContact CB-CE2 3.83Å; N335-F739 HydrophobicContact CB-CZ 3.83Å; F739-M741 PolarHBondContact O-N 3.31Å; F739-M741 VanDerWaalsContact O-N 3.16Å
740	S	50.4	Low	55.8	Low	120 Å²	120	97 Å²	97	84%	0.839	50%	0.502	S	S	*	.			trans	-73.3	98.1	162.9	59.9	0	0	0	0	107.8	Q738	Q738-S740 PolarHBondContact O-N 3.38Å
741	M	45.4	Very low	54.1	Low	113 Å²	113	101.7 Å²	101.7	56%	0.557	53%	0.527	S	S	*	.			trans	-117.8	150.2	167.7	-79.4	-68.2	-87.3	0	0	109.8	W329 F739 Q743	W329-M741 HydrophobicContact CH2-CE 3.53Å; W329-M741 HydrophobicContact CH2-SD 4.44Å; W329-M741 HydrophobicContact CZ3-CE 3.82Å; F739-M741 PolarHBondContact O-N 3.31Å; F739-M741 VanDerWaalsContact O-N 3.16Å; M741-Q743 PolarHBondContact O-N 3.3Å
742	L	40	Very low	52	Low	154 Å²	154	107 Å²	107	81%	0.806	55%	0.547	S	S	*	.			trans	-37.5	124	170.5	-69.4	160.5	0	0	0	108.8	L744	L742-L744 PolarHBondContact O-N 3.45Å
743	Q	32.4	Very low	49.4	Very low	194 Å²	194	112 Å²	112	91%	0.907	57%	0.566	S	S	*	*			trans	-60.1	81.6	174.5	-74.5	174.5	-16.3	0	0	108.7	M741 I745	M741-Q743 PolarHBondContact O-N 3.3Å; Q743-I745 PolarHBondContact O-N 2.96Å; Q743-I745 VanDerWaalsContact O-N 3.07Å
744	L	35.9	Very low	46.9	Very low	159 Å²	159	112.1 Å²	112.1	83%	0.832	57%	0.572	S	S	*	*			trans	-74	108.3	171.1	-136.9	116.6	0	0	0	105.4	L742	L742-L744 PolarHBondContact O-N 3.45Å
745	I	30.7	Very low	44.1	Very low	148 Å²	148	113.5 Å²	113.5	76%	0.759	59%	0.587	S	S	*	*			trans	-35.8	137.8	178.3	-65.6	159.1	0	0	0	109.7	Q743 A747	Q743-I745 PolarHBondContact O-N 2.96Å; Q743-I745 VanDerWaalsContact O-N 3.07Å; I745-A747 PolarHBondContact O-N 2.83Å
746	K	28.5	Very low	41.6	Very low	204 Å²	204	115.2 Å²	115.2	89%	0.887	59%	0.594	S	S	*	*			trans	-54.7	79.6	167.1	-72.6	177.2	177.2	176.5	0	109.1	N748	K746-N748 PolarHBondContact O-N 2.96Å
747	A	32.1	Very low	38.8	Very low	72 Å²	72	119.8 Å²	119.8	60%	0.595	62%	0.622	S	S	*	*			trans	-78.6	116.6	170.7	0	0	0	0	0	105.7	I745 V749	I745-A747 PolarHBondContact O-N 2.83Å; A747-V749 VanDerWaalsContact C-N 3.25Å; A747-V749 PolarHBondContact O-N 3.23Å
748	N	30.2	Very low	36.6	Very low	164 Å²	164	122 Å²	122	88%	0.877	63%	0.628	S	S	*	*			trans	-58.7	91	169.1	-78	-19.4	0	0	0	108.2	K746	K746-N748 PolarHBondContact O-N 2.96Å
749	V	34.4	Very low	34.2	Very low	92 Å²	92	125.3 Å²	125.3	56%	0.558	64%	0.644	S	S	*	*			trans	-71.4	133.7	170.7	-170.6	0	0	0	0	107.3	A747 W753	A747-V749 VanDerWaalsContact C-N 3.25Å; A747-V749 PolarHBondContact O-N 3.23Å; V749-W753 HydrophobicContact CG1-CB 3.72Å; V749-W753 HydrophobicContact CG1-CG 4.33Å
750	P	28.1	Very low	32.2	Very low	76 Å²	76	132.1 Å²	132.1	49%	0.494	67%	0.667	S	S	.	*			trans	-51.7	145.6	-177	-28.3	34.2	0	0	0	114	W752 W753	P750-W752 PolarHBondContact O-N 3.4Å; P750-W753 PolarHBondContact O-N 2.97Å
