A0A087Y0P1_POEFO Loading...

DNA primase large subunit

Regulatory subunit of the DNA primase complex and component of the DNA polymerase alpha complex (also known as the alpha DNA polymerase-primase complex) which play an essential role in the initiation of DNA synthesis. The primase subunit of the polymerase alpha complex initiates DNA synthesis by oligomerising short RNA primers on both leading and lagging strands.

AlphaFold DB , UniProt , Accession A0A087Y0P1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 532 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	32.9	Very low	244 Å²	244	169.9 Å²	169.9	100%	1.202	87%	0.872	S	S	*	*				0	101.5	0	-81.4	175	172.3	0	0	107.9
2	T	33.5	Very low	32.4	Very low	132 Å²	132	175.2 Å²	175.2	81%	0.81	87%	0.872	S	S	*	*			trans	-144.1	120	-171.5	37.4	0	0	0	0	107.3
3	Y	30	Very low	31.9	Very low	228 Å²	228	169.3 Å²	169.3	89%	0.894	86%	0.858	S	S	*	*			trans	-133	151.7	163.7	-95.6	-92.5	0	0	0	108.7
4	P	39	Very low	31.5	Very low	113 Å²	113	169.8 Å²	169.8	73%	0.734	86%	0.856	S	S	*	*				-120.5	165.1	-129.7	24.6	-3.9	0	0	0	114.5
5	R	36.2	Very low	31	Very low	239 Å²	239	172.7 Å²	172.7	90%	0.902	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-69.1	144.7	167.7	-70.9	-179.6	178.1	-170.6	-0.7	111.5
6	P	33.6	Very low	30.6	Very low	131 Å²	131	177.6 Å²	177.6	85%	0.851	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-82.7	136.1	164.2	5.4	11.9	0	0	0	111.3
7	R	30.4	Very low	30.6	Very low	241 Å²	241	180.1 Å²	180.1	91%	0.909	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-77.5	143.6	175.9	-74.4	175.9	171.9	178.4	-3.1	111.7
8	S	30.5	Very low	30.3	Very low	116 Å²	116	179.9 Å²	179.9	81%	0.811	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-67.7	138.3	157.3	50.1	0	0	0	0	111.8
9	V	29	Very low	30.3	Very low	136 Å²	136	177.7 Å²	177.7	82%	0.824	86%	0.855	S	S	*	*			trans	-137.9	136.8	157.6	179.6	0	0	0	0	108.6
10	P	37.8	Very low	30.1	Very low	110 Å²	110	174.8 Å²	174.8	71%	0.714	85%	0.848	S	S	*	*			trans	-97.2	167.9	-169	39.2	-33.1	0	0	0	112.3
11	L	25.6	Very low	30.1	Very low	179 Å²	179	172.4 Å²	172.4	94%	0.937	84%	0.844	S	S	*	*			trans	-159.5	117.7	150.8	-102.7	150.8	0	0	0	110.7
12	R	26.2	Very low	29.5	Very low	233 Å²	233	168.8 Å²	168.8	88%	0.879	83%	0.829	S	S	*	*			trans	-92.7	142.3	168.4	-100.3	-175.2	174.3	-147.9	0.5	109.7
13	S	26.6	Very low	29	Very low	99 Å²	99	173.3 Å²	173.3	69%	0.692	83%	0.831	S	S	*	*			trans	60.8	122.7	144.1	66.4	0	0	0	0	120.9
14	Q	26.2	Very low	28.8	Very low	176 Å²	176	170.5 Å²	170.5	82%	0.822	83%	0.831	S	S	*	*				-178.7	125.5	97.9	-95.6	-177.6	-15.9	0	0	112.6
15	W	23.7	Very low	28.3	Very low	214 Å²	214	170.6 Å²	170.6	81%	0.811	83%	0.831	S	S	*	*			trans	28.9	122.9	140.9	-63.5	80.6	0	0	0	121.5
16	R	24	Very low	27.9	Very low	251 Å²	251	165.2 Å²	165.2	95%	0.947	83%	0.829	S	S	*	*				-163.3	131.8	121.6	-107.5	170	-154.5	-108.1	2.9	112
17	R	30.6	Very low	27.6	Very low	220 Å²	220	167.4 Å²	167.4	83%	0.83	83%	0.833	S	S	*	*			trans	-61.4	137.8	164.5	-67.8	174.9	178.1	-169.4	-1.4	109.1
18	Q	25.7	Very low	27.4	Very low	176 Å²	176	159.3 Å²	159.3	82%	0.822	82%	0.824	S	S	*	*			trans	-154.5	109.5	147.6	-110.4	165.3	13.6	0	0	109.9
19	T	30.5	Very low	27.4	Very low	138 Å²	138	160.6 Å²	160.6	85%	0.847	83%	0.827	S	S	*	*			trans	-48	126.4	153.9	19.5	0	0	0	0	109.7
20	T	26.1	Very low	27.3	Very low	119 Å²	119	163 Å²	163	73%	0.73	83%	0.832	S	S	*	*			trans	-144.5	108.4	160	-42.6	0	0	0	0	110.2
21	V	29.3	Very low	26.9	Very low	125 Å²	125	167 Å²	167	76%	0.758	84%	0.841	S	S	*	*			trans	-54	124.6	163.8	174.3	0	0	0	0	108.8
22	L	24.6	Very low	27.1	Very low	169 Å²	169	169 Å²	169	89%	0.885	84%	0.843	S	S	*	*			trans	-110.9	108.9	166.8	-95.6	158	0	0	0	109.9
23	R	24.5	Very low	27.2	Very low	227 Å²	227	162.6 Å²	162.6	86%	0.857	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-55.4	134.6	178.7	-74	167.4	170.9	-164.7	-3.2	112.6
24	L	23.8	Very low	27.9	Very low	169 Å²	169	163.6 Å²	163.6	89%	0.885	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-65.1	142.9	156.3	-75.1	145.5	0	0	0	110.6
25	P	29.8	Very low	28.2	Very low	114 Å²	114	164.4 Å²	164.4	74%	0.74	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-93.2	123.6	157.9	10.4	8.2	0	0	0	111.4
26	C	26.8	Very low	28.8	Very low	126 Å²	126	163.2 Å²	163.2	85%	0.851	84%	0.841	S	S	*	*			trans	59.5	100.6	140.5	-64.1	0	0	0	0	120.1	G28	C26-G28 PolarHBondContact O-N 3.16Å
27	L	27.7	Very low	29.5	Very low	178 Å²	178	156.6 Å²	156.6	93%	0.932	83%	0.831	S	S	*	*			trans	-54.3	117.2	149.6	-77.6	145.6	0	0	0	111.2
28	G	25.8	Very low	29.8	Very low	71 Å²	71	156.2 Å²	156.2	73%	0.732	83%	0.829	S	S	*	*			trans	-102.1	112.7	152.2	0	0	0	0	0	108.3	C26 M30	C26-G28 PolarHBondContact O-N 3.16Å; G28-M30 PolarHBondContact O-N 3.42Å
29	T	31.6	Very low	30.5	Very low	142 Å²	142	151.3 Å²	151.3	87%	0.871	82%	0.819	S	S	*	*			trans	-57	115.6	171.4	38.2	0	0	0	0	110.6
30	M	27.5	Very low	31.3	Very low	188 Å²	188	149.3 Å²	149.3	93%	0.926	81%	0.806	S	S	*	*			trans	-122.1	124.5	163	-99.6	-172.1	158.7	0	0	110	G28	G28-M30 PolarHBondContact O-N 3.42Å
31	Q	27.6	Very low	32.4	Very low	192 Å²	192	147.9 Å²	147.9	90%	0.897	80%	0.798	S	S	*	*			trans	-53.2	139.9	-178.6	-69.9	162.2	-28.6	0	0	111.8	S33	Q31-S33 PolarHBondContact O-N 3.42Å
32	F	30.3	Very low	33.5	Very low	223 Å²	223	147.6 Å²	147.6	98%	0.978	79%	0.792	S	S	*	*			trans	-59.8	104.4	167.5	-82.2	-92	0	0	0	109.8
33	S	28.5	Very low	35.3	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	78%	0.779	S	S	*	*			trans	-105.1	111.3	159.7	-166.5	0	0	0	0	108.2	Q31 K35	Q31-S33 PolarHBondContact O-N 3.42Å; S33-K35 PolarHBondContact O-N 2.96Å
34	S	41.6	Very low	37	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	75%	0.752	S	S	*	*			trans	-58.5	103.6	175.8	61.3	0	0	0	0	110.6
35	K	32.4	Very low	38.8	Very low	194 Å²	194	132.2 Å²	132.2	84%	0.843	73%	0.732	S	S	*	*			trans	-108	122.1	165.9	-75.3	-173.9	178.4	179.1	0	109.8	S33	S33-K35 PolarHBondContact O-N 2.96Å
36	K	36.5	Very low	40.6	Very low	188 Å²	188	133.2 Å²	133.2	82%	0.817	73%	0.727	S	S	*	*			trans	-51.5	157	177.7	-74	176	176	178.3	0	113.1	R38	K36-R38 VanDerWaalsContact C-N 3.27Å; K36-R38 PolarHBondContact O-N 2.92Å
37	P	38.6	Very low	42.7	Very low	112 Å²	112	129.7 Å²	129.7	73%	0.727	70%	0.7	S	S	*	*	S	Bend	trans	-80.6	54.9	-171.4	36.1	-37.7	0	0	0	113.6
38	R	36.2	Very low	45.2	Very low	212 Å²	212	121.6 Å²	121.6	80%	0.8	66%	0.657	S	S	*	*	H	α-helix	trans	-83.5	-23.6	-176.4	-121.9	177.7	-178.3	172.9	-1.6	114.7	K36 T41	K36-R38 VanDerWaalsContact C-N 3.27Å; K36-R38 PolarHBondContact O-N 2.92Å; R38-T41 PolarHBondContact O-OG1 2.92Å
39	A	40.6	Very low	47.5	Very low	74 Å²	74	120.8 Å²	120.8	61%	0.612	64%	0.64	S	S	*	*	H	α-helix	trans	-79.7	-27.6	-173.7	0	0	0	0	0	114.4
40	V	47.1	Very low	49.6	Very low	95 Å²	95	115.4 Å²	115.4	58%	0.576	61%	0.605	S	S	*	*	H	α-helix	trans	-77.5	-29.9	-179.9	-179.1	0	0	0	0	111.4	K44	V40-K44 PolarHBondContact O-N 3.36Å
41	T	49.6	Very low	51.7	Low	89 Å²	89	107.8 Å²	107.8	55%	0.546	57%	0.569	S	S	.	*	H	α-helix	trans	-68.8	-35.3	176.6	37.7	0	0	0	0	112.9	R38 A45	R38-T41 PolarHBondContact O-OG1 2.92Å; T41-A45 PolarHBondContact O-N 3.38Å
42	D	53.5	Low	54.5	Low	119 Å²	119	98.9 Å²	98.9	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-43.1	177.2	-98	-27	0	0	0	112.3	K44 A45 E46	D42-K44 VanDerWaalsContact C-N 3.35Å; D42-K44 PolarHBondContact O-N 3.07Å; D42-A45 PolarHBondContact O-N 3.01Å; D42-E46 PolarHBondContact O-N 2.65Å; D42-E46 VanDerWaalsContact O-N 3.07Å
43	L	60.6	Low	57.3	Low	118 Å²	118	90.1 Å²	90.1	62%	0.618	49%	0.49	S	S	*	.	H	α-helix	trans	-64.3	-36.7	178.2	-77.2	160.6	0	0	0	112.9	L47	L43-L47 WeakPolarHBondContact O-CB 3.2Å; L43-L47 PolarHBondContact O-N 2.96Å
44	K	61.4	Low	60.3	Low	68 Å²	68	85.8 Å²	85.8	30%	0.296	46%	0.459	S	S	.	.	H	α-helix	trans	-68.2	-40.1	175.5	-80	-171.2	169.9	-167.1	0	111.8	V40 D42 E46 L47 Y48 E61	V40-K44 PolarHBondContact O-N 3.36Å; D42-K44 VanDerWaalsContact C-N 3.35Å; D42-K44 PolarHBondContact O-N 3.07Å; K44-E46 VanDerWaalsContact C-N 3.31Å; K44-E46 PolarHBondContact O-N 3.12Å; K44-L47 PolarHBondContact O-N 3.15Å; K44-Y48 WeakPolarHBondContact O-CD2 3.39Å; K44-Y48 PolarHBondContact O-N 3Å; K44-Y48 VanDerWaalsContact O-N 3.12Å; K44-E61 WeakPolarHBondContact CE-OE2 3.4Å; K44-E61 IonicContact NZ-OE1 3.91Å; K44-E61 PolarHBondContact NZ-OE1 3.26Å; K44-E61 IonicContact NZ-OE2 3.94Å; K44-E61 PolarHBondContact NZ-OE2 3.48Å
45	A	61.8	Low	62.8	Low	56 Å²	56	80.3 Å²	80.3	46%	0.463	42%	0.42	S	S	.	.	H	α-helix	trans	-64.9	-36.8	177.6	0	0	0	0	0	111.9	T41 D42 S49	T41-A45 PolarHBondContact O-N 3.38Å; D42-A45 PolarHBondContact O-N 3.01Å; A45-S49 WeakPolarHBondContact O-CA 3.31Å; A45-S49 PolarHBondContact O-N 2.89Å
46	E	66.3	Low	65.5	Low	135 Å²	135	74.5 Å²	74.5	63%	0.631	41%	0.408	S	S	*	.	H	α-helix	trans	-72.6	-40.2	177.2	-164.8	175.3	-168.1	0	0	112.9	D42 K44 Y48 S49	D42-E46 PolarHBondContact O-N 2.65Å; D42-E46 VanDerWaalsContact O-N 3.07Å; K44-E46 VanDerWaalsContact C-N 3.31Å; K44-E46 PolarHBondContact O-N 3.12Å; E46-Y48 VanDerWaalsContact C-N 3.35Å; E46-Y48 PolarHBondContact O-N 3.25Å; E46-S49 WeakPolarHBondContact O-CB 3.29Å; E46-S49 PolarHBondContact O-N 2.83Å; E46-S49 PolarHBondContact O-OG 3.23Å
47	L	72.4	Confident	68.1	Low	52 Å²	52	71.6 Å²	71.6	27%	0.272	40%	0.398	S	S	.	.	H	α-helix	trans	-65.8	-37.3	178.3	-172.1	67.6	0	0	0	112.2	L43 K44	L43-L47 WeakPolarHBondContact O-CB 3.2Å; L43-L47 PolarHBondContact O-N 2.96Å; K44-L47 PolarHBondContact O-N 3.15Å
48	Y	80.4	Confident	70.6	Confident	9 Å²	9	69.9 Å²	69.9	4%	0.035	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	27.6	-178.5	-56.9	-52.8	0	0	0	113	K44 E46 Q50 T117 R120 R121 H124	K44-Y48 WeakPolarHBondContact O-CD2 3.39Å; K44-Y48 PolarHBondContact O-N 3Å; K44-Y48 VanDerWaalsContact O-N 3.12Å; E46-Y48 VanDerWaalsContact C-N 3.35Å; E46-Y48 PolarHBondContact O-N 3.25Å; Y48-Q50 VanDerWaalsContact C-N 3.34Å; Y48-Q50 PolarHBondContact O-N 2.96Å; Y48-T117 HydrophobicContact CD2-CG2 4Å; Y48-T117 HydrophobicContact CG-CG2 4.44Å; Y48-R120 HydrophobicContact CD1-CB 3.93Å; Y48-R120 HydrophobicContact CG-CB 4.17Å; Y48-R120 WeakPolarHBondContact O-CD 3.46Å; Y48-R120 PolarHBondContact O-NH1 3.43Å; Y48-R121 HydrophobicContact CD2-CB 4.35Å; Y48-R121 HydrophobicContact CE1-CB 4.26Å; Y48-R121 HydrophobicContact CE2-CB 3.8Å; Y48-R121 HydrophobicContact CE2-CG 4.17Å; Y48-H124 HydrophobicContact CE1-CB 3.73Å; Y48-H124 AromaticContact CE1-CG 3.99Å; Y48-H124 AromaticContact CE1-ND1 3.46Å; Y48-H124 WeakPolarHBondContact CE1-ND1 3.19Å; Y48-H124 AromaticContact CZ-ND1 3.91Å
49	S	73.1	Confident	73.2	Confident	54 Å²	54	61.4 Å²	61.4	38%	0.378	36%	0.359	S	S	.	.	S	Bend	trans	-68.5	-31.4	-176.4	78.7	0	0	0	0	113.4	A45 E46 R120 K170	A45-S49 WeakPolarHBondContact O-CA 3.31Å; A45-S49 PolarHBondContact O-N 2.89Å; E46-S49 WeakPolarHBondContact O-CB 3.29Å; E46-S49 PolarHBondContact O-N 2.83Å; E46-S49 PolarHBondContact O-OG 3.23Å; S49-R120 PolarHBondContact O-NH1 3.23Å; S49-K170 PolarHBondContact OG-NZ 2.7Å
50	Q	74.8	Confident	75.5	Confident	28 Å²	28	65.7 Å²	65.7	13%	0.131	37%	0.37	C	S	.	.	S	Bend	trans	-113.4	149.1	-175.5	-72.3	179.2	-13.8	0	0	112.4	Y48 L52 R120 E166	Y48-Q50 VanDerWaalsContact C-N 3.34Å; Y48-Q50 PolarHBondContact O-N 2.96Å; Q50-L52 VanDerWaalsContact C-N 3.28Å; Q50-L52 PolarHBondContact O-N 3.37Å; Q50-R120 WeakPolarHBondContact O-CD 3.49Å; Q50-E166 VanDerWaalsContact NE2-CD 3.27Å; Q50-E166 PolarHBondContact NE2-OE1 3.1Å
51	P	71.8	Confident	77.5	Confident	28 Å²	28	64.1 Å²	64.1	18%	0.182	36%	0.357	C	S	.	.	S	Bend	trans	-72.5	-18.3	178.2	29.1	-34.7	0	0	0	113.8	L159	P51-L159 HydrophobicContact CG-CD2 3.87Å
52	L	87.7	Confident	79.4	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.026	37%	0.371	C	S	.	.			trans	-122.9	139.1	-178.9	-171.1	61.2	0	0	0	110.8	Q50 F152 R155 F156 L159 F167	Q50-L52 VanDerWaalsContact C-N 3.28Å; Q50-L52 PolarHBondContact O-N 3.37Å; L52-F152 HydrophobicContact CD1-CD2 3.64Å; L52-F152 HydrophobicContact CD1-CE2 3.61Å; L52-F152 HydrophobicContact CD1-CG 4.26Å; L52-F152 HydrophobicContact CD1-CZ 4.22Å; L52-F152 HydrophobicContact CD2-CD2 4.48Å; L52-F152 HydrophobicContact CD2-CE1 4.01Å; L52-F152 HydrophobicContact CD2-CE2 3.84Å; L52-F152 HydrophobicContact CD2-CZ 3.58Å; L52-F152 HydrophobicContact CG-CD2 4.2Å; L52-F152 HydrophobicContact CG-CE2 3.62Å; L52-F152 HydrophobicContact CG-CZ 3.9Å; L52-R155 HydrophobicContact CD1-CB 3.68Å; L52-R155 HydrophobicContact CD1-CG 4.49Å; L52-F156 HydrophobicContact CD2-CB 3.83Å; L52-F156 HydrophobicContact CD2-CD2 3.73Å; L52-F156 HydrophobicContact CD2-CG 4.28Å; L52-L159 HydrophobicContact CB-CD1 4.27Å; L52-L159 HydrophobicContact CD2-CD1 3.73Å; L52-F167 HydrophobicContact CB-CD2 4.36Å; L52-F167 HydrophobicContact CB-CE2 4.24Å; L52-F167 HydrophobicContact CD2-CD2 4.48Å; L52-F167 HydrophobicContact CD2-CE2 4.23Å; L52-F167 HydrophobicContact CD2-CZ 4.45Å; L52-F167 HydrophobicContact CG-CD2 4.45Å; L52-F167 HydrophobicContact CG-CE2 3.98Å; L52-F167 HydrophobicContact CG-CZ 4.46Å
53	Q	89.1	Confident	81.3	Confident	40 Å²	40	63.9 Å²	63.9	19%	0.187	35%	0.352	C	S	.	.			trans	-141.6	148.8	-176.6	-159.5	-171.5	-11	0	0	111	Y55	Q53-Y55 HydrophobicContact CB-CD1 4.12Å; Q53-Y55 HydrophobicContact CB-CE1 4.19Å; Q53-Y55 HydrophobicContact CG-CD1 4.48Å; Q53-Y55 PolarHBondContact O-N 3.5Å
54	F	90.8	Very high	82.8	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.026	34%	0.337	C	S	.	.			trans	-79	-0.5	167.7	-81.8	-12.3	0	0	0	114.3	A56 F152 F167 N171 L173 V242 D245 F246	F54-A56 VanDerWaalsContact C-N 3.26Å; F54-A56 PolarHBondContact O-N 3.08Å; F54-F152 AromaticContact CD1-CE2 3.65Å; F54-F152 HydrophobicContact CD1-CE2 3.65Å; F54-F152 AromaticContact CD1-CZ 3.82Å; F54-F152 HydrophobicContact CD1-CZ 3.82Å; F54-F152 HydrophobicContact CE1-CE1 4.32Å; F54-F152 AromaticContact CE1-CE2 3.82Å; F54-F152 HydrophobicContact CE1-CE2 3.82Å; F54-F152 AromaticContact CE1-CZ 3.48Å; F54-F152 HydrophobicContact CE1-CZ 3.48Å; F54-F152 VanDerWaalsContact CE1-CZ 3.48Å; F54-F167 HydrophobicContact CD1-CE1 4.28Å; F54-F167 AromaticContact CD1-CZ 3.59Å; F54-F167 HydrophobicContact CD1-CZ 3.59Å; F54-F167 AromaticContact CE1-CE1 3.71Å; F54-F167 HydrophobicContact CE1-CE1 3.71Å; F54-F167 AromaticContact CE1-CZ 3.49Å; F54-F167 HydrophobicContact CE1-CZ 3.49Å; F54-F167 VanDerWaalsContact CE1-CZ 3.49Å; F54-F167 HydrophobicContact CG-CZ 4.17Å; F54-F167 AromaticContact CZ-CE1 3.85Å; F54-F167 HydrophobicContact CZ-CE1 3.85Å; F54-F167 AromaticContact CZ-CZ 3.99Å; F54-F167 HydrophobicContact CZ-CZ 3.99Å; F54-N171 HydrophobicContact CD2-CB 3.92Å; F54-N171 WeakPolarHBondContact CD2-OD1 3.4Å; F54-N171 HydrophobicContact CE2-CB 3.74Å; F54-L173 HydrophobicContact CE2-CD1 3.95Å; F54-L173 HydrophobicContact CZ-CD1 3.85Å; F54-V242 HydrophobicContact CE1-CG1 3.85Å; F54-V242 HydrophobicContact CZ-CG1 3.84Å; F54-D245 WeakPolarHBondContact CE2-OD2 3.46Å; F54-F246 HydrophobicContact CB-CD2 4.49Å; F54-F246 HydrophobicContact CD1-CB 4.09Å; F54-F246 AromaticContact CD1-CD2 3.68Å; F54-F246 HydrophobicContact CD1-CD2 3.68Å; F54-F246 HydrophobicContact CD1-CG 4.26Å; F54-F246 HydrophobicContact CE1-CB 3.83Å; F54-F246 HydrophobicContact CE1-CD2 4.29Å; F54-F246 HydrophobicContact CE1-CG 4.44Å; F54-F246 HydrophobicContact CG-CD2 4.37Å