751	I	35.3	Very low	31	Very low	153 Å²	153	130 Å²	130	79%	0.785	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-52.9	-31.4	-168.3	-65.3	150.4	0	0	0	114.1	W753 S754	I751-W753 VanDerWaalsContact C-N 3.3Å; I751-W753 PolarHBondContact O-N 3.03Å; I751-S754 WeakPolarHBondContact O-CB 3.47Å; I751-S754 PolarHBondContact O-N 3.29Å; I751-S754 VanDerWaalsContact O-N 3.11Å; I751-S754 PolarHBondContact O-OG 3.47Å
752	W	34.7	Very low	30	Very low	215 Å²	215	131.2 Å²	131.2	81%	0.814	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-72.5	-16.4	177.1	61	-60.9	0	0	0	114.7	P750	P750-W752 PolarHBondContact O-N 3.4Å
753	W	28.3	Very low	29.3	Very low	108 Å²	108	129.7 Å²	129.7	41%	0.409	65%	0.652	S	S	.	*	G	3₁₀ helix	trans	-94.7	-7.8	168.2	-80.8	69.5	0	0	0	113.1	F323 L327 V749 P750 I751 G755	F323-W753 HydrophobicContact CD1-CZ3 4.22Å; F323-W753 HydrophobicContact CE1-CH2 4.32Å; F323-W753 AromaticContact CE1-CZ3 3.86Å; F323-W753 HydrophobicContact CE1-CZ3 3.86Å; L327-W753 HydrophobicContact CD1-CZ3 4.26Å; V749-W753 HydrophobicContact CG1-CB 3.72Å; V749-W753 HydrophobicContact CG1-CG 4.33Å; P750-W753 PolarHBondContact O-N 2.97Å; I751-W753 VanDerWaalsContact C-N 3.3Å; I751-W753 PolarHBondContact O-N 3.03Å; W753-G755 PolarHBondContact O-N 3.32Å
754	S	29.9	Very low	28.9	Very low	50 Å²	50	128 Å²	128	35%	0.35	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-78.4	3.6	-179.7	74.6	0	0	0	0	114.8	I751 I756 T757	I751-S754 WeakPolarHBondContact O-CB 3.47Å; I751-S754 PolarHBondContact O-N 3.29Å; I751-S754 VanDerWaalsContact O-N 3.11Å; I751-S754 PolarHBondContact O-OG 3.47Å; S754-I756 PolarHBondContact O-N 3.06Å; S754-T757 PolarHBondContact O-N 3.25Å; S754-T757 PolarHBondContact O-OG1 3.14Å
755	G	26.3	Very low	28.4	Very low	32 Å²	32	126.5 Å²	126.5	33%	0.33	64%	0.64	S	S	.	*	G	3₁₀ helix	trans	-66.7	2	169	0	0	0	0	0	115.1	W753	W753-G755 PolarHBondContact O-N 3.32Å
756	I	28.6	Very low	28.1	Very low	80 Å²	80	123.2 Å²	123.2	41%	0.41	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-95.8	-10	170.1	-61	169.8	0	0	0	111.9	L327 S754 Y758	L327-I756 HydrophobicContact CD1-CD1 4.28Å; S754-I756 PolarHBondContact O-N 3.06Å; I756-Y758 PolarHBondContact O-N 3.35Å
757	T	24.5	Very low	28.5	Very low	96 Å²	96	120.4 Å²	120.4	59%	0.589	63%	0.631	S	S	*	*	S	Bend	trans	-61.6	130.2	153.9	64.4	0	0	0	0	105.7	S754 E759	S754-T757 PolarHBondContact O-N 3.25Å; S754-T757 PolarHBondContact O-OG1 3.14Å; T757-E759 PolarHBondContact O-N 2.96Å; T757-E759 VanDerWaalsContact C-N 3.25Å
758	Y	31.9	Very low	28.5	Very low	173 Å²	173	121.4 Å²	121.4	68%	0.678	63%	0.633	S	S	*	*			trans	-44.8	99	174.5	-75.6	-90.5	0	0	0	107.6	I756 R760	I756-Y758 PolarHBondContact O-N 3.35Å; Y758-R760 PolarHBondContact O-N 3.42Å
759	E	24.4	Very low	28.7	Very low	144 Å²	144	117.7 Å²	117.7	67%	0.673	62%	0.617	S	S	*	*			trans	-59.7	118.8	-178	-96.4	-167.9	164.2	0	0	103.8	T757 S761	T757-E759 PolarHBondContact O-N 2.96Å; T757-E759 VanDerWaalsContact C-N 3.25Å; E759-S761 PolarHBondContact O-N 3.14Å
760	R	23.7	Very low	28.5	Very low	227 Å²	227	119.1 Å²	119.1	86%	0.857	63%	0.626	S	S	*	*			trans	-49.6	79.7	150	177	179.9	-92.6	-172.8	-9.6	105.2	Y758 N762	Y758-R760 PolarHBondContact O-N 3.42Å; R760-N762 PolarHBondContact O-N 3.33Å
761	S	25.4	Very low	28.5	Very low	76 Å²	76	122.2 Å²	122.2	53%	0.531	63%	0.633	S	S	.	*			trans	-61.5	109.5	173.9	55	0	0	0	0	104.3	E759 I763	E759-S761 PolarHBondContact O-N 3.14Å; S761-I763 PolarHBondContact O-N 3.09Å
762	N	23.7	Very low	28.5	Very low	138 Å²	138	117.4 Å²	117.4	74%	0.738	61%	0.611	S	S	*	*			trans	-61.9	44.4	165.1	-77.3	-20.8	0	0	0	111.1	R760 I764	R760-N762 PolarHBondContact O-N 3.33Å; N762-I764 PolarHBondContact O-N 2.96Å
763	I	26.8	Very low	28.3	Very low	122 Å²	122	110.1 Å²	110.1	63%	0.626	59%	0.593	S	S	*	*			trans	-65.1	100.6	143.6	-59.1	175.4	0	0	0	102.4	S761 L765	S761-I763 PolarHBondContact O-N 3.09Å; I763-L765 HydrophobicContact CB-CD1 4.38Å; I763-L765 HydrophobicContact CG2-CD1 3.83Å; I763-L765 HydrophobicContact CG2-CG 4.39Å; I763-L765 PolarHBondContact O-N 3.18Å
764	I	23.2	Very low	28.4	Very low	159 Å²	159	112 Å²	112	82%	0.815	61%	0.609	S	S	*	*			trans	-55.8	79.3	172.1	-63	158.3	0	0	0	106.4	N762	N762-I764 PolarHBondContact O-N 2.96Å
765	L	26.2	Very low	28.3	Very low	128 Å²	128	111.4 Å²	111.4	67%	0.67	61%	0.611	S	S	*	*			trans	-85.2	124.5	157.2	-87.7	129.5	0	0	0	104.3	I763	I763-L765 HydrophobicContact CB-CD1 4.38Å; I763-L765 HydrophobicContact CG2-CD1 3.83Å; I763-L765 HydrophobicContact CG2-CG 4.39Å; I763-L765 PolarHBondContact O-N 3.18Å
766	P	23.6	Very low	28.9	Very low	79 Å²	79	116.4 Å²	116.4	51%	0.513	64%	0.641	S	S	.	*			trans	-56.2	145.5	-171.8	22.1	-32	0	0	0	110.2	S768	P766-S768 PolarHBondContact O-N 3.41Å
767	P	36	Very low	29.5	Very low	145 Å²	145	115.1 Å²	115.1	94%	0.942	64%	0.639	S	S	*	*	S	Bend	trans	-70.9	29.8	-166.2	28.6	-34.7	0	0	0	115.4
768	S	34	Very low	30.6	Very low	92 Å²	92	119.8 Å²	119.8	64%	0.643	65%	0.654	S	S	*	*			trans	-132.4	75	-178.8	63.6	0	0	0	0	111.7	P766	P766-S768 PolarHBondContact O-N 3.41Å
769	T	32.9	Very low	31.6	Very low	86 Å²	86	114.7 Å²	114.7	53%	0.528	64%	0.639	S	S	.	*			trans	-163.6	38.9	158.2	-0.9	0	0	0	0	115.2	F701	F701-T769 HydrophobicContact CE1-CG2 3.68Å; F701-T769 HydrophobicContact CZ-CG2 4.11Å