55	Y	93.5	Very high	84	Confident	5 Å²	5	61 Å²	61	2%	0.02	34%	0.343	C	S	.	.			trans	49.9	47.2	-177	-47.5	-65	0	0	0	112.3	Q53 R75 D123 H127 F128 R131 R155 F246	Q53-Y55 HydrophobicContact CB-CD1 4.12Å; Q53-Y55 HydrophobicContact CB-CE1 4.19Å; Q53-Y55 HydrophobicContact CG-CD1 4.48Å; Q53-Y55 PolarHBondContact O-N 3.5Å; Y55-R75 PolarHBondContact OH-NH2 3.32Å; Y55-D123 WeakPolarHBondContact CE1-OD2 3.35Å; Y55-D123 VanDerWaalsContact OH-CG 3.32Å; Y55-D123 PolarHBondContact OH-OD1 3Å; Y55-D123 PolarHBondContact OH-OD2 2.78Å; Y55-H127 WeakPolarHBondContact CB-CD2 3.48Å; Y55-H127 HydrophobicContact CD1-CB 4.15Å; Y55-H127 HydrophobicContact CD2-CB 4.4Å; Y55-H127 AromaticContact CD2-CD2 3.5Å; Y55-H127 AromaticContact CD2-CE1 3.61Å; Y55-H127 AromaticContact CD2-CG 3.61Å; Y55-H127 AromaticContact CD2-ND1 3.7Å; Y55-H127 AromaticContact CD2-NE2 3.51Å; Y55-H127 HydrophobicContact CE1-CB 4.21Å; Y55-H127 HydrophobicContact CE2-CB 4.47Å; Y55-H127 AromaticContact CE2-CG 3.94Å; Y55-H127 AromaticContact CE2-ND1 3.82Å; Y55-H127 HydrophobicContact CG-CB 4.23Å; Y55-H127 AromaticContact CG-CD2 3.39Å; Y55-H127 AromaticContact CG-CG 3.71Å; Y55-H127 AromaticContact CG-NE2 3.8Å; Y55-F128 WeakPolarHBondContact O-CZ 3.25Å; Y55-R131 PolarHBondContact O-NH1 2.86Å; Y55-R131 PolarHBondContact O-NH2 3.34Å; Y55-R155 PolarHBondContact OH-NH1 2.97Å; Y55-R155 VanDerWaalsContact OH-NH1 3.08Å; Y55-F246 AromaticContact CD2-CE2 3.85Å; Y55-F246 HydrophobicContact CD2-CE2 3.85Å; Y55-F246 HydrophobicContact CD2-CZ 4.02Å; Y55-F246 HydrophobicContact CE2-CE2 4.31Å; Y55-F246 HydrophobicContact CE2-CZ 4.14Å
56	A	90.1	Very high	85.3	Confident	72 Å²	72	62.3 Å²	62.3	60%	0.595	35%	0.349	S	S	*	.			trans	-79.4	-41.4	-175.8	0	0	0	0	0	112.5	F54	F54-A56 VanDerWaalsContact C-N 3.26Å; F54-A56 PolarHBondContact O-N 3.08Å
57	Q	89.9	Confident	86.5	Confident	127 Å²	127	58.8 Å²	58.8	59%	0.593	33%	0.332	S	S	*	.	S	Bend	trans	-96.5	131.2	-179	-67.2	-177.4	-18.8	0	0	110.4	H124 F128	Q57-H124 PolarHBondContact O-CE1 2.9Å; Q57-H124 PolarHBondContact O-NE2 2.85Å; Q57-F128 VanDerWaalsContact O-CE2 3.3Å; Q57-F128 WeakPolarHBondContact O-CE2 3.2Å; Q57-F128 VanDerWaalsContact O-CZ 3.27Å; Q57-F128 WeakPolarHBondContact O-CZ 3.15Å
58	P	91.3	Very high	87.4	Confident	76 Å²	76	57.3 Å²	57.3	49%	0.494	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-69.1	145.8	175.3	28.8	-33.4	0	0	0	111.2	L60 F128	P58-L60 PolarHBondContact O-N 3.26Å; P58-F128 HydrophobicContact CB-CD1 4.18Å; P58-F128 HydrophobicContact CB-CE1 3.83Å; P58-F128 HydrophobicContact CB-CZ 4.29Å
59	P	91.6	Very high	87.7	Confident	33 Å²	33	61.8 Å²	61.8	21%	0.214	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-65.1	133.3	172.6	29.1	-34.8	0	0	0	110	I125 F128	P59-I125 HydrophobicContact CB-CG1 3.86Å; P59-I125 HydrophobicContact CG-CG1 4.12Å; P59-F128 HydrophobicContact CG-CB 4.31Å; P59-F128 HydrophobicContact CG-CG 4.47Å
60	L	88.8	Confident	88.5	Confident	164 Å²	164	61.8 Å²	61.8	86%	0.859	35%	0.345	S	S	*	.			trans	-98.7	1.6	178.9	-58.9	179.9	0	0	0	113	P58	P58-L60 PolarHBondContact O-N 3.26Å
61	E	88.8	Confident	89.5	Confident	63 Å²	63	61.5 Å²	61.5	29%	0.294	34%	0.344	S	S	.	.			trans	-82.6	143.9	-177.3	179.5	172	-176.7	0	0	111.5	K44 R121	K44-E61 WeakPolarHBondContact CE-OE2 3.4Å; K44-E61 IonicContact NZ-OE1 3.91Å; K44-E61 PolarHBondContact NZ-OE1 3.26Å; K44-E61 IonicContact NZ-OE2 3.94Å; K44-E61 PolarHBondContact NZ-OE2 3.48Å; E61-R121 VanDerWaalsContact CD-NE 3.26Å; E61-R121 VanDerWaalsContact CD-NH2 3.28Å; E61-R121 IonicContact OE1-CZ 2.86Å; E61-R121 IonicContact OE1-NE 3.67Å; E61-R121 PolarHBondContact OE1-NE 3.13Å; E61-R121 VanDerWaalsContact OE1-NE 3.16Å; E61-R121 IonicContact OE1-NH2 3.29Å; E61-R121 PolarHBondContact OE1-NH2 3.08Å; E61-R121 IonicContact OE2-CZ 2.62Å; E61-R121 IonicContact OE2-NE 2.76Å; E61-R121 PolarHBondContact OE2-NE 2.89Å; E61-R121 IonicContact OE2-NH2 2.72Å
62	N	89.5	Confident	90.4	Very high	156 Å²	156	60.1 Å²	60.1	83%	0.834	34%	0.335	S	S	*	.			trans	-83.4	132.6	170.3	-63.6	-43	0	0	0	109.7
63	I	92.9	Very high	90.4	Very high	46 Å²	46	61.6 Å²	61.6	24%	0.236	34%	0.344	C	S	.	.			trans	-121.8	157	176	65.4	179.9	0	0	0	110.4	E67 F68 I125 I129	I63-E67 HydrophobicContact CB-CB 4.3Å; I63-F68 HydrophobicContact CD1-CB 3.85Å; I63-F68 HydrophobicContact CD1-CD2 4.08Å; I63-F68 HydrophobicContact CD1-CG 4.44Å; I63-F68 HydrophobicContact CG1-CB 4.3Å; I63-I125 HydrophobicContact CD1-CG2 3.73Å; I63-I125 HydrophobicContact CG2-CD1 3.99Å; I63-I129 HydrophobicContact CD1-CD1 4.03Å
64	S	92.6	Very high	90.6	Very high	46 Å²	46	61 Å²	61	32%	0.322	34%	0.342	S	S	.	.			trans	-68.8	156.9	171.6	61.7	0	0	0	0	111.7	S66 E67 F68	S64-S66 VanDerWaalsContact C-N 3.26Å; S64-S66 PolarHBondContact O-N 3.35Å; S64-S66 PolarHBondContact OG-OG 3.45Å; S64-S66 VanDerWaalsContact OG-OG 3.14Å; S64-E67 PolarHBondContact N-OE2 2.97Å; S64-E67 PolarHBondContact O-N 3.49Å; S64-E67 WeakPolarHBondContact OG-CB 3.47Å; S64-E67 VanDerWaalsContact OG-CG 3.24Å; S64-E67 WeakPolarHBondContact OG-CG 3.34Å; S64-E67 PolarHBondContact OG-N 2.99Å; S64-E67 PolarHBondContact OG-OE2 2.78Å; S64-F68 PolarHBondContact O-N 3.18Å
65	L	87.5	Confident	90.8	Very high	80 Å²	80	60.7 Å²	60.7	42%	0.419	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-33.2	175.2	-74.3	173.8	0	0	0	112.3	F68 E69 L270	L65-F68 WeakPolarHBondContact O-CB 3.39Å; L65-F68 PolarHBondContact O-N 3.11Å; L65-E69 WeakPolarHBondContact O-CB 3.38Å; L65-E69 PolarHBondContact O-N 2.9Å; L65-L270 HydrophobicContact CD2-CD2 4.47Å
66	S	87.9	Confident	90.7	Very high	83 Å²	83	60.6 Å²	60.6	58%	0.58	34%	0.34	S	S	*	.	H	α-helix	trans	-67.3	-41.6	175.2	50.9	0	0	0	0	112.1	S64 S70	S64-S66 VanDerWaalsContact C-N 3.26Å; S64-S66 PolarHBondContact O-N 3.35Å; S64-S66 PolarHBondContact OG-OG 3.45Å; S64-S66 VanDerWaalsContact OG-OG 3.14Å; S66-S70 WeakPolarHBondContact O-CB 3.34Å; S66-S70 PolarHBondContact O-N 2.9Å
67	E	91.9	Very high	90.7	Very high	61 Å²	61	60.6 Å²	60.6	29%	0.285	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-43.5	171.3	-79.2	172.5	105.6	0	0	111.5	I63 S64 E69 S70 F71 R121	I63-E67 HydrophobicContact CB-CB 4.3Å; S64-E67 PolarHBondContact N-OE2 2.97Å; S64-E67 PolarHBondContact O-N 3.49Å; S64-E67 WeakPolarHBondContact OG-CB 3.47Å; S64-E67 VanDerWaalsContact OG-CG 3.24Å; S64-E67 WeakPolarHBondContact OG-CG 3.34Å; S64-E67 PolarHBondContact OG-N 2.99Å; S64-E67 PolarHBondContact OG-OE2 2.78Å; E67-E69 VanDerWaalsContact C-N 3.35Å; E67-E69 PolarHBondContact O-N 3.32Å; E67-S70 PolarHBondContact O-N 3.11Å; E67-F71 VanDerWaalsContact O-CB 3.22Å; E67-F71 WeakPolarHBondContact O-CB 3.43Å; E67-F71 WeakPolarHBondContact O-CD1 3.39Å; E67-F71 WeakPolarHBondContact O-CG 3.39Å; E67-F71 PolarHBondContact O-N 3.17Å; E67-R121 IonicContact OE1-NH1 3.51Å; E67-R121 PolarHBondContact OE1-NH1 3.25Å; E67-R121 IonicContact OE1-NH2 2.78Å
68	F	90.9	Very high	90.9	Very high	22 Å²	22	54.5 Å²	54.5	10%	0.096	30%	0.299	C	S	.	.	H	α-helix	trans	-55.2	-50.9	177.4	-178.9	-79	0	0	0	111.2	I63 S64 L65 A72 I129 L132 L270 L273 L274	I63-F68 HydrophobicContact CD1-CB 3.85Å; I63-F68 HydrophobicContact CD1-CD2 4.08Å; I63-F68 HydrophobicContact CD1-CG 4.44Å; I63-F68 HydrophobicContact CG1-CB 4.3Å; S64-F68 PolarHBondContact O-N 3.18Å; L65-F68 WeakPolarHBondContact O-CB 3.39Å; L65-F68 PolarHBondContact O-N 3.11Å; F68-A72 WeakPolarHBondContact O-CB 3.37Å; F68-A72 PolarHBondContact O-N 3.19Å; F68-A72 VanDerWaalsContact O-N 3.1Å; F68-I129 HydrophobicContact CB-CD1 4.38Å; F68-I129 HydrophobicContact CD1-CG2 4.21Å; F68-I129 HydrophobicContact CD2-CD1 3.68Å; F68-I129 HydrophobicContact CD2-CG1 3.81Å; F68-I129 HydrophobicContact CD2-CG2 4.35Å; F68-I129 HydrophobicContact CE1-CG2 3.64Å; F68-I129 HydrophobicContact CE2-CB 4.29Å; F68-I129 HydrophobicContact CE2-CD1 4.06Å; F68-I129 HydrophobicContact CE2-CG1 3.67Å; F68-I129 HydrophobicContact CE2-CG2 3.81Å; F68-I129 HydrophobicContact CG-CD1 3.95Å; F68-I129 HydrophobicContact CG-CG1 4.46Å; F68-I129 HydrophobicContact CZ-CB 4.35Å; F68-I129 HydrophobicContact CZ-CG1 4.21Å; F68-I129 HydrophobicContact CZ-CG2 3.41Å; F68-I129 VanDerWaalsContact CZ-CG2 3.41Å; F68-L132 HydrophobicContact CZ-CD1 4.41Å; F68-L270 HydrophobicContact CE1-CD2 4.13Å; F68-L270 HydrophobicContact CE2-CD2 4.16Å; F68-L270 HydrophobicContact CZ-CD2 3.87Å; F68-L273 HydrophobicContact CD1-CD1 4.15Å; F68-L273 HydrophobicContact CE1-CD1 4.31Å; F68-L274 HydrophobicContact CZ-CD2 4.47Å
69	E	87.6	Confident	91	Very high	102 Å²	102	50.9 Å²	50.9	48%	0.477	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-48.7	179.4	-175.6	175.4	-173.2	0	0	111.7	L65 E67 F71 A72 V73 L273	L65-E69 WeakPolarHBondContact O-CB 3.38Å; L65-E69 PolarHBondContact O-N 2.9Å; E67-E69 VanDerWaalsContact C-N 3.35Å; E67-E69 PolarHBondContact O-N 3.32Å; E69-F71 PolarHBondContact O-N 3.3Å; E69-A72 PolarHBondContact O-N 3.07Å; E69-V73 HydrophobicContact CG-CG2 4.47Å; E69-V73 WeakPolarHBondContact O-CB 3.32Å; E69-V73 WeakPolarHBondContact O-CG2 3.42Å; E69-V73 PolarHBondContact O-N 3.49Å; E69-L273 HydrophobicContact CB-CD2 4.23Å; E69-L273 HydrophobicContact CG-CD2 3.93Å
70	S	90.6	Very high	90.9	Very high	54 Å²	54	52.9 Å²	52.9	38%	0.378	28%	0.28	S	S	.	.	H	α-helix	trans	-57.7	-46.8	178.9	176.7	0	0	0	0	112.2	S66 E67 A72 V73 D74	S66-S70 WeakPolarHBondContact O-CB 3.34Å; S66-S70 PolarHBondContact O-N 2.9Å; E67-S70 PolarHBondContact O-N 3.11Å; S70-A72 PolarHBondContact O-N 3.37Å; S70-V73 PolarHBondContact O-N 2.84Å; S70-D74 WeakPolarHBondContact O-CB 3.45Å; S70-D74 PolarHBondContact O-N 2.86Å
71	F	94.1	Very high	91.1	Very high	22 Å²	22	46.2 Å²	46.2	10%	0.096	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-39.2	179.8	-74	6.6	0	0	0	112.2	E67 E69 R75 K122 I125 S126 I129	E67-F71 VanDerWaalsContact O-CB 3.22Å; E67-F71 WeakPolarHBondContact O-CB 3.43Å; E67-F71 WeakPolarHBondContact O-CD1 3.39Å; E67-F71 WeakPolarHBondContact O-CG 3.39Å; E67-F71 PolarHBondContact O-N 3.17Å; E69-F71 PolarHBondContact O-N 3.3Å; F71-R75 PolarHBondContact O-N 3.37Å; F71-R75 VanDerWaalsContact O-N 3.07Å; F71-K122 HydrophobicContact CD1-CD 4.14Å; F71-K122 HydrophobicContact CD1-CG 3.8Å; F71-K122 HydrophobicContact CD2-CG 4.37Å; F71-K122 HydrophobicContact CE1-CB 4.3Å; F71-K122 HydrophobicContact CE1-CD 4.1Å; F71-K122 HydrophobicContact CE1-CG 3.87Å; F71-K122 HydrophobicContact CE2-CB 4.37Å; F71-K122 HydrophobicContact CE2-CG 4.44Å; F71-K122 HydrophobicContact CG-CG 4.06Å; F71-K122 HydrophobicContact CZ-CB 4.17Å; F71-K122 HydrophobicContact CZ-CG 4.2Å; F71-I125 HydrophobicContact CD2-CB 4.13Å; F71-I125 HydrophobicContact CD2-CG2 3.84Å; F71-I125 HydrophobicContact CE2-CB 4.46Å; F71-I125 HydrophobicContact CE2-CD1 4.35Å; F71-I125 HydrophobicContact CE2-CG2 4.39Å; F71-S126 VanDerWaalsContact O-CB 3.24Å; F71-S126 WeakPolarHBondContact O-CB 3.47Å; F71-I129 HydrophobicContact CB-CD1 4.17Å
72	A	90.9	Very high	91.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.9	-48	176.6	0	0	0	0	0	111.7	F68 E69 S70 R75 L76 I129 L130 L277	F68-A72 WeakPolarHBondContact O-CB 3.37Å; F68-A72 PolarHBondContact O-N 3.19Å; F68-A72 VanDerWaalsContact O-N 3.1Å; E69-A72 PolarHBondContact O-N 3.07Å; S70-A72 PolarHBondContact O-N 3.37Å; A72-R75 PolarHBondContact O-N 3.32Å; A72-L76 VanDerWaalsContact O-CB 3.26Å; A72-L76 WeakPolarHBondContact O-CB 3.38Å; A72-L76 PolarHBondContact O-N 3.31Å; A72-I129 HydrophobicContact CB-CG2 3.62Å; A72-L130 HydrophobicContact CB-CD2 4.2Å; A72-L277 HydrophobicContact CB-CD1 3.58Å; A72-L277 HydrophobicContact CB-CD2 3.64Å; A72-L277 HydrophobicContact CB-CG 4.26Å
73	V	88.6	Confident	91.4	Very high	35 Å²	35	37.5 Å²	37.5	21%	0.212	20%	0.201	C	C	.	.	H	α-helix	trans	-61.3	-47	178.8	167.4	0	0	0	0	110.8	E69 S70 L76 K77 L277 L282	E69-V73 HydrophobicContact CG-CG2 4.47Å; E69-V73 WeakPolarHBondContact O-CB 3.32Å; E69-V73 WeakPolarHBondContact O-CG2 3.42Å; E69-V73 PolarHBondContact O-N 3.49Å; S70-V73 PolarHBondContact O-N 2.84Å; V73-L76 PolarHBondContact O-N 3.19Å; V73-K77 HydrophobicContact CG1-CD 4.22Å; V73-K77 WeakPolarHBondContact O-CG 3.21Å; V73-K77 PolarHBondContact O-N 3.25Å; V73-L277 HydrophobicContact CG2-CD2 4.42Å; V73-L282 HydrophobicContact CG1-CD2 4.3Å
74	D	92.5	Very high	91.2	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-42.8	-178.5	-74.9	-12.5	0	0	0	112.2	S70 L76 K77 L78 L107 F109 K122	S70-D74 WeakPolarHBondContact O-CB 3.45Å; S70-D74 PolarHBondContact O-N 2.86Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 3.4Å; D74-K77 PolarHBondContact O-N 3.46Å; D74-L78 PolarHBondContact O-N 3.33Å; D74-L107 HydrophobicContact CB-CD2 4.43Å; D74-L107 WeakPolarHBondContact O-CD1 3.26Å; D74-F109 HydrophobicContact CB-CE2 4.09Å; D74-F109 HydrophobicContact CB-CZ 4.29Å; D74-K122 WeakPolarHBondContact OD2-CE 3.47Å; D74-K122 IonicContact OD2-NZ 2.8Å; D74-K122 PolarHBondContact OD2-NZ 3.15Å
75	R	94.8	Very high	91.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-38.1	175.8	-173	178.5	-163.2	89	2.9	111.5	Y55 F71 A72 K77 L78 L79 F109 D123 S126 H127 L130 E148	Y55-R75 PolarHBondContact OH-NH2 3.32Å; F71-R75 PolarHBondContact O-N 3.37Å; F71-R75 VanDerWaalsContact O-N 3.07Å; A72-R75 PolarHBondContact O-N 3.32Å; R75-K77 VanDerWaalsContact C-N 3.33Å; R75-K77 PolarHBondContact O-N 2.9Å; R75-L78 WeakPolarHBondContact O-CB 3.46Å; R75-L78 PolarHBondContact O-N 3.47Å; R75-L79 HydrophobicContact CG-CD1 4.36Å; R75-L79 HydrophobicContact CG-CG 4.37Å; R75-L79 WeakPolarHBondContact O-CG 3.42Å; R75-L79 PolarHBondContact O-N 2.94Å; R75-F109 HydrophobicContact CB-CE1 4.45Å; R75-F109 HydrophobicContact CB-CZ 3.83Å; R75-F109 HydrophobicContact CG-CZ 4.43Å; R75-D123 IonicContact CZ-OD1 2.84Å; R75-D123 PolarHBondContact NH1-O 2.95Å; R75-D123 IonicContact NH1-OD1 3.7Å; R75-D123 PolarHBondContact NH1-OD1 3.02Å; R75-D123 IonicContact NH2-OD1 2.87Å; R75-S126 WeakPolarHBondContact CD-O 3.27Å; R75-S126 WeakPolarHBondContact CD-OG 3.39Å; R75-S126 PolarHBondContact NH1-OG 3.12Å; R75-H127 VanDerWaalsContact CD-N 3.35Å; R75-H127 VanDerWaalsContact CZ-CB 3.49Å; R75-H127 PolarHBondContact NH2-ND1 3.45Å; R75-L130 HydrophobicContact CB-CD1 3.85Å; R75-L130 HydrophobicContact CB-CG 4.48Å; R75-L130 HydrophobicContact CG-CD1 3.68Å; R75-E148 IonicContact CZ-OE1 3.71Å; R75-E148 IonicContact CZ-OE2 2.79Å; R75-E148 IonicContact NE-OE1 2.87Å; R75-E148 PolarHBondContact NE-OE1 3.48Å; R75-E148 IonicContact NH2-OE1 2.74Å; R75-E148 PolarHBondContact NH2-OE1 2.92Å; R75-E148 IonicContact NH2-OE2 2.81Å; R75-E148 PolarHBondContact NH2-OE2 3.15Å
76	L	91.8	Very high	91.2	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-65.9	-39	179.1	-177.4	56.3	0	0	0	111.5	A72 V73 D74 L79 K80 L130 Y134 W143 L277 L282	A72-L76 VanDerWaalsContact O-CB 3.26Å; A72-L76 WeakPolarHBondContact O-CB 3.38Å; A72-L76 PolarHBondContact O-N 3.31Å; V73-L76 PolarHBondContact O-N 3.19Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 3.4Å; L76-L79 PolarHBondContact O-N 3.18Å; L76-K80 HydrophobicContact CD1-CG 4.4Å; L76-K80 WeakPolarHBondContact O-CB 3.41Å; L76-K80 WeakPolarHBondContact O-CG 3.47Å; L76-K80 PolarHBondContact O-N 3.47Å; L76-L130 HydrophobicContact CB-CD1 4.14Å; L76-L130 HydrophobicContact CB-CD2 4.34Å; L76-Y134 HydrophobicContact CD1-CE2 4.03Å; L76-Y134 WeakPolarHBondContact CD1-OH 3.45Å; L76-W143 HydrophobicContact CD1-CH2 3.73Å; L76-W143 HydrophobicContact CD1-CZ3 3.91Å; L76-L277 HydrophobicContact CD2-CD2 4.29Å; L76-L277 WeakPolarHBondContact CD2-O 3.38Å; L76-L282 HydrophobicContact CB-CD1 4.13Å; L76-L282 HydrophobicContact CD2-CD1 3.83Å; L76-L282 HydrophobicContact CD2-CD2 3.96Å; L76-L282 HydrophobicContact CD2-CG 4.3Å; L76-L282 HydrophobicContact CG-CD1 3.59Å
77	K	90.1	Very high	91.2	Very high	71 Å²	71	31 Å²	31	31%	0.309	16%	0.164	S	C	.	.	H	α-helix	trans	-57.4	-47.8	169.9	-74.5	174.1	-178.3	171.5	0	111.2	V73 D74 R75 L79 K80 T81 L107 L282	V73-K77 HydrophobicContact CG1-CD 4.22Å; V73-K77 WeakPolarHBondContact O-CG 3.21Å; V73-K77 PolarHBondContact O-N 3.25Å; D74-K77 PolarHBondContact O-N 3.46Å; R75-K77 VanDerWaalsContact C-N 3.33Å; R75-K77 PolarHBondContact O-N 2.9Å; K77-L79 PolarHBondContact O-N 3.27Å; K77-K80 PolarHBondContact O-N 3.04Å; K77-T81 PolarHBondContact O-N 3.4Å; K77-T81 PolarHBondContact O-OG1 3.39Å; K77-L107 HydrophobicContact CB-CD1 4.06Å; K77-L107 HydrophobicContact CB-CD2 4.35Å; K77-L107 HydrophobicContact CD-CD2 4.18Å; K77-L282 HydrophobicContact CG-CB 4.27Å; K77-L282 HydrophobicContact CG-CD1 3.93Å
78	L	94.3	Very high	90.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-48.7	176.9	178.4	60.9	0	0	0	112.1	D74 R75 K80 T81 V82 L100 E103 I104 L107 F109 L151	D74-L78 PolarHBondContact O-N 3.33Å; R75-L78 WeakPolarHBondContact O-CB 3.46Å; R75-L78 PolarHBondContact O-N 3.47Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.13Å; L78-T81 WeakPolarHBondContact O-CB 3.32Å; L78-T81 PolarHBondContact O-N 3.06Å; L78-T81 VanDerWaalsContact O-N 3.17Å; L78-V82 WeakPolarHBondContact O-CG2 3.39Å; L78-V82 PolarHBondContact O-N 3.49Å; L78-L100 HydrophobicContact CD1-CD1 3.93Å; L78-E103 HydrophobicContact CD1-CG 4.43Å; L78-I104 HydrophobicContact CD1-CG1 3.66Å; L78-I104 HydrophobicContact CD2-CG1 4.46Å; L78-L107 HydrophobicContact CB-CD1 3.78Å; L78-F109 HydrophobicContact CB-CD2 4.46Å; L78-F109 HydrophobicContact CB-CE2 4.19Å; L78-F109 HydrophobicContact CD2-CB 4.45Å; L78-F109 HydrophobicContact CD2-CD1 4.38Å; L78-F109 HydrophobicContact CD2-CD2 3.74Å; L78-F109 HydrophobicContact CD2-CE2 4.04Å; L78-F109 HydrophobicContact CD2-CG 3.93Å; L78-L151 HydrophobicContact CD2-CD1 4.2Å; L78-L151 HydrophobicContact CD2-CD2 3.73Å; L78-L151 HydrophobicContact CG-CD1 4.47Å; L78-L151 HydrophobicContact CG-CD2 4.28Å
79	L	94.3	Very high	90.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-34	-179.9	-65.6	179.9	0	0	0	112.5	R75 L76 K77 V82 E83 L130 W143 F144 Q147 E148 L151	R75-L79 HydrophobicContact CG-CD1 4.36Å; R75-L79 HydrophobicContact CG-CG 4.37Å; R75-L79 WeakPolarHBondContact O-CG 3.42Å; R75-L79 PolarHBondContact O-N 2.94Å; L76-L79 PolarHBondContact O-N 3.18Å; K77-L79 PolarHBondContact O-N 3.27Å; L79-V82 PolarHBondContact O-N 2.89Å; L79-E83 PolarHBondContact O-N 3.46Å; L79-L130 HydrophobicContact CD1-CD1 3.83Å; L79-W143 HydrophobicContact CB-CH2 3.8Å; L79-W143 HydrophobicContact CB-CZ3 4.36Å; L79-W143 HydrophobicContact CD1-CZ3 4.47Å; L79-F144 HydrophobicContact CD1-CD2 3.66Å; L79-F144 HydrophobicContact CD1-CE2 3.6Å; L79-Q147 HydrophobicContact CB-CB 3.99Å; L79-Q147 HydrophobicContact CD2-CB 3.84Å; L79-Q147 HydrophobicContact CG-CB 4.36Å; L79-E148 HydrophobicContact CD1-CG 4.32Å; L79-E148 HydrophobicContact CD2-CG 4.26Å; L79-L151 HydrophobicContact CD2-CD2 4.08Å
80	K	89.7	Confident	90.6	Very high	74 Å²	74	33.2 Å²	33.2	32%	0.322	19%	0.188	S	C	.	.	H	α-helix	trans	-66.8	-37	171.9	-78.1	-76.5	164.9	-162.9	0	112.1	L76 K77 L78 E83 N84 W143 L282	L76-K80 HydrophobicContact CD1-CG 4.4Å; L76-K80 WeakPolarHBondContact O-CB 3.41Å; L76-K80 WeakPolarHBondContact O-CG 3.47Å; L76-K80 PolarHBondContact O-N 3.47Å; K77-K80 PolarHBondContact O-N 3.04Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.13Å; K80-E83 WeakPolarHBondContact CD-OE2 3.28Å; K80-E83 IonicContact NZ-OE2 2.64Å; K80-E83 PolarHBondContact NZ-OE2 2.94Å; K80-E83 WeakPolarHBondContact O-CB 3.48Å; K80-E83 PolarHBondContact O-N 2.99Å; K80-N84 WeakPolarHBondContact O-CB 3.16Å; K80-N84 PolarHBondContact O-N 3.42Å; K80-N84 PolarHBondContact O-ND2 2.71Å; K80-W143 HydrophobicContact CD-CH2 4.37Å; K80-W143 HydrophobicContact CD-CZ2 3.85Å; K80-W143 HydrophobicContact CG-CH2 4.25Å; K80-W143 HydrophobicContact CG-CZ2 4.17Å; K80-L282 HydrophobicContact CG-CD1 4.44Å
81	T	91.3	Very high	90.4	Very high	24 Å²	24	34.6 Å²	34.6	15%	0.147	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-42.2	172.2	-61.6	0	0	0	0	111.3	K77 L78 E83 N84 L85 E103	K77-T81 PolarHBondContact O-N 3.4Å; K77-T81 PolarHBondContact O-OG1 3.39Å; L78-T81 WeakPolarHBondContact O-CB 3.32Å; L78-T81 PolarHBondContact O-N 3.06Å; L78-T81 VanDerWaalsContact O-N 3.17Å; T81-E83 VanDerWaalsContact C-N 3.31Å; T81-E83 PolarHBondContact O-N 2.83Å; T81-N84 PolarHBondContact O-N 2.75Å; T81-L85 HydrophobicContact CG2-CD1 3.78Å; T81-L85 HydrophobicContact CG2-CG 4.06Å; T81-L85 WeakPolarHBondContact O-CB 3.45Å; T81-L85 VanDerWaalsContact O-CG 3.25Å; T81-L85 WeakPolarHBondContact O-CG 3.42Å; T81-L85 PolarHBondContact O-N 3.28Å; T81-E103 HydrophobicContact CG2-CB 3.99Å; T81-E103 HydrophobicContact CG2-CG 3.84Å
82	V	93.9	Very high	90	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-43.6	174.3	172.8	0	0	0	0	111.4	L78 L79 G86 L100 D150 L151	L78-V82 WeakPolarHBondContact O-CG2 3.39Å; L78-V82 PolarHBondContact O-N 3.49Å; L79-V82 PolarHBondContact O-N 2.89Å; V82-G86 PolarHBondContact O-N 3.42Å; V82-L100 HydrophobicContact CG2-CD1 3.76Å; V82-L100 HydrophobicContact CG2-CD2 4.46Å; V82-D150 HydrophobicContact CG1-CB 3.7Å; V82-L151 HydrophobicContact CG2-CB 4.32Å; V82-L151 HydrophobicContact CG2-CD1 4.23Å
83	E	91.1	Very high	90	Very high	35 Å²	35	37.7 Å²	37.7	16%	0.164	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-54.7	175.3	175.2	175.3	-137.2	0	0	111.4	L79 K80 T81 L85 G86 V87 W143 Q147	L79-E83 PolarHBondContact O-N 3.46Å; K80-E83 WeakPolarHBondContact CD-OE2 3.28Å; K80-E83 IonicContact NZ-OE2 2.64Å; K80-E83 PolarHBondContact NZ-OE2 2.94Å; K80-E83 WeakPolarHBondContact O-CB 3.48Å; K80-E83 PolarHBondContact O-N 2.99Å; T81-E83 VanDerWaalsContact C-N 3.31Å; T81-E83 PolarHBondContact O-N 2.83Å; E83-L85 PolarHBondContact O-N 2.77Å; E83-G86 PolarHBondContact O-N 2.67Å; E83-G86 VanDerWaalsContact O-N 3.1Å; E83-V87 WeakPolarHBondContact O-CG2 3.42Å; E83-V87 PolarHBondContact O-N 3.11Å; E83-V87 VanDerWaalsContact O-N 3.16Å; E83-W143 PolarHBondContact OE1-NE1 3.25Å; E83-W143 WeakPolarHBondContact OE2-CZ2 3.41Å; E83-W143 PolarHBondContact OE2-NE1 3.35Å; E83-Q147 HydrophobicContact CB-CG 4.36Å
84	N	88.9	Confident	90.1	Very high	31 Å²	31	41.4 Å²	41.4	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-45.8	-176.5	-70.2	-18.4	0	0	0	111.9	K80 T81 G86 V87 S88 L446 S464	K80-N84 WeakPolarHBondContact O-CB 3.16Å; K80-N84 PolarHBondContact O-N 3.42Å; K80-N84 PolarHBondContact O-ND2 2.71Å; T81-N84 PolarHBondContact O-N 2.75Å; N84-G86 VanDerWaalsContact C-N 3.28Å; N84-G86 PolarHBondContact O-N 2.84Å; N84-V87 PolarHBondContact O-N 2.81Å; N84-S88 PolarHBondContact O-N 2.81Å; N84-S88 PolarHBondContact O-OG 3.4Å; N84-L446 HydrophobicContact CB-CD2 4.24Å; N84-S464 PolarHBondContact ND2-OG 3.25Å
85	L	91.1	Very high	89.9	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.063	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-34.5	177.2	-66.1	178.8	0	0	0	111.8	T81 E83 V87 Y89 Y96 K99 L100	T81-L85 HydrophobicContact CG2-CD1 3.78Å; T81-L85 HydrophobicContact CG2-CG 4.06Å; T81-L85 WeakPolarHBondContact O-CB 3.45Å; T81-L85 VanDerWaalsContact O-CG 3.25Å; T81-L85 WeakPolarHBondContact O-CG 3.42Å; T81-L85 PolarHBondContact O-N 3.28Å; E83-L85 PolarHBondContact O-N 2.77Å; L85-V87 PolarHBondContact O-N 2.94Å; L85-Y89 HydrophobicContact CB-CD2 4.42Å; L85-Y89 HydrophobicContact CD2-CD2 3.79Å; L85-Y89 HydrophobicContact CD2-CE2 3.68Å; L85-Y89 WeakPolarHBondContact O-CB 3.43Å; L85-Y89 PolarHBondContact O-N 3.24Å; L85-Y96 HydrophobicContact CB-CD2 3.59Å; L85-Y96 HydrophobicContact CB-CE2 3.55Å; L85-K99 HydrophobicContact CD1-CB 3.91Å; L85-K99 HydrophobicContact CD2-CB 3.82Å; L85-K99 HydrophobicContact CD2-CD 3.61Å; L85-K99 HydrophobicContact CD2-CG 4.39Å; L85-L100 HydrophobicContact CD1-CB 3.87Å
86	G	88.8	Confident	89.7	Confident	25 Å²	25	44.2 Å²	44.2	26%	0.258	24%	0.239	S	C	.	.	H	α-helix	trans	-69.2	-19.3	177.4	0	0	0	0	0	114.4	V82 E83 N84	V82-G86 PolarHBondContact O-N 3.42Å; E83-G86 PolarHBondContact O-N 2.67Å; E83-G86 VanDerWaalsContact O-N 3.1Å; N84-G86 VanDerWaalsContact C-N 3.28Å; N84-G86 PolarHBondContact O-N 2.84Å
87	V	87.3	Confident	89.8	Confident	50 Å²	50	46.2 Å²	46.2	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-91.5	-43.5	173.5	177.3	0	0	0	0	110.8	E83 N84 L85 L438 L446	E83-V87 WeakPolarHBondContact O-CG2 3.42Å; E83-V87 PolarHBondContact O-N 3.11Å; E83-V87 VanDerWaalsContact O-N 3.16Å; N84-V87 PolarHBondContact O-N 2.81Å; L85-V87 PolarHBondContact O-N 2.94Å; V87-L438 HydrophobicContact CG1-CD2 3.63Å; V87-L446 HydrophobicContact CB-CD1 3.78Å; V87-L446 HydrophobicContact CG1-CD1 3.71Å; V87-L446 HydrophobicContact CG2-CD1 4.27Å
88	S	84.1	Confident	89.8	Confident	69 Å²	69	48.7 Å²	48.7	48%	0.483	26%	0.26	S	S	.	.	H	α-helix	trans	-79.7	-23.2	-174.5	-60.1	0	0	0	0	114.2	N84	N84-S88 PolarHBondContact O-N 2.81Å; N84-S88 PolarHBondContact O-OG 3.4Å
89	Y	87.3	Confident	89.7	Confident	49 Å²	49	51.5 Å²	51.5	19%	0.192	27%	0.272	C	S	.	.	S	Bend	trans	-131.3	158.2	-175.5	-58.6	-86.4	0	0	0	112.1	L85 K91 D95 K99 D460	L85-Y89 HydrophobicContact CB-CD2 4.42Å; L85-Y89 HydrophobicContact CD2-CD2 3.79Å; L85-Y89 HydrophobicContact CD2-CE2 3.68Å; L85-Y89 WeakPolarHBondContact O-CB 3.43Å; L85-Y89 PolarHBondContact O-N 3.24Å; Y89-K91 PolarHBondContact O-N 2.97Å; Y89-D95 HydrophobicContact CD1-CB 4.01Å; Y89-D95 HydrophobicContact CE1-CB 3.97Å; Y89-K99 HydrophobicContact CE2-CD 4.01Å; Y89-K99 VanDerWaalsContact OH-CE 3.28Å; Y89-K99 WeakPolarHBondContact OH-CE 3.42Å; Y89-K99 PolarHBondContact OH-NZ 2.92Å; Y89-D460 PolarHBondContact OH-OD1 2.98Å; Y89-D460 PolarHBondContact OH-OD2 2.97Å
90	V	87.6	Confident	89.7	Confident	114 Å²	114	51.5 Å²	51.5	69%	0.691	27%	0.272	S	S	*	.			trans	-66.7	120.2	165	-179.8	0	0	0	0	108.2	L92 N93	V90-L92 PolarHBondContact O-N 3.5Å; V90-N93 WeakPolarHBondContact O-CB 3.28Å; V90-N93 PolarHBondContact O-N 2.94Å; V90-N93 VanDerWaalsContact O-N 3.1Å; V90-N93 PolarHBondContact O-OD1 3.41Å
91	K	86.3	Confident	89.8	Confident	83 Å²	83	49.4 Å²	49.4	36%	0.361	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	130	-178.4	-70.7	-175.9	172.7	-174.1	0	111.3	Y89 N93 D150	Y89-K91 PolarHBondContact O-N 2.97Å; K91-N93 VanDerWaalsContact C-N 3.31Å; K91-N93 PolarHBondContact O-N 2.88Å; K91-D150 IonicContact NZ-OD1 3.16Å; K91-D150 PolarHBondContact NZ-OD1 2.75Å; K91-D150 IonicContact NZ-OD2 2.85Å; K91-D150 PolarHBondContact NZ-OD2 3.16Å
92	L	85.7	Confident	89.8	Confident	38 Å²	38	52.9 Å²	52.9	20%	0.199	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	17.9	177.6	-48.3	166.7	0	0	0	115.5	V90 Y96 L97 K153 Y154 K157	V90-L92 PolarHBondContact O-N 3.5Å; L92-Y96 HydrophobicContact CD2-CE1 4.27Å; L92-L97 HydrophobicContact CD2-CD2 4Å; L92-K153 HydrophobicContact CD1-CD 4.38Å; L92-K153 HydrophobicContact CD1-CG 4.45Å; L92-Y154 HydrophobicContact CD2-CD2 4.39Å; L92-K157 HydrophobicContact CD1-CD 3.52Å; L92-K157 VanDerWaalsContact CD1-NZ 3.31Å; L92-K157 HydrophobicContact CD2-CD 4.43Å
93	N	91	Very high	89.7	Confident	50 Å²	50	55.3 Å²	55.3	27%	0.267	29%	0.293	S	S	.	.	S	Bend	trans	-73.4	168.6	162.9	76.7	-8.5	0	0	0	111	V90 K91 D95 Y96 L97	V90-N93 WeakPolarHBondContact O-CB 3.28Å; V90-N93 PolarHBondContact O-N 2.94Å; V90-N93 VanDerWaalsContact O-N 3.1Å; V90-N93 PolarHBondContact O-OD1 3.41Å; K91-N93 VanDerWaalsContact C-N 3.31Å; K91-N93 PolarHBondContact O-N 2.88Å; N93-D95 VanDerWaalsContact C-N 3.3Å; N93-D95 PolarHBondContact O-N 3.43Å; N93-Y96 WeakPolarHBondContact O-CB 3.46Å; N93-Y96 PolarHBondContact O-N 3.01Å; N93-Y96 WeakPolarHBondContact OD1-CA 3.3Å; N93-Y96 WeakPolarHBondContact OD1-CB 3.44Å; N93-Y96 PolarHBondContact OD1-N 3.15Å; N93-L97 VanDerWaalsContact O-CG 3.26Å; N93-L97 WeakPolarHBondContact O-CG 3.45Å; N93-L97 PolarHBondContact O-N 3.46Å
94	D	90.3	Very high	89.8	Confident	113 Å²	113	53.8 Å²	53.8	60%	0.604	29%	0.286	S	S	*	.	H	α-helix	trans	-59.5	-39.1	-174.5	-69.1	-16.1	0	0	0	113.2	L97 K98	D94-L97 PolarHBondContact O-N 3.12Å; D94-K98 WeakPolarHBondContact O-CB 3.4Å; D94-K98 VanDerWaalsContact O-CG 3.23Å; D94-K98 WeakPolarHBondContact O-CG 3.31Å; D94-K98 PolarHBondContact O-N 3.49Å
95	D	88.8	Confident	89.9	Confident	84 Å²	84	60.2 Å²	60.2	45%	0.449	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-41.2	-180	-61.4	-34	0	0	0	112.1	Y89 N93 L97 K99	Y89-D95 HydrophobicContact CD1-CB 4.01Å; Y89-D95 HydrophobicContact CE1-CB 3.97Å; N93-D95 VanDerWaalsContact C-N 3.3Å; N93-D95 PolarHBondContact O-N 3.43Å; D95-L97 VanDerWaalsContact C-N 3.34Å; D95-L97 PolarHBondContact O-N 3.35Å; D95-K99 WeakPolarHBondContact O-CB 3.28Å; D95-K99 WeakPolarHBondContact O-CG 3.34Å; D95-K99 PolarHBondContact O-N 3.35Å