770	V	30.7	Very low	32.9	Very low	123 Å²	123	110.8 Å²	110.8	75%	0.745	62%	0.621	S	S	*	*			trans	-136.5	76.8	161.1	-172.2	0	0	0	0	108.5	T772	V770-T772 HydrophobicContact CG1-CG2 4.29Å; V770-T772 PolarHBondContact O-N 3.46Å
771	E	28	Very low	34.5	Very low	140 Å²	140	101.5 Å²	101.5	65%	0.654	59%	0.593	S	S	*	*			trans	-84.7	100.4	164.4	-70.1	-179.4	177.2	0	0	107.8	C773	E771-C773 VanDerWaalsContact C-N 3.33Å; E771-C773 VanDerWaalsContact O-N 3.15Å; E771-C773 PolarHBondContact O-N 3.08Å
772	T	35.2	Very low	36	Very low	52 Å²	52	100.7 Å²	100.7	32%	0.319	58%	0.581	S	S	.	*			trans	-77.1	90.8	161.6	53.6	0	0	0	0	107.7	K357 V770 I774	K357-T772 HydrophobicContact CD-CG2 4.37Å; K357-T772 PolarHBondContact NZ-OG1 3.48Å; V770-T772 HydrophobicContact CG1-CG2 4.29Å; V770-T772 PolarHBondContact O-N 3.46Å; T772-I774 PolarHBondContact O-N 3.43Å
773	C	31.5	Very low	37.6	Very low	63 Å²	63	95.2 Å²	95.2	43%	0.426	55%	0.551	S	S	.	*			trans	-71.6	112.2	167	-61.5	0	0	0	0	107.9	E771 G775	E771-C773 VanDerWaalsContact C-N 3.33Å; E771-C773 VanDerWaalsContact O-N 3.15Å; E771-C773 PolarHBondContact O-N 3.08Å; C773-G775 PolarHBondContact O-N 3.05Å
774	I	29.8	Very low	38.8	Very low	146 Å²	146	93.6 Å²	93.6	75%	0.749	54%	0.54	S	S	*	.			trans	-72	88.7	166.8	-59	170.6	0	0	0	105.5	T772 S776	T772-I774 PolarHBondContact O-N 3.43Å; I774-S776 PolarHBondContact O-N 2.97Å
775	G	28.3	Very low	40.2	Very low	39 Å²	39	89.9 Å²	89.9	40%	0.402	52%	0.521	S	S	.	.			trans	-76.9	103.6	179.1	0	0	0	0	0	110.3	C773 S777	C773-G775 PolarHBondContact O-N 3.05Å; G775-S777 PolarHBondContact O-N 3.35Å
776	S	38	Very low	40.9	Very low	137 Å²	137	88 Å²	88	96%	0.958	51%	0.514	S	S	*	.	S	Bend	trans	28.9	9.9	153.7	62.7	0	0	0	0	122.6	I774	I774-S776 PolarHBondContact O-N 2.97Å
777	S	40.9	Very low	41.8	Very low	52 Å²	52	88.5 Å²	88.5	36%	0.364	51%	0.514	S	S	.	.	S	Bend	trans	-133.9	123.9	167.1	64.6	0	0	0	0	106.7	G775 N779 M780	G775-S777 PolarHBondContact O-N 3.35Å; S777-N779 PolarHBondContact O-N 3.24Å; S777-M780 PolarHBondContact O-N 3.32Å; S777-M780 VanDerWaalsContact O-N 3.1Å; S777-M780 WeakPolarHBondContact OG-CB 3.44Å; S777-M780 VanDerWaalsContact OG-CG 3.28Å; S777-M780 WeakPolarHBondContact OG-CG 3.41Å
778	E	48.5	Very low	42.1	Very low	194 Å²	194	85.3 Å²	85.3	91%	0.907	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-12.3	-167.1	-63.4	174.2	161.7	0	0	114.5
779	N	51.6	Low	42.6	Very low	67 Å²	67	84.9 Å²	84.9	36%	0.358	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	10.3	-174.6	-61.2	-26.6	0	0	0	115	L708 S777	L708-N779 HydrophobicContact CB-CB 4.47Å; L708-N779 PolarHBondContact N-O 3.49Å; L708-N779 VanDerWaalsContact N-O 3.12Å; S777-N779 PolarHBondContact O-N 3.24Å