96	Y	91.1	Very high	90	Very high	3 Å²	3	64.5 Å²	64.5	1%	0.012	34%	0.335	C	S	.	.	H	α-helix	trans	-57.3	-48.7	172	176.9	-81.4	0	0	0	110.5	L85 L92 N93 L100	L85-Y96 HydrophobicContact CB-CD2 3.59Å; L85-Y96 HydrophobicContact CB-CE2 3.55Å; L92-Y96 HydrophobicContact CD2-CE1 4.27Å; N93-Y96 WeakPolarHBondContact O-CB 3.46Å; N93-Y96 PolarHBondContact O-N 3.01Å; N93-Y96 WeakPolarHBondContact OD1-CA 3.3Å; N93-Y96 WeakPolarHBondContact OD1-CB 3.44Å; N93-Y96 PolarHBondContact OD1-N 3.15Å; Y96-L100 HydrophobicContact CE1-CD2 3.71Å; Y96-L100 VanDerWaalsContact O-CB 3.29Å; Y96-L100 WeakPolarHBondContact O-CB 3.36Å; Y96-L100 PolarHBondContact O-N 3.36Å
97	L	92.2	Very high	90.1	Very high	44 Å²	44	63.9 Å²	63.9	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-63.8	-49	-177.9	-65	174.2	0	0	0	111	L92 N93 D94 D95 K99 L100 D101 Y154	L92-L97 HydrophobicContact CD2-CD2 4Å; N93-L97 VanDerWaalsContact O-CG 3.26Å; N93-L97 WeakPolarHBondContact O-CG 3.45Å; N93-L97 PolarHBondContact O-N 3.46Å; D94-L97 PolarHBondContact O-N 3.12Å; D95-L97 VanDerWaalsContact C-N 3.34Å; D95-L97 PolarHBondContact O-N 3.35Å; L97-K99 PolarHBondContact O-N 3.42Å; L97-L100 PolarHBondContact O-N 2.92Å; L97-D101 WeakPolarHBondContact O-CB 3.41Å; L97-D101 PolarHBondContact O-N 2.79Å; L97-Y154 HydrophobicContact CD2-CD2 3.53Å; L97-Y154 HydrophobicContact CD2-CE2 3.47Å; L97-Y154 VanDerWaalsContact CD2-CE2 3.47Å
98	K	91.9	Very high	90.3	Very high	124 Å²	124	65.9 Å²	65.9	54%	0.539	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-45	179.4	-73.8	169	-172.7	168.1	0	112.3	D94 N102	D94-K98 WeakPolarHBondContact O-CB 3.4Å; D94-K98 VanDerWaalsContact O-CG 3.23Å; D94-K98 WeakPolarHBondContact O-CG 3.31Å; D94-K98 PolarHBondContact O-N 3.49Å; K98-N102 PolarHBondContact O-N 2.81Å; K98-N102 VanDerWaalsContact O-N 3.08Å
99	K	91.1	Very high	90.7	Very high	59 Å²	59	62.7 Å²	62.7	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-67.7	-43.3	179.4	-75.4	-170.8	168.6	-160.7	0	112.3	L85 Y89 D95 L97 D101 N102 E103 D460	L85-K99 HydrophobicContact CD1-CB 3.91Å; L85-K99 HydrophobicContact CD2-CB 3.82Å; L85-K99 HydrophobicContact CD2-CD 3.61Å; L85-K99 HydrophobicContact CD2-CG 4.39Å; Y89-K99 HydrophobicContact CE2-CD 4.01Å; Y89-K99 VanDerWaalsContact OH-CE 3.28Å; Y89-K99 WeakPolarHBondContact OH-CE 3.42Å; Y89-K99 PolarHBondContact OH-NZ 2.92Å; D95-K99 WeakPolarHBondContact O-CB 3.28Å; D95-K99 WeakPolarHBondContact O-CG 3.34Å; D95-K99 PolarHBondContact O-N 3.35Å; L97-K99 PolarHBondContact O-N 3.42Å; K99-D101 VanDerWaalsContact C-N 3.32Å; K99-D101 PolarHBondContact O-N 3.09Å; K99-N102 PolarHBondContact O-N 3.4Å; K99-E103 PolarHBondContact O-N 3.38Å; K99-E103 VanDerWaalsContact O-N 3.08Å; K99-D460 WeakPolarHBondContact CE-OD2 3.3Å; K99-D460 IonicContact NZ-OD1 2.81Å; K99-D460 PolarHBondContact NZ-OD1 3.4Å; K99-D460 IonicContact NZ-OD2 3.69Å; K99-D460 PolarHBondContact NZ-OD2 2.97Å
100	L	93.4	Very high	90.7	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-38.3	177.9	-175.7	55.6	0	0	0	111.6	L78 V82 L85 Y96 L97 E103 I104 Y154	L78-L100 HydrophobicContact CD1-CD1 3.93Å; V82-L100 HydrophobicContact CG2-CD1 3.76Å; V82-L100 HydrophobicContact CG2-CD2 4.46Å; L85-L100 HydrophobicContact CD1-CB 3.87Å; Y96-L100 HydrophobicContact CE1-CD2 3.71Å; Y96-L100 VanDerWaalsContact O-CB 3.29Å; Y96-L100 WeakPolarHBondContact O-CB 3.36Å; Y96-L100 PolarHBondContact O-N 3.36Å; L97-L100 PolarHBondContact O-N 2.92Å; L100-E103 PolarHBondContact O-N 3.01Å; L100-I104 HydrophobicContact CD1-CD1 4.24Å; L100-I104 HydrophobicContact CD1-CG1 4.37Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CB 3.39Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3.29Å; L100-I104 PolarHBondContact O-N 3.4Å; L100-Y154 HydrophobicContact CD2-CD1 3.75Å; L100-Y154 HydrophobicContact CD2-CD2 3.66Å; L100-Y154 HydrophobicContact CD2-CE1 4.09Å; L100-Y154 HydrophobicContact CD2-CE2 3.96Å; L100-Y154 HydrophobicContact CD2-CG 3.52Å; L100-Y154 HydrophobicContact CG-CD1 4.38Å; L100-Y154 HydrophobicContact CG-CE1 4.26Å; L100-Y154 HydrophobicContact CG-CE2 4.39Å
101	D	92.8	Very high	90.2	Very high	29 Å²	29	58.2 Å²	58.2	16%	0.155	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-47.8	172.4	-91.6	-43.8	0	0	0	112.8	L97 K99 E103 I104 R105 Q111 Y154 K158	L97-D101 WeakPolarHBondContact O-CB 3.41Å; L97-D101 PolarHBondContact O-N 2.79Å; K99-D101 VanDerWaalsContact C-N 3.32Å; K99-D101 PolarHBondContact O-N 3.09Å; D101-E103 VanDerWaalsContact C-N 3.28Å; D101-E103 PolarHBondContact O-N 3.4Å; D101-I104 PolarHBondContact O-N 2.93Å; D101-R105 WeakPolarHBondContact O-CB 3.36Å; D101-R105 PolarHBondContact O-N 3.46Å; D101-Q111 PolarHBondContact OD1-NE2 3.24Å; D101-Y154 PolarHBondContact OD1-OH 3.26Å; D101-Y154 PolarHBondContact OD2-OH 2.89Å; D101-K158 IonicContact OD1-NZ 3.42Å; D101-K158 PolarHBondContact OD1-NZ 3.45Å; D101-K158 IonicContact OD2-NZ 2.68Å; D101-K158 PolarHBondContact OD2-NZ 2.94Å
102	N	91.9	Very high	89.3	Confident	98 Å²	98	58.9 Å²	58.9	52%	0.524	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-39.2	178.6	-77.4	-16.5	0	0	0	111.9	K98 K99 T106	K98-N102 PolarHBondContact O-N 2.81Å; K98-N102 VanDerWaalsContact O-N 3.08Å; K99-N102 PolarHBondContact O-N 3.4Å; N102-T106 WeakPolarHBondContact O-CB 3.33Å; N102-T106 PolarHBondContact O-N 2.88Å; N102-T106 PolarHBondContact O-OG1 3.49Å
103	E	92.1	Very high	88.1	Confident	52 Å²	52	59.4 Å²	59.4	24%	0.243	30%	0.303	C	S	.	.	H	α-helix	trans	-69.4	-46.1	177.9	-168.1	67.8	-171.8	0	0	111.8	L78 T81 K99 L100 D101 R105 T106 L107	L78-E103 HydrophobicContact CD1-CG 4.43Å; T81-E103 HydrophobicContact CG2-CB 3.99Å; T81-E103 HydrophobicContact CG2-CG 3.84Å; K99-E103 PolarHBondContact O-N 3.38Å; K99-E103 VanDerWaalsContact O-N 3.08Å; L100-E103 PolarHBondContact O-N 3.01Å; D101-E103 VanDerWaalsContact C-N 3.28Å; D101-E103 PolarHBondContact O-N 3.4Å; E103-R105 PolarHBondContact O-N 2.9Å; E103-T106 PolarHBondContact O-N 3.04Å; E103-L107 HydrophobicContact CG-CD1 3.76Å; E103-L107 HydrophobicContact CG-CG 4.32Å; E103-L107 WeakPolarHBondContact O-CB 3.34Å; E103-L107 WeakPolarHBondContact O-CG 3.47Å; E103-L107 PolarHBondContact O-N 3.38Å; E103-L107 WeakPolarHBondContact OE1-CD1 3.48Å
104	I	92.9	Very high	86.7	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-55.9	-42.5	175.7	-74.3	170.3	0	0	0	110.6	L78 L100 D101 N108 F109 Q111 L151 Y154	L78-I104 HydrophobicContact CD1-CG1 3.66Å; L78-I104 HydrophobicContact CD2-CG1 4.46Å; L100-I104 HydrophobicContact CD1-CD1 4.24Å; L100-I104 HydrophobicContact CD1-CG1 4.37Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CB 3.39Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3.29Å; L100-I104 PolarHBondContact O-N 3.4Å; D101-I104 PolarHBondContact O-N 2.93Å; I104-N108 PolarHBondContact O-N 2.87Å; I104-F109 HydrophobicContact CG2-CB 3.91Å; I104-F109 PolarHBondContact O-N 3.4Å; I104-Q111 HydrophobicContact CG2-CB 4.31Å; I104-L151 HydrophobicContact CD1-CD1 4.38Å; I104-Y154 HydrophobicContact CD1-CD1 4.11Å; I104-Y154 HydrophobicContact CD1-CE1 3.4Å
105	R	91.4	Very high	85.4	Confident	166 Å²	166	67.9 Å²	67.9	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-65.8	-47.3	177.1	-174.9	177.8	175.6	-147.3	-0.7	111.9	D101 E103 L107 N108	D101-R105 WeakPolarHBondContact O-CB 3.36Å; D101-R105 PolarHBondContact O-N 3.46Å; E103-R105 PolarHBondContact O-N 2.9Å; R105-L107 VanDerWaalsContact C-N 3.31Å; R105-L107 PolarHBondContact O-N 3.27Å; R105-N108 PolarHBondContact O-N 2.92Å
106	T	91.9	Very high	84.9	Confident	102 Å²	102	64.9 Å²	64.9	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-61.1	-40.9	179.7	-59.4	0	0	0	0	111.8	N102 E103 N108	N102-T106 WeakPolarHBondContact O-CB 3.33Å; N102-T106 PolarHBondContact O-N 2.88Å; N102-T106 PolarHBondContact O-OG1 3.49Å; E103-T106 PolarHBondContact O-N 3.04Å; T106-N108 VanDerWaalsContact C-N 3.29Å; T106-N108 PolarHBondContact O-N 2.85Å
107	L	91.7	Very high	84.6	Confident	13 Å²	13	67.2 Å²	67.2	7%	0.068	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	4.7	-179.7	-63.5	175.5	0	0	0	113.5	D74 K77 L78 E103 R105 F109 K122	D74-L107 HydrophobicContact CB-CD2 4.43Å; D74-L107 WeakPolarHBondContact O-CD1 3.26Å; K77-L107 HydrophobicContact CB-CD1 4.06Å; K77-L107 HydrophobicContact CB-CD2 4.35Å; K77-L107 HydrophobicContact CD-CD2 4.18Å; L78-L107 HydrophobicContact CB-CD1 3.78Å; E103-L107 HydrophobicContact CG-CD1 3.76Å; E103-L107 HydrophobicContact CG-CG 4.32Å; E103-L107 WeakPolarHBondContact O-CB 3.34Å; E103-L107 WeakPolarHBondContact O-CG 3.47Å; E103-L107 PolarHBondContact O-N 3.38Å; E103-L107 WeakPolarHBondContact OE1-CD1 3.48Å; R105-L107 VanDerWaalsContact C-N 3.31Å; R105-L107 PolarHBondContact O-N 3.27Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 HydrophobicContact CB-CD2 3.58Å; L107-F109 HydrophobicContact CB-CE2 3.8Å; L107-F109 HydrophobicContact CD1-CD2 4.48Å; L107-F109 HydrophobicContact CD1-CE2 4.33Å; L107-F109 PolarHBondContact O-N 2.8Å; L107-K122 PolarHBondContact O-NZ 3.02Å
108	N	90.9	Very high	84.4	Confident	92 Å²	92	70.8 Å²	70.8	49%	0.492	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	39.3	179.7	-66.7	-50.2	0	0	0	114.6	I104 R105 T106 K119	I104-N108 PolarHBondContact O-N 2.87Å; R105-N108 PolarHBondContact O-N 2.92Å; T106-N108 VanDerWaalsContact C-N 3.29Å; T106-N108 PolarHBondContact O-N 2.85Å; N108-K119 WeakPolarHBondContact O-CG 3.27Å
109	F	91.9	Very high	84.3	Confident	1 Å²	1	67.8 Å²	67.8	0%	0.004	34%	0.34	C	S	.	.			trans	-88.5	161.2	170.3	-79	-76.1	0	0	0	111.4	D74 R75 L78 I104 L107 Q111 K122 D123	D74-F109 HydrophobicContact CB-CE2 4.09Å; D74-F109 HydrophobicContact CB-CZ 4.29Å; R75-F109 HydrophobicContact CB-CE1 4.45Å; R75-F109 HydrophobicContact CB-CZ 3.83Å; R75-F109 HydrophobicContact CG-CZ 4.43Å; L78-F109 HydrophobicContact CB-CD2 4.46Å; L78-F109 HydrophobicContact CB-CE2 4.19Å; L78-F109 HydrophobicContact CD2-CB 4.45Å; L78-F109 HydrophobicContact CD2-CD1 4.38Å; L78-F109 HydrophobicContact CD2-CD2 3.74Å; L78-F109 HydrophobicContact CD2-CE2 4.04Å; L78-F109 HydrophobicContact CD2-CG 3.93Å; I104-F109 HydrophobicContact CG2-CB 3.91Å; I104-F109 PolarHBondContact O-N 3.4Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 HydrophobicContact CB-CD2 3.58Å; L107-F109 HydrophobicContact CB-CE2 3.8Å; L107-F109 HydrophobicContact CD1-CD2 4.48Å; L107-F109 HydrophobicContact CD1-CE2 4.33Å; L107-F109 PolarHBondContact O-N 2.8Å; F109-Q111 PolarHBondContact O-N 3.19Å; F109-K122 HydrophobicContact CE1-CG 4.24Å; F109-D123 HydrophobicContact CD1-CB 4.03Å; F109-D123 HydrophobicContact CE1-CB 4.4Å
110	P	87.3	Confident	84.3	Confident	8 Å²	8	65.9 Å²	65.9	5%	0.052	33%	0.331	C	S	.	.			trans	-68.3	134.3	-175.6	25.5	-32	0	0	0	111.8	Q116 K119 R120 D123	P110-Q116 VanDerWaalsContact CA-OE1 3.23Å; P110-K119 HydrophobicContact CB-CB 4.23Å; P110-R120 HydrophobicContact CB-CG 4.12Å; P110-R120 HydrophobicContact CG-CG 4.46Å; P110-D123 HydrophobicContact CG-CB 3.93Å
111	Q	77	Confident	84.2	Confident	62 Å²	62	66.5 Å²	66.5	29%	0.29	33%	0.334	S	S	.	.			trans	-121.5	-36.1	-178.1	-164.1	171.1	16.4	0	0	112.8	D101 I104 F109	D101-Q111 PolarHBondContact OD1-NE2 3.24Å; I104-Q111 HydrophobicContact CG2-CB 4.31Å; F109-Q111 PolarHBondContact O-N 3.19Å
112	D	68.7	Low	84.3	Confident	96 Å²	96	66 Å²	66	51%	0.513	33%	0.33	S	S	.	.	S	Bend	trans	-129.9	167.8	-173.5	-52.7	-45.6	0	0	0	113
113	A	59.6	Low	84.4	Confident	49 Å²	49	61.5 Å²	61.5	41%	0.405	31%	0.306	S	S	.	.	S	Bend	trans	-73.6	-23.4	-173.9	0	0	0	0	0	115.2	R120 E163	A113-R120 PolarHBondContact O-NH2 3.43Å; A113-E163 WeakPolarHBondContact CB-OE1 3.5Å
114	K	62.6	Low	84.5	Confident	185 Å²	185	59 Å²	59	80%	0.804	30%	0.295	S	S	*	.	S	Bend	trans	-105.2	127.3	-170.6	-65.5	-174.9	-178.4	179.1	0	113.3	Q116	K114-Q116 WeakPolarHBondContact O-CG 3.49Å
115	D	61.5	Low	84.6	Confident	157 Å²	157	59.2 Å²	59.2	84%	0.84	30%	0.296	S	S	*	.	S	Bend	trans	50.9	56.7	168.5	-154	15.2	0	0	0	115.9
116	Q	78.7	Confident	84.8	Confident	21 Å²	21	51.3 Å²	51.3	10%	0.098	27%	0.266	C	S	.	.			trans	-124.7	32.2	179	-58.2	-157.3	9.6	0	0	113.1	P110 K114 E118 K119 R120	P110-Q116 VanDerWaalsContact CA-OE1 3.23Å; K114-Q116 WeakPolarHBondContact O-CG 3.49Å; Q116-E118 VanDerWaalsContact C-N 3.33Å; Q116-E118 PolarHBondContact O-N 3.31Å; Q116-K119 HydrophobicContact CB-CB 4.22Å; Q116-K119 HydrophobicContact CB-CD 4.2Å; Q116-K119 HydrophobicContact CG-CD 4.26Å; Q116-K119 PolarHBondContact O-N 3.33Å; Q116-K119 VanDerWaalsContact OE1-CD 3.26Å; Q116-R120 WeakPolarHBondContact O-CG 3.26Å; Q116-R120 PolarHBondContact O-N 3.35Å
117	T	85	Confident	85.1	Confident	52 Å²	52	46.5 Å²	46.5	32%	0.319	24%	0.236	S	C	.	.	H	α-helix	trans	-53.9	-45.3	-175.2	-56	0	0	0	0	112.8	Y48 K119 R120 R121	Y48-T117 HydrophobicContact CD2-CG2 4Å; Y48-T117 HydrophobicContact CG-CG2 4.44Å; T117-K119 PolarHBondContact O-N 3.49Å; T117-R120 PolarHBondContact O-N 2.99Å; T117-R121 WeakPolarHBondContact O-CB 3.17Å; T117-R121 PolarHBondContact O-N 3.38Å
118	E	87.8	Confident	85.2	Confident	118 Å²	118	47.6 Å²	47.6	55%	0.551	24%	0.24	S	C	*	.	H	α-helix	trans	-67.6	-34.9	178.5	-72	-54.5	126.3	0	0	113.1	Q116 R121 K122	Q116-E118 VanDerWaalsContact C-N 3.33Å; Q116-E118 PolarHBondContact O-N 3.31Å; E118-R121 WeakPolarHBondContact O-CB 3.44Å; E118-R121 PolarHBondContact O-N 2.96Å; E118-R121 IonicContact OE2-NH1 2.75Å; E118-K122 WeakPolarHBondContact O-CB 3.41Å; E118-K122 PolarHBondContact O-N 3.21Å
119	K	90.9	Very high	85.4	Confident	62 Å²	62	43.5 Å²	43.5	27%	0.27	22%	0.219	S	C	.	.	H	α-helix	trans	-68.7	-38.4	174.8	-60.2	-179	172.9	-178.4	0	111.1	N108 P110 Q116 T117 K122 D123	N108-K119 WeakPolarHBondContact O-CG 3.27Å; P110-K119 HydrophobicContact CB-CB 4.23Å; Q116-K119 HydrophobicContact CB-CB 4.22Å; Q116-K119 HydrophobicContact CB-CD 4.2Å; Q116-K119 HydrophobicContact CG-CD 4.26Å; Q116-K119 PolarHBondContact O-N 3.33Å; Q116-K119 VanDerWaalsContact OE1-CD 3.26Å; T117-K119 PolarHBondContact O-N 3.49Å; K119-K122 PolarHBondContact O-N 2.93Å; K119-D123 WeakPolarHBondContact O-CB 3.4Å; K119-D123 PolarHBondContact O-N 2.89Å
120	R	90.2	Very high	85.5	Confident	18 Å²	18	43.5 Å²	43.5	7%	0.068	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-40.1	174	-67.7	172.8	-172.1	176.6	-1	111.5	Y48 S49 Q50 P110 A113 Q116 T117 D123 H124	Y48-R120 HydrophobicContact CD1-CB 3.93Å; Y48-R120 HydrophobicContact CG-CB 4.17Å; Y48-R120 WeakPolarHBondContact O-CD 3.46Å; Y48-R120 PolarHBondContact O-NH1 3.43Å; S49-R120 PolarHBondContact O-NH1 3.23Å; Q50-R120 WeakPolarHBondContact O-CD 3.49Å; P110-R120 HydrophobicContact CB-CG 4.12Å; P110-R120 HydrophobicContact CG-CG 4.46Å; A113-R120 PolarHBondContact O-NH2 3.43Å; Q116-R120 WeakPolarHBondContact O-CG 3.26Å; Q116-R120 PolarHBondContact O-N 3.35Å; T117-R120 PolarHBondContact O-N 2.99Å; R120-D123 PolarHBondContact O-N 3.35Å; R120-H124 WeakPolarHBondContact O-CB 3.15Å; R120-H124 PolarHBondContact O-N 3.39Å
121	R	91.8	Very high	85.8	Confident	13 Å²	13	43.7 Å²	43.7	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-58.2	-50.8	171.1	176.7	-179.1	174.9	-90	3.4	111.4	Y48 E61 E67 T117 E118 D123 H124 I125	Y48-R121 HydrophobicContact CD2-CB 4.35Å; Y48-R121 HydrophobicContact CE1-CB 4.26Å; Y48-R121 HydrophobicContact CE2-CB 3.8Å; Y48-R121 HydrophobicContact CE2-CG 4.17Å; E61-R121 VanDerWaalsContact CD-NE 3.26Å; E61-R121 VanDerWaalsContact CD-NH2 3.28Å; E61-R121 IonicContact OE1-CZ 2.86Å; E61-R121 IonicContact OE1-NE 3.67Å; E61-R121 PolarHBondContact OE1-NE 3.13Å; E61-R121 VanDerWaalsContact OE1-NE 3.16Å; E61-R121 IonicContact OE1-NH2 3.29Å; E61-R121 PolarHBondContact OE1-NH2 3.08Å; E61-R121 IonicContact OE2-CZ 2.62Å; E61-R121 IonicContact OE2-NE 2.76Å; E61-R121 PolarHBondContact OE2-NE 2.89Å; E61-R121 IonicContact OE2-NH2 2.72Å; E67-R121 IonicContact OE1-NH1 3.51Å; E67-R121 PolarHBondContact OE1-NH1 3.25Å; E67-R121 IonicContact OE1-NH2 2.78Å; T117-R121 WeakPolarHBondContact O-CB 3.17Å; T117-R121 PolarHBondContact O-N 3.38Å; E118-R121 WeakPolarHBondContact O-CB 3.44Å; E118-R121 PolarHBondContact O-N 2.96Å; E118-R121 IonicContact OE2-NH1 2.75Å; R121-D123 VanDerWaalsContact C-N 3.34Å; R121-D123 PolarHBondContact O-N 3.02Å; R121-H124 PolarHBondContact O-N 3.39Å; R121-I125 HydrophobicContact CG-CD1 3.63Å; R121-I125 HydrophobicContact CG-CG1 4.44Å; R121-I125 WeakPolarHBondContact O-CB 3.05Å; R121-I125 VanDerWaalsContact O-CG1 3.31Å; R121-I125 WeakPolarHBondContact O-CG1 3.28Å; R121-I125 PolarHBondContact O-N 2.95Å
122	K	93.8	Very high	86.6	Confident	18 Å²	18	42.5 Å²	42.5	8%	0.078	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-47.3	175.4	178.7	178.4	-177.8	177.7	0	111.5	F71 D74 L107 F109 E118 K119 S126	F71-K122 HydrophobicContact CD1-CD 4.14Å; F71-K122 HydrophobicContact CD1-CG 3.8Å; F71-K122 HydrophobicContact CD2-CG 4.37Å; F71-K122 HydrophobicContact CE1-CB 4.3Å; F71-K122 HydrophobicContact CE1-CD 4.1Å; F71-K122 HydrophobicContact CE1-CG 3.87Å; F71-K122 HydrophobicContact CE2-CB 4.37Å; F71-K122 HydrophobicContact CE2-CG 4.44Å; F71-K122 HydrophobicContact CG-CG 4.06Å; F71-K122 HydrophobicContact CZ-CB 4.17Å; F71-K122 HydrophobicContact CZ-CG 4.2Å; D74-K122 WeakPolarHBondContact OD2-CE 3.47Å; D74-K122 IonicContact OD2-NZ 2.8Å; D74-K122 PolarHBondContact OD2-NZ 3.15Å; L107-K122 PolarHBondContact O-NZ 3.02Å; F109-K122 HydrophobicContact CE1-CG 4.24Å; E118-K122 WeakPolarHBondContact O-CB 3.41Å; E118-K122 PolarHBondContact O-N 3.21Å; K119-K122 PolarHBondContact O-N 2.93Å; K122-S126 WeakPolarHBondContact O-CB 3.31Å; K122-S126 PolarHBondContact O-N 3.02Å; K122-S126 PolarHBondContact O-OG 3.13Å
123	D	94.6	Very high	87.6	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-59.7	-48.3	178.6	-173.6	65.5	0	0	0	112.5	Y55 R75 F109 P110 K119 R120 R121 S126 H127 R155	Y55-D123 WeakPolarHBondContact CE1-OD2 3.35Å; Y55-D123 VanDerWaalsContact OH-CG 3.32Å; Y55-D123 PolarHBondContact OH-OD1 3Å; Y55-D123 PolarHBondContact OH-OD2 2.78Å; R75-D123 IonicContact CZ-OD1 2.84Å; R75-D123 PolarHBondContact NH1-O 2.95Å; R75-D123 IonicContact NH1-OD1 3.7Å; R75-D123 PolarHBondContact NH1-OD1 3.02Å; R75-D123 IonicContact NH2-OD1 2.87Å; F109-D123 HydrophobicContact CD1-CB 4.03Å; F109-D123 HydrophobicContact CE1-CB 4.4Å; P110-D123 HydrophobicContact CG-CB 3.93Å; K119-D123 WeakPolarHBondContact O-CB 3.4Å; K119-D123 PolarHBondContact O-N 2.89Å; R120-D123 PolarHBondContact O-N 3.35Å; R121-D123 VanDerWaalsContact C-N 3.34Å; R121-D123 PolarHBondContact O-N 3.02Å; D123-S126 PolarHBondContact O-OG 3Å; D123-H127 WeakPolarHBondContact O-CB 3.5Å; D123-H127 PolarHBondContact O-N 2.93Å; D123-R155 IonicContact OD1-CZ 2.72Å; D123-R155 IonicContact OD1-NH1 3.89Å; D123-R155 PolarHBondContact OD1-NH1 2.92Å; D123-R155 IonicContact OD1-NH2 3.62Å; D123-R155 PolarHBondContact OD1-NH2 2.91Å; D123-R155 IonicContact OD2-CZ 3.45Å; D123-R155 IonicContact OD2-NH1 3.9Å; D123-R155 PolarHBondContact OD2-NH1 2.98Å; D123-R155 IonicContact OD2-NH2 3.63Å
124	H	94.7	Very high	89.1	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-50.3	179	-179	-155.1	0	0	0	112	Y48 Q57 R120 R121 H127 F128	Y48-H124 HydrophobicContact CE1-CB 3.73Å; Y48-H124 AromaticContact CE1-CG 3.99Å; Y48-H124 AromaticContact CE1-ND1 3.46Å; Y48-H124 WeakPolarHBondContact CE1-ND1 3.19Å; Y48-H124 AromaticContact CZ-ND1 3.91Å; Q57-H124 PolarHBondContact O-CE1 2.9Å; Q57-H124 PolarHBondContact O-NE2 2.85Å; R120-H124 WeakPolarHBondContact O-CB 3.15Å; R120-H124 PolarHBondContact O-N 3.39Å; R121-H124 PolarHBondContact O-N 3.39Å; H124-H127 PolarHBondContact O-N 3.22Å; H124-F128 AromaticContact CD2-CD2 3.64Å; H124-F128 AromaticContact CD2-CE2 3.52Å; H124-F128 AromaticContact NE2-CD2 3.75Å; H124-F128 AromaticContact NE2-CE2 3.34Å; H124-F128 VanDerWaalsContact NE2-CE2 3.34Å; H124-F128 WeakPolarHBondContact NE2-CE2 3.39Å; H124-F128 WeakPolarHBondContact O-CD2 3.34Å; H124-F128 PolarHBondContact O-N 3.33Å
125	I	95.4	Very high	90.5	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.031	13%	0.133	C	C	.	.	H	α-helix	trans	-65.7	-48.8	-177.6	-66.4	174	0	0	0	110.9	P59 I63 F71 R121 H127 F128 I129	P59-I125 HydrophobicContact CB-CG1 3.86Å; P59-I125 HydrophobicContact CG-CG1 4.12Å; I63-I125 HydrophobicContact CD1-CG2 3.73Å; I63-I125 HydrophobicContact CG2-CD1 3.99Å; F71-I125 HydrophobicContact CD2-CB 4.13Å; F71-I125 HydrophobicContact CD2-CG2 3.84Å; F71-I125 HydrophobicContact CE2-CB 4.46Å; F71-I125 HydrophobicContact CE2-CD1 4.35Å; F71-I125 HydrophobicContact CE2-CG2 4.39Å; R121-I125 HydrophobicContact CG-CD1 3.63Å; R121-I125 HydrophobicContact CG-CG1 4.44Å; R121-I125 WeakPolarHBondContact O-CB 3.05Å; R121-I125 VanDerWaalsContact O-CG1 3.31Å; R121-I125 WeakPolarHBondContact O-CG1 3.28Å; R121-I125 PolarHBondContact O-N 2.95Å; I125-H127 PolarHBondContact O-N 3.12Å; I125-F128 PolarHBondContact O-N 2.89Å; I125-F128 VanDerWaalsContact O-N 3.07Å; I125-I129 HydrophobicContact CG2-CD1 3.72Å; I125-I129 HydrophobicContact CG2-CG1 4.21Å; I125-I129 WeakPolarHBondContact O-CG1 3.34Å; I125-I129 PolarHBondContact O-N 3.27Å
126	S	95.6	Very high	91.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.6	-35.8	-179	59.5	0	0	0	0	112.8	F71 R75 K122 D123 I129 L130	F71-S126 VanDerWaalsContact O-CB 3.24Å; F71-S126 WeakPolarHBondContact O-CB 3.47Å; R75-S126 WeakPolarHBondContact CD-O 3.27Å; R75-S126 WeakPolarHBondContact CD-OG 3.39Å; R75-S126 PolarHBondContact NH1-OG 3.12Å; K122-S126 WeakPolarHBondContact O-CB 3.31Å; K122-S126 PolarHBondContact O-N 3.02Å; K122-S126 PolarHBondContact O-OG 3.13Å; D123-S126 PolarHBondContact O-OG 3Å; S126-I129 PolarHBondContact O-N 3.43Å; S126-L130 PolarHBondContact O-N 3.12Å
127	H	96.7	Very high	91.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-48.6	174.5	-178.1	74.7	0	0	0	111.7	Y55 R75 D123 H124 I125 L130 R131 F144 E148 L250	Y55-H127 WeakPolarHBondContact CB-CD2 3.48Å; Y55-H127 HydrophobicContact CD1-CB 4.15Å; Y55-H127 HydrophobicContact CD2-CB 4.4Å; Y55-H127 AromaticContact CD2-CD2 3.5Å; Y55-H127 AromaticContact CD2-CE1 3.61Å; Y55-H127 AromaticContact CD2-CG 3.61Å; Y55-H127 AromaticContact CD2-ND1 3.7Å; Y55-H127 AromaticContact CD2-NE2 3.51Å; Y55-H127 HydrophobicContact CE1-CB 4.21Å; Y55-H127 HydrophobicContact CE2-CB 4.47Å; Y55-H127 AromaticContact CE2-CG 3.94Å; Y55-H127 AromaticContact CE2-ND1 3.82Å; Y55-H127 HydrophobicContact CG-CB 4.23Å; Y55-H127 AromaticContact CG-CD2 3.39Å; Y55-H127 AromaticContact CG-CG 3.71Å; Y55-H127 AromaticContact CG-NE2 3.8Å; R75-H127 VanDerWaalsContact CD-N 3.35Å; R75-H127 VanDerWaalsContact CZ-CB 3.49Å; R75-H127 PolarHBondContact NH2-ND1 3.45Å; D123-H127 WeakPolarHBondContact O-CB 3.5Å; D123-H127 PolarHBondContact O-N 2.93Å; H124-H127 PolarHBondContact O-N 3.22Å; I125-H127 PolarHBondContact O-N 3.12Å; H127-L130 PolarHBondContact O-N 2.88Å; H127-R131 PolarHBondContact CD2-NE 3.46Å; H127-R131 VanDerWaalsContact CD2-NE 3.29Å; H127-R131 PolarHBondContact CD2-NH2 3.42Å; H127-R131 PolarHBondContact NE2-NE 3.08Å; H127-R131 PolarHBondContact NE2-NH2 2.92Å; H127-R131 WeakPolarHBondContact O-CG 3.14Å; H127-R131 PolarHBondContact O-N 2.65Å; H127-R131 VanDerWaalsContact O-N 3.09Å; H127-F144 AromaticContact CE1-CZ 3.82Å; H127-F144 AromaticContact ND1-CZ 3.79Å; H127-E148 IonicContact CE1-OE1 3.73Å; H127-E148 IonicContact CE1-OE2 2.95Å; H127-E148 IonicContact CG-OE1 2.93Å; H127-E148 IonicContact ND1-OE1 2.94Å; H127-E148 PolarHBondContact ND1-OE1 3.35Å; H127-E148 IonicContact ND1-OE2 3.34Å; H127-E148 PolarHBondContact ND1-OE2 2.75Å; H127-L250 WeakPolarHBondContact NE2-CD1 3.44Å
128	F	95.6	Very high	91.9	Very high	36 Å²	36	27.7 Å²	27.7	16%	0.158	13%	0.132	C	C	.	.	H	α-helix	trans	-68.2	-33.7	179.5	-85.1	-89.9	0	0	0	112.8	Y55 Q57 P58 P59 H124 I125 R131	Y55-F128 WeakPolarHBondContact O-CZ 3.25Å; Q57-F128 VanDerWaalsContact O-CE2 3.3Å; Q57-F128 WeakPolarHBondContact O-CE2 3.2Å; Q57-F128 VanDerWaalsContact O-CZ 3.27Å; Q57-F128 WeakPolarHBondContact O-CZ 3.15Å; P58-F128 HydrophobicContact CB-CD1 4.18Å; P58-F128 HydrophobicContact CB-CE1 3.83Å; P58-F128 HydrophobicContact CB-CZ 4.29Å; P59-F128 HydrophobicContact CG-CB 4.31Å; P59-F128 HydrophobicContact CG-CG 4.47Å; H124-F128 AromaticContact CD2-CD2 3.64Å; H124-F128 AromaticContact CD2-CE2 3.52Å; H124-F128 AromaticContact NE2-CD2 3.75Å; H124-F128 AromaticContact NE2-CE2 3.34Å; H124-F128 VanDerWaalsContact NE2-CE2 3.34Å; H124-F128 WeakPolarHBondContact NE2-CE2 3.39Å; H124-F128 WeakPolarHBondContact O-CD2 3.34Å; H124-F128 PolarHBondContact O-N 3.33Å; I125-F128 PolarHBondContact O-N 2.89Å; I125-F128 VanDerWaalsContact O-N 3.07Å; F128-R131 VanDerWaalsContact CE1-NH1 3.33Å; F128-R131 WeakPolarHBondContact O-CB 3.41Å; F128-R131 PolarHBondContact O-N 2.92Å
129	I	93.6	Very high	91.5	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.036	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-48.9	173.2	-64.1	169.9	0	0	0	110.4	I63 F68 F71 A72 I125 S126 R131 L132	I63-I129 HydrophobicContact CD1-CD1 4.03Å; F68-I129 HydrophobicContact CB-CD1 4.38Å; F68-I129 HydrophobicContact CD1-CG2 4.21Å; F68-I129 HydrophobicContact CD2-CD1 3.68Å; F68-I129 HydrophobicContact CD2-CG1 3.81Å; F68-I129 HydrophobicContact CD2-CG2 4.35Å; F68-I129 HydrophobicContact CE1-CG2 3.64Å; F68-I129 HydrophobicContact CE2-CB 4.29Å; F68-I129 HydrophobicContact CE2-CD1 4.06Å; F68-I129 HydrophobicContact CE2-CG1 3.67Å; F68-I129 HydrophobicContact CE2-CG2 3.81Å; F68-I129 HydrophobicContact CG-CD1 3.95Å; F68-I129 HydrophobicContact CG-CG1 4.46Å; F68-I129 HydrophobicContact CZ-CB 4.35Å; F68-I129 HydrophobicContact CZ-CG1 4.21Å; F68-I129 HydrophobicContact CZ-CG2 3.41Å; F68-I129 VanDerWaalsContact CZ-CG2 3.41Å; F71-I129 HydrophobicContact CB-CD1 4.17Å; A72-I129 HydrophobicContact CB-CG2 3.62Å; I125-I129 HydrophobicContact CG2-CD1 3.72Å; I125-I129 HydrophobicContact CG2-CG1 4.21Å; I125-I129 WeakPolarHBondContact O-CG1 3.34Å; I125-I129 PolarHBondContact O-N 3.27Å; S126-I129 PolarHBondContact O-N 3.43Å; I129-R131 VanDerWaalsContact C-N 3.26Å; I129-R131 PolarHBondContact O-N 3.33Å; I129-L132 VanDerWaalsContact O-CB 3.32Å; I129-L132 WeakPolarHBondContact O-CB 3.11Å; I129-L132 PolarHBondContact O-N 3.26Å
130	L	94.3	Very high	91.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-26	179.4	-68.5	-168.5	0	0	0	113.3	A72 R75 L76 L79 S126 H127 L132 A133 Y134 F144 L277	A72-L130 HydrophobicContact CB-CD2 4.2Å; R75-L130 HydrophobicContact CB-CD1 3.85Å; R75-L130 HydrophobicContact CB-CG 4.48Å; R75-L130 HydrophobicContact CG-CD1 3.68Å; L76-L130 HydrophobicContact CB-CD1 4.14Å; L76-L130 HydrophobicContact CB-CD2 4.34Å; L79-L130 HydrophobicContact CD1-CD1 3.83Å; S126-L130 PolarHBondContact O-N 3.12Å; H127-L130 PolarHBondContact O-N 2.88Å; L130-L132 PolarHBondContact O-N 3.48Å; L130-A133 PolarHBondContact O-N 3.16Å; L130-Y134 HydrophobicContact CB-CD2 4.29Å; L130-Y134 HydrophobicContact CD2-CD2 4.44Å; L130-Y134 HydrophobicContact CD2-CE2 4.21Å; L130-Y134 WeakPolarHBondContact O-CB 3.38Å; L130-Y134 WeakPolarHBondContact O-CD2 3.45Å; L130-Y134 PolarHBondContact O-N 3.02Å; L130-F144 HydrophobicContact CB-CD2 4.32Å; L130-F144 HydrophobicContact CB-CE2 3.54Å; L130-F144 HydrophobicContact CB-CZ 3.95Å; L130-F144 HydrophobicContact CD1-CE2 4.06Å; L130-F144 HydrophobicContact CG-CE2 4.48Å; L130-L277 HydrophobicContact CD2-CD1 4.4Å; L130-L277 HydrophobicContact CD2-CD2 4.41Å
131	R	94.9	Very high	91.4	Very high	13 Å²	13	28.5 Å²	28.5	5%	0.049	14%	0.139	C	C	.	.	H	α-helix	trans	-57.4	-35.2	170.1	-71.3	-176.7	-177.4	-178.4	3.6	112	Y55 H127 F128 I129 C135 F144 L254	Y55-R131 PolarHBondContact O-NH1 2.86Å; Y55-R131 PolarHBondContact O-NH2 3.34Å; H127-R131 PolarHBondContact CD2-NE 3.46Å; H127-R131 VanDerWaalsContact CD2-NE 3.29Å; H127-R131 PolarHBondContact CD2-NH2 3.42Å; H127-R131 PolarHBondContact NE2-NE 3.08Å; H127-R131 PolarHBondContact NE2-NH2 2.92Å; H127-R131 WeakPolarHBondContact O-CG 3.14Å; H127-R131 PolarHBondContact O-N 2.65Å; H127-R131 VanDerWaalsContact O-N 3.09Å; F128-R131 VanDerWaalsContact CE1-NH1 3.33Å; F128-R131 WeakPolarHBondContact O-CB 3.41Å; F128-R131 PolarHBondContact O-N 2.92Å; I129-R131 VanDerWaalsContact C-N 3.26Å; I129-R131 PolarHBondContact O-N 3.33Å; R131-C135 WeakPolarHBondContact O-CB 3.1Å; R131-C135 PolarHBondContact O-N 3.48Å; R131-C135 PolarHBondContact O-SG 2.99Å; R131-F144 HydrophobicContact CG-CE1 3.89Å; R131-F144 HydrophobicContact CG-CZ 4.29Å; R131-L254 HydrophobicContact CB-CD2 3.82Å; R131-L254 HydrophobicContact CG-CD2 3.78Å
132	L	92.1	Very high	91.2	Very high	36 Å²	36	35.1 Å²	35.1	19%	0.188	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-42.9	177.9	-61.7	172.7	0	0	0	111.5	F68 I129 L130 C135 T257 L261 V264 L274	F68-L132 HydrophobicContact CZ-CD1 4.41Å; I129-L132 VanDerWaalsContact O-CB 3.32Å; I129-L132 WeakPolarHBondContact O-CB 3.11Å; I129-L132 PolarHBondContact O-N 3.26Å; L130-L132 PolarHBondContact O-N 3.48Å; L132-C135 PolarHBondContact O-SG 2.89Å; L132-C135 VanDerWaalsContact O-SG 3.33Å; L132-T257 HydrophobicContact CD2-CG2 3.84Å; L132-L261 HydrophobicContact CD2-CD1 4.41Å; L132-V264 HydrophobicContact CD2-CG2 4.47Å; L132-L274 HydrophobicContact CB-CD1 4.02Å; L132-L274 HydrophobicContact CB-CD2 3.59Å; L132-L274 HydrophobicContact CB-CG 4.49Å; L132-L274 HydrophobicContact CD1-CD2 4.49Å