780	M	52	Low	43.2	Very low	62 Å²	62	84.9 Å²	84.9	31%	0.305	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.2	-178.9	-58.6	-169	88.2	0	0	112.8	K705 L706 R707 S777	K705-M780 HydrophobicContact CD-CE 4.3Å; L706-M780 WeakPolarHBondContact O-CA 3.26Å; R707-M780 HydrophobicContact CG-CE 3.73Å; S777-M780 PolarHBondContact O-N 3.32Å; S777-M780 VanDerWaalsContact O-N 3.1Å; S777-M780 WeakPolarHBondContact OG-CB 3.44Å; S777-M780 VanDerWaalsContact OG-CG 3.28Å; S777-M780 WeakPolarHBondContact OG-CG 3.41Å
781	A	58.1	Low	44	Very low	31 Å²	31	82.3 Å²	82.3	26%	0.256	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143	169.6	0	0	0	0	0	110.4	L706	L706-A781 HydrophobicContact CB-CB 4.31Å; L706-A781 WeakPolarHBondContact CB-O 3.38Å; L706-A781 HydrophobicContact CD2-CB 4.33Å; L706-A781 PolarHBondContact N-O 2.67Å; L706-A781 PolarHBondContact O-N 3.04Å
782	E	57.1	Low	45.1	Very low	59 Å²	59	78.2 Å²	78.2	28%	0.276	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.2	174.4	-164.1	175.3	-174.1	0	0	110.4	T703 K784	T703-E782 WeakPolarHBondContact CB-OE1 3.48Å; E782-K784 HydrophobicContact CG-CG 4.42Å
783	I	57	Low	45.9	Very low	24 Å²	24	80.2 Å²	80.2	12%	0.123	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	113.4	173.2	-57.3	174.4	0	0	0	106.8	A360 T703 W704 L706 L725 L785	A360-I783 HydrophobicContact CB-CD1 3.57Å; T703-I783 WeakPolarHBondContact CA-O 3.33Å; W704-I783 HydrophobicContact CB-CB 4.47Å; W704-I783 PolarHBondContact N-O 3.3Å; W704-I783 PolarHBondContact O-N 3.49Å; L706-I783 HydrophobicContact CB-CD1 4.32Å; L725-I783 HydrophobicContact CD2-CD1 4.32Å; I783-L785 HydrophobicContact CG2-CG 4.29Å
784	K	52.2	Low	47.1	Very low	87 Å²	87	81.7 Å²	81.7	38%	0.378	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.4	172.1	-56.9	-173	177.6	168.5	0	108.6	T703 E782	T703-K784 HydrophobicContact CG2-CB 4.48Å; T703-K784 HydrophobicContact CG2-CD 4.4Å; T703-K784 HydrophobicContact CG2-CG 3.87Å; E782-K784 HydrophobicContact CG-CG 4.42Å
785	L	51.5	Low	48.7	Very low	82 Å²	82	75.8 Å²	75.8	43%	0.429	43%	0.432	S	S	.	.			trans	-113.3	0	176.5	-71.7	174.2	0	0	0	111.4	V364 F701 Q702 I783	V364-L785 HydrophobicContact CB-CD1 4.01Å; V364-L785 HydrophobicContact CG1-CD1 3.31Å; F701-L785 CarbonylContact C-O 3.58Å; F701-L785 VanDerWaalsContact CA-O 3.31Å; F701-L785 WeakPolarHBondContact CA-O 3.35Å; Q702-L785 PolarHBondContact N-O 3.41Å; Q702-L785 PolarHBondContact O-N 3.49Å; I783-L785 HydrophobicContact CG2-CG 4.29Å

Retrieved 785 of 785 residues in 186.8 ms (Link to these results)

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