133	A	89.5	Confident	91.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-74.2	-44.2	-179.7	0	0	0	0	0	112.3	L130 C135 Q136 L274 L277	L130-A133 PolarHBondContact O-N 3.16Å; A133-C135 PolarHBondContact O-N 2.93Å; A133-Q136 WeakPolarHBondContact O-CG 3.37Å; A133-Q136 PolarHBondContact O-NE2 3.46Å; A133-L274 HydrophobicContact CB-CD2 4.09Å; A133-L277 HydrophobicContact CB-CB 3.88Å; A133-L277 HydrophobicContact CB-CD1 4.37Å
134	Y	91.6	Very high	91.1	Very high	8 Å²	8	36 Å²	36	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-91.2	3.1	-171.3	-73.5	-98.9	0	0	0	114.2	L76 L130 L140 R141 W143 F144 L277	L76-Y134 HydrophobicContact CD1-CE2 4.03Å; L76-Y134 WeakPolarHBondContact CD1-OH 3.45Å; L130-Y134 HydrophobicContact CB-CD2 4.29Å; L130-Y134 HydrophobicContact CD2-CD2 4.44Å; L130-Y134 HydrophobicContact CD2-CE2 4.21Å; L130-Y134 WeakPolarHBondContact O-CB 3.38Å; L130-Y134 WeakPolarHBondContact O-CD2 3.45Å; L130-Y134 PolarHBondContact O-N 3.02Å; Y134-L140 HydrophobicContact CD1-CB 3.95Å; Y134-L140 HydrophobicContact CD1-CD2 3.78Å; Y134-L140 HydrophobicContact CD1-CG 4.43Å; Y134-L140 HydrophobicContact CE1-CD2 3.73Å; Y134-L140 CarbonylContact O-C 3.59Å; Y134-R141 WeakPolarHBondContact O-CA 3.46Å; Y134-R141 WeakPolarHBondContact O-CG 3.4Å; Y134-R141 PolarHBondContact O-N 3.39Å; Y134-R141 VanDerWaalsContact O-N 3.16Å; Y134-W143 AromaticContact CD1-CE3 3.69Å; Y134-W143 HydrophobicContact CD1-CE3 3.69Å; Y134-W143 HydrophobicContact CD1-CZ3 4.06Å; Y134-W143 HydrophobicContact CE1-CD2 4.35Å; Y134-W143 AromaticContact CE1-CE3 3.32Å; Y134-W143 HydrophobicContact CE1-CE3 3.32Å; Y134-W143 AromaticContact CE1-CZ3 3.44Å; Y134-W143 HydrophobicContact CE1-CZ3 3.44Å; Y134-W143 VanDerWaalsContact CE1-CZ3 3.44Å; Y134-W143 AromaticContact CZ-CZ3 3.83Å; Y134-F144 HydrophobicContact CD1-CB 3.88Å; Y134-F144 HydrophobicContact CD2-CD2 4.46Å; Y134-F144 HydrophobicContact CG-CB 3.9Å; Y134-F144 HydrophobicContact CG-CD2 4.2Å; Y134-F144 HydrophobicContact CG-CG 4.17Å; Y134-L277 PolarHBondContact OH-O 3.35Å
135	C	92	Very high	91.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.1	172.8	72.8	0	0	0	0	114.3	R131 L132 A133 R141 L254 T257 A258	R131-C135 WeakPolarHBondContact O-CB 3.1Å; R131-C135 PolarHBondContact O-N 3.48Å; R131-C135 PolarHBondContact O-SG 2.99Å; L132-C135 PolarHBondContact O-SG 2.89Å; L132-C135 VanDerWaalsContact O-SG 3.33Å; A133-C135 PolarHBondContact O-N 2.93Å; C135-R141 VanDerWaalsContact O-CZ 3.23Å; C135-R141 PolarHBondContact O-NE 2.88Å; C135-R141 PolarHBondContact O-NH2 2.91Å; C135-L254 HydrophobicContact CB-CB 4.39Å; C135-L254 HydrophobicContact CB-CD2 3.99Å; C135-T257 HydrophobicContact CB-CG2 4.41Å; C135-A258 HydrophobicContact CB-CB 4.06Å; C135-A258 WeakPolarHBondContact O-CB 3.13Å
136	Q	85.6	Confident	91.2	Very high	56 Å²	56	39.3 Å²	39.3	26%	0.262	18%	0.182	S	C	.	.	S	Bend	trans	-69.1	-50.6	-170.8	-64.6	176.2	21.6	0	0	113.6	A133 L140 L261	A133-Q136 WeakPolarHBondContact O-CG 3.37Å; A133-Q136 PolarHBondContact O-NE2 3.46Å; Q136-L140 HydrophobicContact CB-CD1 4.27Å; Q136-L261 HydrophobicContact CG-CD2 3.85Å
137	T	85.1	Confident	91.2	Very high	66 Å²	66	40 Å²	40	41%	0.405	19%	0.185	S	C	.	.	S	Bend	trans	-120.9	159.7	-178	68.8	0	0	0	0	111.2	D139 L140 R141	T137-D139 VanDerWaalsContact C-N 3.31Å; T137-D139 PolarHBondContact O-N 3.27Å; T137-L140 HydrophobicContact CG2-CD1 4.45Å; T137-L140 PolarHBondContact O-N 3.14Å; T137-L140 WeakPolarHBondContact OG1-CB 3.5Å; T137-L140 WeakPolarHBondContact OG1-CD1 3.32Å; T137-L140 VanDerWaalsContact OG1-CG 3.27Å; T137-L140 WeakPolarHBondContact OG1-CG 3.46Å; T137-L140 PolarHBondContact OG1-N 2.97Å; T137-R141 WeakPolarHBondContact O-CG 3.1Å; T137-R141 PolarHBondContact O-N 3.5Å; T137-R141 VanDerWaalsContact O-N 3.08Å
138	E	85.1	Confident	91.2	Very high	120 Å²	120	40.1 Å²	40.1	56%	0.561	19%	0.186	S	C	*	.	H	α-helix	trans	-61.4	-39.4	177.1	-72.3	-153.3	167.4	0	0	112.8	R141 R142	E138-R141 PolarHBondContact O-N 3.09Å; E138-R142 WeakPolarHBondContact O-CB 3.19Å; E138-R142 VanDerWaalsContact O-CG 3.28Å; E138-R142 WeakPolarHBondContact O-CG 3.27Å; E138-R142 PolarHBondContact O-N 3.33Å; E138-R142 IonicContact OE2-CZ 3.9Å; E138-R142 IonicContact OE2-NE 3.78Å; E138-R142 IonicContact OE2-NH2 3.88Å; E138-R142 PolarHBondContact OE2-NH2 3.17Å
139	D	79.1	Confident	91.2	Very high	121 Å²	121	39.1 Å²	39.1	65%	0.647	18%	0.182	S	C	*	.	H	α-helix	trans	-65	-43.2	-178.9	-65.4	-31.8	0	0	0	111.5	T137 R141 R142 W143	T137-D139 VanDerWaalsContact C-N 3.31Å; T137-D139 PolarHBondContact O-N 3.27Å; D139-R141 VanDerWaalsContact C-N 3.35Å; D139-R141 PolarHBondContact O-N 3.16Å; D139-R142 PolarHBondContact O-N 3.21Å; D139-W143 WeakPolarHBondContact O-CB 3.34Å; D139-W143 PolarHBondContact O-N 3.02Å
140	L	86.8	Confident	91.3	Very high	28 Å²	28	39.4 Å²	39.4	15%	0.147	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-42.8	174.2	-70.4	173	0	0	0	111.4	Y134 Q136 T137 W143 F144	Y134-L140 HydrophobicContact CD1-CB 3.95Å; Y134-L140 HydrophobicContact CD1-CD2 3.78Å; Y134-L140 HydrophobicContact CD1-CG 4.43Å; Y134-L140 HydrophobicContact CE1-CD2 3.73Å; Y134-L140 CarbonylContact O-C 3.59Å; Q136-L140 HydrophobicContact CB-CD1 4.27Å; T137-L140 HydrophobicContact CG2-CD1 4.45Å; T137-L140 PolarHBondContact O-N 3.14Å; T137-L140 WeakPolarHBondContact OG1-CB 3.5Å; T137-L140 WeakPolarHBondContact OG1-CD1 3.32Å; T137-L140 VanDerWaalsContact OG1-CG 3.27Å; T137-L140 WeakPolarHBondContact OG1-CG 3.46Å; T137-L140 PolarHBondContact OG1-N 2.97Å; L140-W143 PolarHBondContact O-N 3.3Å; L140-F144 WeakPolarHBondContact O-CB 3.45Å; L140-F144 PolarHBondContact O-N 3.09Å
141	R	91.6	Very high	91.3	Very high	65 Å²	65	39.5 Å²	39.5	25%	0.245	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-47.2	176.8	-70.8	177.9	-162.5	166.3	10.8	111.3	Y134 C135 T137 E138 D139 F144 I145 L254	Y134-R141 WeakPolarHBondContact O-CA 3.46Å; Y134-R141 WeakPolarHBondContact O-CG 3.4Å; Y134-R141 PolarHBondContact O-N 3.39Å; Y134-R141 VanDerWaalsContact O-N 3.16Å; C135-R141 VanDerWaalsContact O-CZ 3.23Å; C135-R141 PolarHBondContact O-NE 2.88Å; C135-R141 PolarHBondContact O-NH2 2.91Å; T137-R141 WeakPolarHBondContact O-CG 3.1Å; T137-R141 PolarHBondContact O-N 3.5Å; T137-R141 VanDerWaalsContact O-N 3.08Å; E138-R141 PolarHBondContact O-N 3.09Å; D139-R141 VanDerWaalsContact C-N 3.35Å; D139-R141 PolarHBondContact O-N 3.16Å; R141-F144 PolarHBondContact O-N 3.37Å; R141-I145 WeakPolarHBondContact O-CB 3.32Å; R141-I145 WeakPolarHBondContact O-CD1 3.22Å; R141-I145 WeakPolarHBondContact O-CG1 3.17Å; R141-I145 PolarHBondContact O-N 3.32Å; R141-L254 HydrophobicContact CB-CD1 4.32Å; R141-L254 HydrophobicContact CG-CB 4.36Å; R141-L254 HydrophobicContact CG-CD1 4.29Å
142	R	87.8	Confident	91.4	Very high	153 Å²	153	39.1 Å²	39.1	58%	0.577	18%	0.183	S	C	*	.	H	α-helix	trans	-60.5	-46.4	179.9	-73.5	174	-169.7	-170	7.5	110.8	E138 D139 Q146	E138-R142 WeakPolarHBondContact O-CB 3.19Å; E138-R142 VanDerWaalsContact O-CG 3.28Å; E138-R142 WeakPolarHBondContact O-CG 3.27Å; E138-R142 PolarHBondContact O-N 3.33Å; E138-R142 IonicContact OE2-CZ 3.9Å; E138-R142 IonicContact OE2-NE 3.78Å; E138-R142 IonicContact OE2-NH2 3.88Å; E138-R142 PolarHBondContact OE2-NH2 3.17Å; D139-R142 PolarHBondContact O-N 3.21Å; R142-Q146 WeakPolarHBondContact O-CB 3.5Å; R142-Q146 PolarHBondContact O-N 3.28Å
143	W	91.7	Very high	91.4	Very high	41 Å²	41	40.5 Å²	40.5	16%	0.155	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-52.3	177	-177.2	88.4	0	0	0	111.6	L76 L79 K80 E83 Y134 D139 L140 I145 Q146 Q147	L76-W143 HydrophobicContact CD1-CH2 3.73Å; L76-W143 HydrophobicContact CD1-CZ3 3.91Å; L79-W143 HydrophobicContact CB-CH2 3.8Å; L79-W143 HydrophobicContact CB-CZ3 4.36Å; L79-W143 HydrophobicContact CD1-CZ3 4.47Å; K80-W143 HydrophobicContact CD-CH2 4.37Å; K80-W143 HydrophobicContact CD-CZ2 3.85Å; K80-W143 HydrophobicContact CG-CH2 4.25Å; K80-W143 HydrophobicContact CG-CZ2 4.17Å; E83-W143 PolarHBondContact OE1-NE1 3.25Å; E83-W143 WeakPolarHBondContact OE2-CZ2 3.41Å; E83-W143 PolarHBondContact OE2-NE1 3.35Å; Y134-W143 AromaticContact CD1-CE3 3.69Å; Y134-W143 HydrophobicContact CD1-CE3 3.69Å; Y134-W143 HydrophobicContact CD1-CZ3 4.06Å; Y134-W143 HydrophobicContact CE1-CD2 4.35Å; Y134-W143 AromaticContact CE1-CE3 3.32Å; Y134-W143 HydrophobicContact CE1-CE3 3.32Å; Y134-W143 AromaticContact CE1-CZ3 3.44Å; Y134-W143 HydrophobicContact CE1-CZ3 3.44Å; Y134-W143 VanDerWaalsContact CE1-CZ3 3.44Å; Y134-W143 AromaticContact CZ-CZ3 3.83Å; D139-W143 WeakPolarHBondContact O-CB 3.34Å; D139-W143 PolarHBondContact O-N 3.02Å; L140-W143 PolarHBondContact O-N 3.3Å; W143-I145 PolarHBondContact O-N 2.81Å; W143-Q146 WeakPolarHBondContact O-CB 3.33Å; W143-Q146 PolarHBondContact O-N 2.9Å; W143-Q146 VanDerWaalsContact O-N 3.14Å; W143-Q147 HydrophobicContact CD2-CG 4.04Å; W143-Q147 HydrophobicContact CE3-CG 4.4Å; W143-Q147 HydrophobicContact CH2-CG 4.1Å; W143-Q147 HydrophobicContact CZ2-CG 3.69Å; W143-Q147 HydrophobicContact CZ3-CG 4.44Å; W143-Q147 WeakPolarHBondContact O-CG 3.3Å; W143-Q147 PolarHBondContact O-N 3.29Å
144	F	95.4	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-46	-177.7	179.6	-111.3	0	0	0	112.1	L79 H127 L130 R131 Y134 L140 R141 Q146 Q147 E148 L250 L254	L79-F144 HydrophobicContact CD1-CD2 3.66Å; L79-F144 HydrophobicContact CD1-CE2 3.6Å; H127-F144 AromaticContact CE1-CZ 3.82Å; H127-F144 AromaticContact ND1-CZ 3.79Å; L130-F144 HydrophobicContact CB-CD2 4.32Å; L130-F144 HydrophobicContact CB-CE2 3.54Å; L130-F144 HydrophobicContact CB-CZ 3.95Å; L130-F144 HydrophobicContact CD1-CE2 4.06Å; L130-F144 HydrophobicContact CG-CE2 4.48Å; R131-F144 HydrophobicContact CG-CE1 3.89Å; R131-F144 HydrophobicContact CG-CZ 4.29Å; Y134-F144 HydrophobicContact CD1-CB 3.88Å; Y134-F144 HydrophobicContact CD2-CD2 4.46Å; Y134-F144 HydrophobicContact CG-CB 3.9Å; Y134-F144 HydrophobicContact CG-CD2 4.2Å; Y134-F144 HydrophobicContact CG-CG 4.17Å; L140-F144 WeakPolarHBondContact O-CB 3.45Å; L140-F144 PolarHBondContact O-N 3.09Å; R141-F144 PolarHBondContact O-N 3.37Å; F144-Q146 VanDerWaalsContact C-N 3.29Å; F144-Q146 PolarHBondContact O-N 2.87Å; F144-Q147 PolarHBondContact O-N 3.46Å; F144-E148 HydrophobicContact CD1-CG 4.37Å; F144-E148 HydrophobicContact CD2-CG 4.05Å; F144-E148 HydrophobicContact CE1-CG 4.06Å; F144-E148 HydrophobicContact CE2-CG 3.71Å; F144-E148 WeakPolarHBondContact CE2-OE1 3.32Å; F144-E148 HydrophobicContact CG-CG 4.37Å; F144-E148 HydrophobicContact CZ-CG 3.72Å; F144-E148 WeakPolarHBondContact CZ-OE1 3.33Å; F144-E148 VanDerWaalsContact O-CB 3.31Å; F144-E148 WeakPolarHBondContact O-CB 3.46Å; F144-E148 VanDerWaalsContact O-CG 3.25Å; F144-E148 WeakPolarHBondContact O-CG 3.39Å; F144-E148 PolarHBondContact O-N 3.47Å; F144-L250 HydrophobicContact CE1-CD1 4.16Å; F144-L250 HydrophobicContact CE1-CD2 4.45Å; F144-L254 HydrophobicContact CD1-CD1 3.92Å; F144-L254 HydrophobicContact CD1-CD2 4.1Å; F144-L254 HydrophobicContact CE1-CD2 4.18Å
145	I	96.2	Very high	91.6	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-58.2	-44.2	175.2	-68.9	165	0	0	0	110.5	R141 W143 V149 R247 L250 L254	R141-I145 WeakPolarHBondContact O-CB 3.32Å; R141-I145 WeakPolarHBondContact O-CD1 3.22Å; R141-I145 WeakPolarHBondContact O-CG1 3.17Å; R141-I145 PolarHBondContact O-N 3.32Å; W143-I145 PolarHBondContact O-N 2.81Å; I145-V149 HydrophobicContact CG2-CG2 4.15Å; I145-V149 WeakPolarHBondContact O-CB 3.48Å; I145-V149 WeakPolarHBondContact O-CG2 3.25Å; I145-V149 PolarHBondContact O-N 3.39Å; I145-R247 HydrophobicContact CG2-CG 3.64Å; I145-L250 HydrophobicContact CB-CD2 4.45Å; I145-L250 HydrophobicContact CG1-CD2 4.09Å; I145-L250 HydrophobicContact CG1-CG 4.13Å; I145-L254 HydrophobicContact CD1-CD1 3.87Å; I145-L254 HydrophobicContact CG1-CD1 3.6Å
146	Q	94.4	Very high	91.5	Very high	64 Å²	64	41.3 Å²	41.3	30%	0.299	19%	0.191	S	C	.	.	H	α-helix	trans	-62.3	-49.1	-178	-174.2	55.4	50.7	0	0	111.7	R142 W143 F144 V149 D150	R142-Q146 WeakPolarHBondContact O-CB 3.5Å; R142-Q146 PolarHBondContact O-N 3.28Å; W143-Q146 WeakPolarHBondContact O-CB 3.33Å; W143-Q146 PolarHBondContact O-N 2.9Å; W143-Q146 VanDerWaalsContact O-N 3.14Å; F144-Q146 VanDerWaalsContact C-N 3.29Å; F144-Q146 PolarHBondContact O-N 2.87Å; Q146-V149 PolarHBondContact O-N 3.33Å; Q146-D150 PolarHBondContact NE2-OD1 3.42Å; Q146-D150 PolarHBondContact NE2-OD2 3.09Å; Q146-D150 PolarHBondContact O-N 2.81Å
147	Q	95.8	Very high	91.6	Very high	16 Å²	16	43.8 Å²	43.8	8%	0.075	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-38.1	-179.1	-53.6	-38.7	-49.3	0	0	112.2	L79 E83 W143 F144 D150 L151	L79-Q147 HydrophobicContact CB-CB 3.99Å; L79-Q147 HydrophobicContact CD2-CB 3.84Å; L79-Q147 HydrophobicContact CG-CB 4.36Å; E83-Q147 HydrophobicContact CB-CG 4.36Å; W143-Q147 HydrophobicContact CD2-CG 4.04Å; W143-Q147 HydrophobicContact CE3-CG 4.4Å; W143-Q147 HydrophobicContact CH2-CG 4.1Å; W143-Q147 HydrophobicContact CZ2-CG 3.69Å; W143-Q147 HydrophobicContact CZ3-CG 4.44Å; W143-Q147 WeakPolarHBondContact O-CG 3.3Å; W143-Q147 PolarHBondContact O-N 3.29Å; F144-Q147 PolarHBondContact O-N 3.46Å; Q147-D150 PolarHBondContact O-N 3.48Å; Q147-L151 WeakPolarHBondContact O-CB 3.5Å; Q147-L151 PolarHBondContact O-N 3.32Å
148	E	97.3	Very high	91.7	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	20%	0.201	C	C	.	.	H	α-helix	trans	-64.7	-40.8	175.5	-75.6	-73.4	-175.8	0	0	112.3	R75 L79 H127 F144 L151 F152 F246 L250	R75-E148 IonicContact CZ-OE1 3.71Å; R75-E148 IonicContact CZ-OE2 2.79Å; R75-E148 IonicContact NE-OE1 2.87Å; R75-E148 PolarHBondContact NE-OE1 3.48Å; R75-E148 IonicContact NH2-OE1 2.74Å; R75-E148 PolarHBondContact NH2-OE1 2.92Å; R75-E148 IonicContact NH2-OE2 2.81Å; R75-E148 PolarHBondContact NH2-OE2 3.15Å; L79-E148 HydrophobicContact CD1-CG 4.32Å; L79-E148 HydrophobicContact CD2-CG 4.26Å; H127-E148 IonicContact CE1-OE1 3.73Å; H127-E148 IonicContact CE1-OE2 2.95Å; H127-E148 IonicContact CG-OE1 2.93Å; H127-E148 IonicContact ND1-OE1 2.94Å; H127-E148 PolarHBondContact ND1-OE1 3.35Å; H127-E148 IonicContact ND1-OE2 3.34Å; H127-E148 PolarHBondContact ND1-OE2 2.75Å; F144-E148 HydrophobicContact CD1-CG 4.37Å; F144-E148 HydrophobicContact CD2-CG 4.05Å; F144-E148 HydrophobicContact CE1-CG 4.06Å; F144-E148 HydrophobicContact CE2-CG 3.71Å; F144-E148 WeakPolarHBondContact CE2-OE1 3.32Å; F144-E148 HydrophobicContact CG-CG 4.37Å; F144-E148 HydrophobicContact CZ-CG 3.72Å; F144-E148 WeakPolarHBondContact CZ-OE1 3.33Å; F144-E148 VanDerWaalsContact O-CB 3.31Å; F144-E148 WeakPolarHBondContact O-CB 3.46Å; F144-E148 VanDerWaalsContact O-CG 3.25Å; F144-E148 WeakPolarHBondContact O-CG 3.39Å; F144-E148 PolarHBondContact O-N 3.47Å; E148-L151 PolarHBondContact O-N 3.47Å; E148-F152 VanDerWaalsContact O-CB 3.27Å; E148-F152 WeakPolarHBondContact O-CB 3.41Å; E148-F152 PolarHBondContact O-N 2.87Å; E148-F246 HydrophobicContact CB-CE1 4.18Å; E148-F246 HydrophobicContact CB-CZ 4.44Å; E148-L250 HydrophobicContact CB-CD2 3.79Å; E148-L250 HydrophobicContact CG-CD2 4.21Å
149	V	95.9	Very high	91.7	Very high	14 Å²	14	40.3 Å²	40.3	9%	0.085	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-41	176.3	168.5	0	0	0	0	110.9	I145 Q146 F152 K153 L243 F246 R247	I145-V149 HydrophobicContact CG2-CG2 4.15Å; I145-V149 WeakPolarHBondContact O-CB 3.48Å; I145-V149 WeakPolarHBondContact O-CG2 3.25Å; I145-V149 PolarHBondContact O-N 3.39Å; Q146-V149 PolarHBondContact O-N 3.33Å; V149-F152 PolarHBondContact O-N 3.03Å; V149-K153 WeakPolarHBondContact O-CB 3.42Å; V149-K153 PolarHBondContact O-N 3.47Å; V149-L243 HydrophobicContact CG1-CB 4.47Å; V149-L243 HydrophobicContact CG1-CD2 4.09Å; V149-F246 HydrophobicContact CG2-CD1 3.94Å; V149-F246 HydrophobicContact CG2-CE1 4.24Å; V149-R247 HydrophobicContact CG2-CB 3.85Å; V149-R247 HydrophobicContact CG2-CG 4.14Å
150	D	94.9	Very high	92	Very high	14 Å²	14	39 Å²	39	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-42.1	177	-75.1	-39.6	0	0	0	111.7	V82 K91 Q146 Q147 K153 Y154	V82-D150 HydrophobicContact CG1-CB 3.7Å; K91-D150 IonicContact NZ-OD1 3.16Å; K91-D150 PolarHBondContact NZ-OD1 2.75Å; K91-D150 IonicContact NZ-OD2 2.85Å; K91-D150 PolarHBondContact NZ-OD2 3.16Å; Q146-D150 PolarHBondContact NE2-OD1 3.42Å; Q146-D150 PolarHBondContact NE2-OD2 3.09Å; Q146-D150 PolarHBondContact O-N 2.81Å; Q147-D150 PolarHBondContact O-N 3.48Å; D150-K153 WeakPolarHBondContact O-CB 3.4Å; D150-K153 PolarHBondContact O-N 3.49Å; D150-Y154 PolarHBondContact O-N 3.48Å
151	L	95.6	Very high	91.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-42.9	173.2	-179	61.6	0	0	0	111.8	L78 L79 V82 I104 Q147 E148 Y154 R155	L78-L151 HydrophobicContact CD2-CD1 4.2Å; L78-L151 HydrophobicContact CD2-CD2 3.73Å; L78-L151 HydrophobicContact CG-CD1 4.47Å; L78-L151 HydrophobicContact CG-CD2 4.28Å; L79-L151 HydrophobicContact CD2-CD2 4.08Å; V82-L151 HydrophobicContact CG2-CB 4.32Å; V82-L151 HydrophobicContact CG2-CD1 4.23Å; I104-L151 HydrophobicContact CD1-CD1 4.38Å; Q147-L151 WeakPolarHBondContact O-CB 3.5Å; Q147-L151 PolarHBondContact O-N 3.32Å; E148-L151 PolarHBondContact O-N 3.47Å; L151-Y154 HydrophobicContact CD1-CD1 4.45Å; L151-Y154 WeakPolarHBondContact O-CB 3.49Å; L151-Y154 PolarHBondContact O-N 3.32Å; L151-R155 WeakPolarHBondContact O-CG 3.44Å; L151-R155 PolarHBondContact O-N 3.49Å
152	F	95.2	Very high	91	Very high	5 Å²	5	40.8 Å²	40.8	2%	0.022	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-45	176	-173.8	-76.6	0	0	0	110.9	L52 F54 E148 V149 Y154 R155 F156 F167 V242 L243 F246	L52-F152 HydrophobicContact CD1-CD2 3.64Å; L52-F152 HydrophobicContact CD1-CE2 3.61Å; L52-F152 HydrophobicContact CD1-CG 4.26Å; L52-F152 HydrophobicContact CD1-CZ 4.22Å; L52-F152 HydrophobicContact CD2-CD2 4.48Å; L52-F152 HydrophobicContact CD2-CE1 4.01Å; L52-F152 HydrophobicContact CD2-CE2 3.84Å; L52-F152 HydrophobicContact CD2-CZ 3.58Å; L52-F152 HydrophobicContact CG-CD2 4.2Å; L52-F152 HydrophobicContact CG-CE2 3.62Å; L52-F152 HydrophobicContact CG-CZ 3.9Å; F54-F152 AromaticContact CD1-CE2 3.65Å; F54-F152 HydrophobicContact CD1-CE2 3.65Å; F54-F152 AromaticContact CD1-CZ 3.82Å; F54-F152 HydrophobicContact CD1-CZ 3.82Å; F54-F152 HydrophobicContact CE1-CE1 4.32Å; F54-F152 AromaticContact CE1-CE2 3.82Å; F54-F152 HydrophobicContact CE1-CE2 3.82Å; F54-F152 AromaticContact CE1-CZ 3.48Å; F54-F152 HydrophobicContact CE1-CZ 3.48Å; F54-F152 VanDerWaalsContact CE1-CZ 3.48Å; E148-F152 VanDerWaalsContact O-CB 3.27Å; E148-F152 WeakPolarHBondContact O-CB 3.41Å; E148-F152 PolarHBondContact O-N 2.87Å; V149-F152 PolarHBondContact O-N 3.03Å; F152-Y154 VanDerWaalsContact C-N 3.3Å; F152-Y154 PolarHBondContact O-N 3.42Å; F152-R155 PolarHBondContact O-N 3.48Å; F152-F156 HydrophobicContact CD1-CB 4.24Å; F152-F156 HydrophobicContact CE1-CB 3.99Å; F152-F156 HydrophobicContact CE1-CD2 4.01Å; F152-F156 HydrophobicContact CE1-CG 4.26Å; F152-F156 HydrophobicContact CZ-CD2 4.38Å; F152-F156 WeakPolarHBondContact O-CB 3.31Å; F152-F156 PolarHBondContact O-N 3.05Å; F152-F167 HydrophobicContact CE2-CZ 4.01Å; F152-F167 AromaticContact CZ-CE1 3.95Å; F152-F167 HydrophobicContact CZ-CE1 3.95Å; F152-F167 HydrophobicContact CZ-CE2 4.41Å; F152-F167 AromaticContact CZ-CZ 3.58Å; F152-F167 HydrophobicContact CZ-CZ 3.58Å; F152-V242 HydrophobicContact CE1-CG1 3.7Å; F152-V242 HydrophobicContact CZ-CG1 3.92Å; F152-L243 HydrophobicContact CB-CD2 4.41Å; F152-L243 HydrophobicContact CD1-CD2 3.55Å; F152-L243 HydrophobicContact CE1-CD2 4.32Å; F152-L243 HydrophobicContact CG-CD2 4.39Å; F152-F246 HydrophobicContact CB-CD1 3.95Å; F152-F246 HydrophobicContact CB-CE1 3.83Å; F152-F246 HydrophobicContact CD2-CD1 4.06Å; F152-F246 HydrophobicContact CD2-CD2 4.12Å; F152-F246 HydrophobicContact CD2-CE1 4.12Å; F152-F246 HydrophobicContact CD2-CE2 4.18Å; F152-F246 HydrophobicContact CD2-CG 4.06Å; F152-F246 HydrophobicContact CD2-CZ 4.18Å; F152-F246 HydrophobicContact CE2-CD2 4.31Å; F152-F246 HydrophobicContact CE2-CG 4.4Å; F152-F246 AromaticContact CG-CD1 3.94Å; F152-F246 HydrophobicContact CG-CD1 3.94Å; F152-F246 HydrophobicContact CG-CE1 4.15Å; F152-F246 HydrophobicContact CG-CG 4.26Å
153	K	93	Very high	90.8	Very high	66 Å²	66	35.7 Å²	35.7	29%	0.287	19%	0.187	S	C	.	.	H	α-helix	trans	-57.1	-44.8	177.3	-178.9	173.9	-169.9	178.4	0	111.8	L92 V149 D150 K157 L243	L92-K153 HydrophobicContact CD1-CD 4.38Å; L92-K153 HydrophobicContact CD1-CG 4.45Å; V149-K153 WeakPolarHBondContact O-CB 3.42Å; V149-K153 PolarHBondContact O-N 3.47Å; D150-K153 WeakPolarHBondContact O-CB 3.4Å; D150-K153 PolarHBondContact O-N 3.49Å; K153-K157 WeakPolarHBondContact O-CG 3.37Å; K153-K157 PolarHBondContact O-N 2.68Å; K153-K157 VanDerWaalsContact O-N 3.1Å; K153-L243 HydrophobicContact CB-CD1 3.87Å; K153-L243 HydrophobicContact CB-CD2 3.67Å; K153-L243 HydrophobicContact CB-CG 4.41Å; K153-L243 HydrophobicContact CD-CD1 3.79Å; K153-L243 HydrophobicContact CG-CD1 3.78Å; K153-L243 HydrophobicContact CG-CD2 4.46Å
154	Y	92.6	Very high	90.4	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.02	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-52.8	175.3	164.8	-98.7	0	0	0	111.5	L92 L97 L100 D101 I104 D150 L151 F152 F156 K157 K158	L92-Y154 HydrophobicContact CD2-CD2 4.39Å; L97-Y154 HydrophobicContact CD2-CD2 3.53Å; L97-Y154 HydrophobicContact CD2-CE2 3.47Å; L97-Y154 VanDerWaalsContact CD2-CE2 3.47Å; L100-Y154 HydrophobicContact CD2-CD1 3.75Å; L100-Y154 HydrophobicContact CD2-CD2 3.66Å; L100-Y154 HydrophobicContact CD2-CE1 4.09Å; L100-Y154 HydrophobicContact CD2-CE2 3.96Å; L100-Y154 HydrophobicContact CD2-CG 3.52Å; L100-Y154 HydrophobicContact CG-CD1 4.38Å; L100-Y154 HydrophobicContact CG-CE1 4.26Å; L100-Y154 HydrophobicContact CG-CE2 4.39Å; D101-Y154 PolarHBondContact OD1-OH 3.26Å; D101-Y154 PolarHBondContact OD2-OH 2.89Å; I104-Y154 HydrophobicContact CD1-CD1 4.11Å; I104-Y154 HydrophobicContact CD1-CE1 3.4Å; D150-Y154 PolarHBondContact O-N 3.48Å; L151-Y154 HydrophobicContact CD1-CD1 4.45Å; L151-Y154 WeakPolarHBondContact O-CB 3.49Å; L151-Y154 PolarHBondContact O-N 3.32Å; F152-Y154 VanDerWaalsContact C-N 3.3Å; F152-Y154 PolarHBondContact O-N 3.42Å; Y154-F156 PolarHBondContact O-N 3.07Å; Y154-K157 PolarHBondContact O-N 3.5Å; Y154-K158 HydrophobicContact CE1-CD 4.32Å; Y154-K158 HydrophobicContact CE2-CD 4.23Å; Y154-K158 PolarHBondContact O-N 3.49Å; Y154-K158 WeakPolarHBondContact OH-CE 3.47Å; Y154-K158 PolarHBondContact OH-NZ 3.15Å
155	R	91.7	Very high	89.7	Confident	17 Å²	17	40.8 Å²	40.8	6%	0.064	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-43.4	-179.3	-68.6	-179.1	179.2	174.9	0.9	112.3	L52 Y55 D123 L151 F152 K157 K158 L159	L52-R155 HydrophobicContact CD1-CB 3.68Å; L52-R155 HydrophobicContact CD1-CG 4.49Å; Y55-R155 PolarHBondContact OH-NH1 2.97Å; Y55-R155 VanDerWaalsContact OH-NH1 3.08Å; D123-R155 IonicContact OD1-CZ 2.72Å; D123-R155 IonicContact OD1-NH1 3.89Å; D123-R155 PolarHBondContact OD1-NH1 2.92Å; D123-R155 IonicContact OD1-NH2 3.62Å; D123-R155 PolarHBondContact OD1-NH2 2.91Å; D123-R155 IonicContact OD2-CZ 3.45Å; D123-R155 IonicContact OD2-NH1 3.9Å; D123-R155 PolarHBondContact OD2-NH1 2.98Å; D123-R155 IonicContact OD2-NH2 3.63Å; L151-R155 WeakPolarHBondContact O-CG 3.44Å; L151-R155 PolarHBondContact O-N 3.49Å; F152-R155 PolarHBondContact O-N 3.48Å; R155-K157 VanDerWaalsContact C-N 3.31Å; R155-K157 PolarHBondContact O-N 2.8Å; R155-K158 PolarHBondContact O-N 2.92Å; R155-L159 PolarHBondContact O-N 3.46Å
156	F	90.4	Very high	89.1	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.013	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-37.9	179.1	-171.7	-90.5	0	0	0	112.3	L52 F152 Y154 K158 L159 K164 F167 I238 V239 V242	L52-F156 HydrophobicContact CD2-CB 3.83Å; L52-F156 HydrophobicContact CD2-CD2 3.73Å; L52-F156 HydrophobicContact CD2-CG 4.28Å; F152-F156 HydrophobicContact CD1-CB 4.24Å; F152-F156 HydrophobicContact CE1-CB 3.99Å; F152-F156 HydrophobicContact CE1-CD2 4.01Å; F152-F156 HydrophobicContact CE1-CG 4.26Å; F152-F156 HydrophobicContact CZ-CD2 4.38Å; F152-F156 WeakPolarHBondContact O-CB 3.31Å; F152-F156 PolarHBondContact O-N 3.05Å; Y154-F156 PolarHBondContact O-N 3.07Å; F156-K158 VanDerWaalsContact C-N 3.29Å; F156-K158 PolarHBondContact O-N 2.95Å; F156-L159 HydrophobicContact CD2-CD1 4.25Å; F156-L159 WeakPolarHBondContact O-CB 3.47Å; F156-L159 PolarHBondContact O-N 2.87Å; F156-K164 HydrophobicContact CE1-CD 4.22Å; F156-K164 HydrophobicContact CE1-CG 4.19Å; F156-K164 HydrophobicContact CE2-CG 4.29Å; F156-K164 HydrophobicContact CZ-CB 4.35Å; F156-K164 HydrophobicContact CZ-CD 4.38Å; F156-K164 HydrophobicContact CZ-CG 3.93Å; F156-K164 WeakPolarHBondContact O-CE 3.38Å; F156-F167 HydrophobicContact CD2-CD1 4.45Å; F156-F167 AromaticContact CE2-CD1 3.97Å; F156-F167 HydrophobicContact CE2-CD1 3.97Å; F156-F167 HydrophobicContact CE2-CE1 4.39Å; F156-I238 HydrophobicContact CE1-CG2 4.46Å; F156-V239 HydrophobicContact CD1-CB 3.9Å; F156-V239 HydrophobicContact CD1-CG2 3.47Å; F156-V239 VanDerWaalsContact CD1-CG2 3.47Å; F156-V239 HydrophobicContact CE1-CB 3.88Å; F156-V239 HydrophobicContact CE1-CG2 3.98Å; F156-V239 HydrophobicContact CG-CG2 4.29Å; F156-V242 HydrophobicContact CD2-CG1 4.23Å; F156-V242 HydrophobicContact CE2-CB 4.47Å; F156-V242 HydrophobicContact CE2-CG1 4.02Å; F156-V242 HydrophobicContact CE2-CG2 4.26Å; F156-V242 HydrophobicContact CZ-CG2 4.11Å
157	K	88.4	Confident	88.7	Confident	107 Å²	107	42.4 Å²	42.4	47%	0.465	22%	0.222	S	C	.	.	H	α-helix	trans	-67.2	-29.3	177.5	-82.1	-168	171	-157.5	0	113.5	L92 K153 Y154 R155 L159	L92-K157 HydrophobicContact CD1-CD 3.52Å; L92-K157 VanDerWaalsContact CD1-NZ 3.31Å; L92-K157 HydrophobicContact CD2-CD 4.43Å; K153-K157 WeakPolarHBondContact O-CG 3.37Å; K153-K157 PolarHBondContact O-N 2.68Å; K153-K157 VanDerWaalsContact O-N 3.1Å; Y154-K157 PolarHBondContact O-N 3.5Å; R155-K157 VanDerWaalsContact C-N 3.31Å; R155-K157 PolarHBondContact O-N 2.8Å; K157-L159 VanDerWaalsContact C-N 3.34Å
158	K	87.3	Confident	88.1	Confident	97 Å²	97	42.2 Å²	42.2	42%	0.422	22%	0.222	S	C	.	.	H	α-helix	trans	-75.6	-19.8	177.2	-77.1	-161.9	162.9	-162.3	0	114.4	D101 Y154 R155 F156	D101-K158 IonicContact OD1-NZ 3.42Å; D101-K158 PolarHBondContact OD1-NZ 3.45Å; D101-K158 IonicContact OD2-NZ 2.68Å; D101-K158 PolarHBondContact OD2-NZ 2.94Å; Y154-K158 HydrophobicContact CE1-CD 4.32Å; Y154-K158 HydrophobicContact CE2-CD 4.23Å; Y154-K158 PolarHBondContact O-N 3.49Å; Y154-K158 WeakPolarHBondContact OH-CE 3.47Å; Y154-K158 PolarHBondContact OH-NZ 3.15Å; R155-K158 PolarHBondContact O-N 2.92Å; F156-K158 VanDerWaalsContact C-N 3.29Å; F156-K158 PolarHBondContact O-N 2.95Å
159	L	85.8	Confident	87.4	Confident	17 Å²	17	47.6 Å²	47.6	9%	0.089	25%	0.247	C	C	.	.	S	Bend	trans	-63.4	143.5	176.3	-61.8	-178.7	0	0	0	111	P51 L52 R155 F156 K157 E163 K164	P51-L159 HydrophobicContact CG-CD2 3.87Å; L52-L159 HydrophobicContact CB-CD1 4.27Å; L52-L159 HydrophobicContact CD2-CD1 3.73Å; R155-L159 PolarHBondContact O-N 3.46Å; F156-L159 HydrophobicContact CD2-CD1 4.25Å; F156-L159 WeakPolarHBondContact O-CB 3.47Å; F156-L159 PolarHBondContact O-N 2.87Å; K157-L159 VanDerWaalsContact C-N 3.34Å; L159-E163 WeakPolarHBondContact CA-OE2 3.35Å; L159-E163 HydrophobicContact CB-CB 4.06Å; L159-E163 HydrophobicContact CD2-CB 4.29Å; L159-K164 HydrophobicContact CB-CG 3.81Å; L159-K164 HydrophobicContact CD1-CG 4.44Å; L159-K164 WeakPolarHBondContact O-CE 3.28Å; L159-K164 PolarHBondContact O-NZ 3.4Å
160	D	83.5	Confident	86.8	Confident	92 Å²	92	51.9 Å²	51.9	49%	0.492	26%	0.264	S	S	.	.			trans	-70.7	171.2	170	75.4	28.2	0	0	0	111.3	G162 E163 K164	D160-G162 VanDerWaalsContact C-N 3.28Å; D160-G162 PolarHBondContact O-N 3.41Å; D160-G162 WeakPolarHBondContact OD1-CA 3.27Å; D160-G162 PolarHBondContact OD1-N 3.03Å; D160-E163 PolarHBondContact N-OE2 2.96Å; D160-E163 WeakPolarHBondContact OD1-CB 3.34Å; D160-E163 VanDerWaalsContact OD1-CG 3.27Å; D160-E163 WeakPolarHBondContact OD1-CG 3.07Å; D160-E163 PolarHBondContact OD1-N 3.39Å; D160-K164 VanDerWaalsContact O-CG 3.28Å; D160-K164 WeakPolarHBondContact O-CG 3.11Å; D160-K164 PolarHBondContact O-N 3.14Å
161	S	78.8	Confident	86.3	Confident	83 Å²	83	52.4 Å²	52.4	58%	0.58	27%	0.267	S	S	*	.	H	α-helix	trans	-65.1	-30.9	-177.9	-57.7	0	0	0	0	113	L165	S161-L165 PolarHBondContact O-N 2.92Å
162	G	80.3	Confident	85.6	Confident	48 Å²	48	59 Å²	59	50%	0.495	30%	0.302	S	S	.	.	H	α-helix	trans	-72.8	-46.7	179.1	0	0	0	0	0	111.9	D160 K164 L165 E166	D160-G162 VanDerWaalsContact C-N 3.28Å; D160-G162 PolarHBondContact O-N 3.41Å; D160-G162 WeakPolarHBondContact OD1-CA 3.27Å; D160-G162 PolarHBondContact OD1-N 3.03Å; G162-K164 VanDerWaalsContact C-N 3.33Å; G162-K164 PolarHBondContact O-N 2.94Å; G162-L165 PolarHBondContact O-N 2.86Å; G162-L165 VanDerWaalsContact O-N 3.14Å; G162-E166 PolarHBondContact O-N 3.35Å
163	E	82.5	Confident	84.8	Confident	47 Å²	47	59.4 Å²	59.4	22%	0.22	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-40.3	175.6	-70.9	177.4	134.1	0	0	111.7	A113 L159 D160 L165 E166 F167	A113-E163 WeakPolarHBondContact CB-OE1 3.5Å; L159-E163 WeakPolarHBondContact CA-OE2 3.35Å; L159-E163 HydrophobicContact CB-CB 4.06Å; L159-E163 HydrophobicContact CD2-CB 4.29Å; D160-E163 PolarHBondContact N-OE2 2.96Å; D160-E163 WeakPolarHBondContact OD1-CB 3.34Å; D160-E163 VanDerWaalsContact OD1-CG 3.27Å; D160-E163 WeakPolarHBondContact OD1-CG 3.07Å; D160-E163 PolarHBondContact OD1-N 3.39Å; E163-L165 VanDerWaalsContact C-N 3.34Å; E163-E166 PolarHBondContact O-N 3.39Å; E163-F167 WeakPolarHBondContact O-CB 3.49Å; E163-F167 PolarHBondContact O-N 3.33Å
164	K	84.3	Confident	83.6	Confident	35 Å²	35	62.1 Å²	62.1	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-45	173.7	-75.9	169.6	-178.7	146.5	0	111.4	F156 L159 D160 G162 F167 L168	F156-K164 HydrophobicContact CE1-CD 4.22Å; F156-K164 HydrophobicContact CE1-CG 4.19Å; F156-K164 HydrophobicContact CE2-CG 4.29Å; F156-K164 HydrophobicContact CZ-CB 4.35Å; F156-K164 HydrophobicContact CZ-CD 4.38Å; F156-K164 HydrophobicContact CZ-CG 3.93Å; F156-K164 WeakPolarHBondContact O-CE 3.38Å; L159-K164 HydrophobicContact CB-CG 3.81Å; L159-K164 HydrophobicContact CD1-CG 4.44Å; L159-K164 WeakPolarHBondContact O-CE 3.28Å; L159-K164 PolarHBondContact O-NZ 3.4Å; D160-K164 VanDerWaalsContact O-CG 3.28Å; D160-K164 WeakPolarHBondContact O-CG 3.11Å; D160-K164 PolarHBondContact O-N 3.14Å; G162-K164 VanDerWaalsContact C-N 3.33Å; G162-K164 PolarHBondContact O-N 2.94Å; K164-F167 PolarHBondContact O-N 3.39Å; K164-L168 VanDerWaalsContact O-CG 3.26Å; K164-L168 WeakPolarHBondContact O-CG 3.43Å; K164-L168 PolarHBondContact O-N 3.03Å
165	L	79.9	Confident	82.8	Confident	112 Å²	112	63.4 Å²	63.4	59%	0.586	32%	0.323	S	S	*	.	H	α-helix	trans	-67.4	-43	-179.5	-169.2	143.3	0	0	0	111.5	S161 G162 E163 F167 L168 H169	S161-L165 PolarHBondContact O-N 2.92Å; G162-L165 PolarHBondContact O-N 2.86Å; G162-L165 VanDerWaalsContact O-N 3.14Å; E163-L165 VanDerWaalsContact C-N 3.34Å; L165-F167 VanDerWaalsContact C-N 3.33Å; L165-F167 PolarHBondContact O-N 3.38Å; L165-L168 PolarHBondContact O-N 3.2Å; L165-H169 PolarHBondContact O-N 2.87Å
166	E	82.7	Confident	81.9	Confident	107 Å²	107	68.2 Å²	68.2	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-42.6	174.4	-164.6	-165.4	143.3	0	0	111.5	Q50 G162 E163 H169 K170	Q50-E166 VanDerWaalsContact NE2-CD 3.27Å; Q50-E166 PolarHBondContact NE2-OE1 3.1Å; G162-E166 PolarHBondContact O-N 3.35Å; E163-E166 PolarHBondContact O-N 3.39Å; E166-H169 PolarHBondContact O-N 3.4Å; E166-K170 WeakPolarHBondContact O-CB 3.45Å; E166-K170 PolarHBondContact O-N 2.82Å
167	F	86.4	Confident	81.5	Confident	3 Å²	3	71.8 Å²	71.8	1%	0.013	37%	0.372	C	S	.	.	H	α-helix	trans	-60.6	-46.4	176.2	-179.9	-89.2	0	0	0	111.9	L52 F54 F152 F156 E163 K164 L165 K170 N171 V242	L52-F167 HydrophobicContact CB-CD2 4.36Å; L52-F167 HydrophobicContact CB-CE2 4.24Å; L52-F167 HydrophobicContact CD2-CD2 4.48Å; L52-F167 HydrophobicContact CD2-CE2 4.23Å; L52-F167 HydrophobicContact CD2-CZ 4.45Å; L52-F167 HydrophobicContact CG-CD2 4.45Å; L52-F167 HydrophobicContact CG-CE2 3.98Å; L52-F167 HydrophobicContact CG-CZ 4.46Å; F54-F167 HydrophobicContact CD1-CE1 4.28Å; F54-F167 AromaticContact CD1-CZ 3.59Å; F54-F167 HydrophobicContact CD1-CZ 3.59Å; F54-F167 AromaticContact CE1-CE1 3.71Å; F54-F167 HydrophobicContact CE1-CE1 3.71Å; F54-F167 AromaticContact CE1-CZ 3.49Å; F54-F167 HydrophobicContact CE1-CZ 3.49Å; F54-F167 VanDerWaalsContact CE1-CZ 3.49Å; F54-F167 HydrophobicContact CG-CZ 4.17Å; F54-F167 AromaticContact CZ-CE1 3.85Å; F54-F167 HydrophobicContact CZ-CE1 3.85Å; F54-F167 AromaticContact CZ-CZ 3.99Å; F54-F167 HydrophobicContact CZ-CZ 3.99Å; F152-F167 HydrophobicContact CE2-CZ 4.01Å; F152-F167 AromaticContact CZ-CE1 3.95Å; F152-F167 HydrophobicContact CZ-CE1 3.95Å; F152-F167 HydrophobicContact CZ-CE2 4.41Å; F152-F167 AromaticContact CZ-CZ 3.58Å; F152-F167 HydrophobicContact CZ-CZ 3.58Å; F156-F167 HydrophobicContact CD2-CD1 4.45Å; F156-F167 AromaticContact CE2-CD1 3.97Å; F156-F167 HydrophobicContact CE2-CD1 3.97Å; F156-F167 HydrophobicContact CE2-CE1 4.39Å; E163-F167 WeakPolarHBondContact O-CB 3.49Å; E163-F167 PolarHBondContact O-N 3.33Å; K164-F167 PolarHBondContact O-N 3.39Å; L165-F167 VanDerWaalsContact C-N 3.33Å; L165-F167 PolarHBondContact O-N 3.38Å; F167-K170 PolarHBondContact O-N 2.83Å; F167-N171 WeakPolarHBondContact CE2-ND2 3.34Å; F167-N171 WeakPolarHBondContact CZ-ND2 3.27Å; F167-N171 PolarHBondContact O-N 2.89Å; F167-N171 PolarHBondContact O-ND2 2.84Å; F167-V242 HydrophobicContact CE1-CG1 3.82Å
168	L	83.8	Confident	81.4	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-46.8	177	-72.4	173.4	0	0	0	111.1	K164 L165 N171 N172 L173 Y175 I238 V242	K164-L168 VanDerWaalsContact O-CG 3.26Å; K164-L168 WeakPolarHBondContact O-CG 3.43Å; K164-L168 PolarHBondContact O-N 3.03Å; L165-L168 PolarHBondContact O-N 3.2Å; L168-N171 PolarHBondContact O-N 2.77Å; L168-N172 PolarHBondContact O-N 3.2Å; L168-L173 HydrophobicContact CB-CB 4.35Å; L168-L173 HydrophobicContact CD2-CB 3.83Å; L168-L173 HydrophobicContact CD2-CD1 3.94Å; L168-L173 WeakPolarHBondContact O-CA 3.35Å; L168-L173 WeakPolarHBondContact O-CB 3.43Å; L168-L173 PolarHBondContact O-N 3.35Å; L168-Y175 HydrophobicContact CD2-CD2 4.34Å; L168-Y175 HydrophobicContact CD2-CE2 4.44Å; L168-I238 HydrophobicContact CD1-CG1 4.22Å; L168-V242 HydrophobicContact CD2-CG2 3.5Å
169	H	82.4	Confident	81.5	Confident	115 Å²	115	65.9 Å²	65.9	53%	0.532	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-45.4	-179.4	-160.9	-89.8	0	0	0	112.2	L165 E166 N171 N172 Q174	L165-H169 PolarHBondContact O-N 2.87Å; E166-H169 PolarHBondContact O-N 3.4Å; H169-N171 VanDerWaalsContact C-N 3.26Å; H169-N171 PolarHBondContact O-N 3.45Å; H169-N172 PolarHBondContact O-N 2.82Å; H169-Q174 PolarHBondContact NE2-NE2 3.07Å
170	K	83.2	Confident	81.5	Confident	103 Å²	103	68.5 Å²	68.5	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-29.8	179.6	-170.9	174.9	-177.6	176.4	0	113.1	S49 E166 F167	S49-K170 PolarHBondContact OG-NZ 2.7Å; E166-K170 WeakPolarHBondContact O-CB 3.45Å; E166-K170 PolarHBondContact O-N 2.82Å; F167-K170 PolarHBondContact O-N 2.83Å
171	N	83.6	Confident	81.7	Confident	26 Å²	26	71.2 Å²	71.2	14%	0.139	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	12.3	-178.4	-70.7	-79.5	0	0	0	113.8	F54 F167 L168 H169 L173	F54-N171 HydrophobicContact CD2-CB 3.92Å; F54-N171 WeakPolarHBondContact CD2-OD1 3.4Å; F54-N171 HydrophobicContact CE2-CB 3.74Å; F167-N171 WeakPolarHBondContact CE2-ND2 3.34Å; F167-N171 WeakPolarHBondContact CZ-ND2 3.27Å; F167-N171 PolarHBondContact O-N 2.89Å; F167-N171 PolarHBondContact O-ND2 2.84Å; L168-N171 PolarHBondContact O-N 2.77Å; H169-N171 VanDerWaalsContact C-N 3.26Å; H169-N171 PolarHBondContact O-N 3.45Å; N171-L173 HydrophobicContact CB-CD1 4.44Å; N171-L173 HydrophobicContact CB-CG 4.31Å; N171-L173 PolarHBondContact O-N 3.44Å
172	N	81	Confident	82.2	Confident	140 Å²	140	69.5 Å²	69.5	75%	0.749	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	31.6	-175.9	-54.1	-58.8	0	0	0	113.2	L168 H169 Q174	L168-N172 PolarHBondContact O-N 3.2Å; H169-N172 PolarHBondContact O-N 2.82Å; N172-Q174 PolarHBondContact O-N 3.43Å
173	L	79.1	Confident	82.6	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.068	35%	0.354	C	S	.	.			trans	-99.1	62.9	172.6	-60.4	179.5	0	0	0	108.6	F54 L168 N171 Y175 V242	F54-L173 HydrophobicContact CE2-CD1 3.95Å; F54-L173 HydrophobicContact CZ-CD1 3.85Å; L168-L173 HydrophobicContact CB-CB 4.35Å; L168-L173 HydrophobicContact CD2-CB 3.83Å; L168-L173 HydrophobicContact CD2-CD1 3.94Å; L168-L173 WeakPolarHBondContact O-CA 3.35Å; L168-L173 WeakPolarHBondContact O-CB 3.43Å; L168-L173 PolarHBondContact O-N 3.35Å; N171-L173 HydrophobicContact CB-CD1 4.44Å; N171-L173 HydrophobicContact CB-CG 4.31Å; N171-L173 PolarHBondContact O-N 3.44Å; L173-Y175 VanDerWaalsContact C-N 3.28Å; L173-Y175 HydrophobicContact CB-CD2 4.22Å; L173-Y175 HydrophobicContact CB-CE2 3.76Å; L173-Y175 HydrophobicContact CD2-CE2 4.31Å; L173-Y175 HydrophobicContact CG-CE2 4.43Å; L173-Y175 PolarHBondContact O-N 3.39Å; L173-V242 HydrophobicContact CD1-CG2 4.26Å
174	Q	68.8	Low	82.8	Confident	122 Å²	122	71.4 Å²	71.4	57%	0.57	37%	0.371	S	S	*	.			trans	-78.3	80.5	179.7	-68.3	-175.8	-5.5	0	0	110	H169 N172	H169-Q174 PolarHBondContact NE2-NE2 3.07Å; N172-Q174 PolarHBondContact O-N 3.43Å
175	Y	75.3	Confident	83.1	Confident	32 Å²	32	76.1 Å²	76.1	13%	0.125	40%	0.398	C	S	.	.			trans	-89.7	113.6	170.7	-55.4	-53.4	0	0	0	108.8	L168 L173 Y208 V210 I238 I241	L168-Y175 HydrophobicContact CD2-CD2 4.34Å; L168-Y175 HydrophobicContact CD2-CE2 4.44Å; L173-Y175 VanDerWaalsContact C-N 3.28Å; L173-Y175 HydrophobicContact CB-CD2 4.22Å; L173-Y175 HydrophobicContact CB-CE2 3.76Å; L173-Y175 HydrophobicContact CD2-CE2 4.31Å; L173-Y175 HydrophobicContact CG-CE2 4.43Å; L173-Y175 PolarHBondContact O-N 3.39Å; Y175-Y208 WeakPolarHBondContact O-CD1 3.07Å; Y175-V210 HydrophobicContact CD1-CB 3.89Å; Y175-V210 HydrophobicContact CD1-CG1 3.24Å; Y175-V210 HydrophobicContact CD2-CG1 4.45Å; Y175-V210 HydrophobicContact CE1-CB 3.99Å; Y175-V210 HydrophobicContact CE1-CG1 3.72Å; Y175-V210 HydrophobicContact CG-CG1 3.65Å; Y175-I238 HydrophobicContact CD2-CD1 3.58Å; Y175-I238 HydrophobicContact CD2-CG1 4.49Å; Y175-I238 HydrophobicContact CE2-CD1 4.17Å; Y175-I238 HydrophobicContact CG-CD1 4.23Å; Y175-I241 HydrophobicContact CE2-CG2 3.94Å; Y175-I241 WeakPolarHBondContact OH-CG2 3.07Å
176	N	72.4	Confident	83.5	Confident	119 Å²	119	71.2 Å²	71.2	64%	0.636	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	137.2	177.9	-64.5	-30.7	0	0	0	109.6	K209	N176-K209 PolarHBondContact O-N 3.33Å
177	T	82.3	Confident	83.7	Confident	77 Å²	77	71.6 Å²	71.6	47%	0.472	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	142.6	165.1	49.9	0	0	0	0	108.9	D206 F207 Y208	T177-D206 HydrophobicContact CG2-CB 4.24Å; T177-F207 VanDerWaalsContact CA-O 3.31Å; T177-F207 WeakPolarHBondContact CA-O 3.16Å; T177-Y208 HydrophobicContact CG2-CD1 4.1Å; T177-Y208 HydrophobicContact CG2-CE1 3.65Å
178	I	86.4	Confident	83.7	Confident	18 Å²	18	78.5 Å²	78.5	9%	0.092	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70.2	150	174	64	176.7	0	0	0	110	E182 K183 L190 F207 K209 Y232	I178-E182 HydrophobicContact CB-CB 4.33Å; I178-E182 HydrophobicContact CB-CG 4.39Å; I178-K183 HydrophobicContact CD1-CB 3.68Å; I178-K183 HydrophobicContact CD1-CG 4.08Å; I178-K183 HydrophobicContact CG1-CB 4.04Å; I178-L190 HydrophobicContact CD1-CD1 4.1Å; I178-F207 HydrophobicContact CD1-CB 3.58Å; I178-F207 HydrophobicContact CD1-CG 4.37Å; I178-F207 HydrophobicContact CG1-CB 3.85Å; I178-F207 PolarHBondContact N-O 3.22Å; I178-K209 HydrophobicContact CG2-CB 3.78Å; I178-Y232 HydrophobicContact CD1-CD1 4.29Å; I178-Y232 HydrophobicContact CG2-CD1 3.89Å; I178-Y232 HydrophobicContact CG2-CE1 3.81Å
179	S	88.1	Confident	84	Confident	62 Å²	62	82.8 Å²	82.8	43%	0.434	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-65.6	157.6	174.9	67	0	0	0	0	111	E181 E182 K183	S179-E181 PolarHBondContact O-N 3.27Å; S179-E182 PolarHBondContact O-N 3.47Å; S179-E182 VanDerWaalsContact O-N 3.17Å; S179-E182 WeakPolarHBondContact OG-CB 3.37Å; S179-E182 PolarHBondContact OG-N 3.37Å; S179-E182 VanDerWaalsContact OG-N 3.11Å; S179-K183 WeakPolarHBondContact O-CB 3.33Å; S179-K183 PolarHBondContact O-N 3.41Å
180	A	85.8	Confident	84.2	Confident	72 Å²	72	77.3 Å²	77.3	60%	0.595	39%	0.394	S	S	*	.	H	α-helix	trans	-56.2	-39.3	174.3	0	0	0	0	0	111.6	K183 D184	A180-K183 WeakPolarHBondContact O-CB 3.4Å; A180-K183 PolarHBondContact O-N 3.48Å; A180-D184 PolarHBondContact O-N 2.93Å
181	E	89.2	Confident	84.2	Confident	150 Å²	150	75.7 Å²	75.7	70%	0.701	39%	0.393	S	S	*	.	H	α-helix	trans	-63.4	-45.2	175.7	-62.2	177.1	-176	0	0	112.7	S179 K183 D184 N185	S179-E181 PolarHBondContact O-N 3.27Å; E181-K183 VanDerWaalsContact C-N 3.31Å; E181-K183 PolarHBondContact O-N 3.1Å; E181-D184 PolarHBondContact O-N 3.39Å; E181-N185 WeakPolarHBondContact O-CB 3.23Å; E181-N185 VanDerWaalsContact O-CG 3.24Å; E181-N185 PolarHBondContact O-N 3.19Å; E181-N185 VanDerWaalsContact O-N 3.08Å; E181-N185 PolarHBondContact O-ND2 3.36Å
182	E	89.4	Confident	84.1	Confident	47 Å²	47	80.7 Å²	80.7	22%	0.22	42%	0.418	C	S	.	.	H	α-helix	trans	-66.5	-36.7	177.1	-173.6	173.5	-168.2	0	0	110.8	I178 S179 L186 K209 Y232	I178-E182 HydrophobicContact CB-CB 4.33Å; I178-E182 HydrophobicContact CB-CG 4.39Å; S179-E182 PolarHBondContact O-N 3.47Å; S179-E182 VanDerWaalsContact O-N 3.17Å; S179-E182 WeakPolarHBondContact OG-CB 3.37Å; S179-E182 PolarHBondContact OG-N 3.37Å; S179-E182 VanDerWaalsContact OG-N 3.11Å; E182-L186 HydrophobicContact CG-CD1 3.95Å; E182-L186 WeakPolarHBondContact O-CB 3.31Å; E182-L186 VanDerWaalsContact O-CG 3.32Å; E182-L186 WeakPolarHBondContact O-CG 3.21Å; E182-L186 PolarHBondContact O-N 3.05Å; E182-L186 VanDerWaalsContact O-N 3.13Å; E182-K209 IonicContact OE1-NZ 3.12Å; E182-K209 PolarHBondContact OE1-NZ 3.25Å; E182-K209 VanDerWaalsContact OE1-NZ 3.12Å; E182-Y232 HydrophobicContact CG-CE1 4.4Å; E182-Y232 WeakPolarHBondContact OE1-CE1 3.42Å; E182-Y232 PolarHBondContact OE1-OH 3.17Å
183	K	87.4	Confident	84.2	Confident	26 Å²	26	74.9 Å²	74.9	11%	0.113	39%	0.389	C	S	.	.	H	α-helix	trans	-63.5	-46.6	176	-171.9	177.7	172.2	-175.6	0	111.9	I178 S179 A180 E181 L186 R187 L190 L202 E203 Q205	I178-K183 HydrophobicContact CD1-CB 3.68Å; I178-K183 HydrophobicContact CD1-CG 4.08Å; I178-K183 HydrophobicContact CG1-CB 4.04Å; S179-K183 WeakPolarHBondContact O-CB 3.33Å; S179-K183 PolarHBondContact O-N 3.41Å; A180-K183 WeakPolarHBondContact O-CB 3.4Å; A180-K183 PolarHBondContact O-N 3.48Å; E181-K183 VanDerWaalsContact C-N 3.31Å; E181-K183 PolarHBondContact O-N 3.1Å; K183-L186 CarbonylContact O-C 3.56Å; K183-L186 PolarHBondContact O-N 3.4Å; K183-R187 WeakPolarHBondContact O-CA 3.49Å; K183-R187 PolarHBondContact O-N 3.39Å; K183-L190 HydrophobicContact CG-CD1 4.47Å; K183-L202 WeakPolarHBondContact CE-O 3.28Å; K183-L202 PolarHBondContact NZ-O 2.75Å; K183-E203 PolarHBondContact NZ-O 2.93Å; K183-Q205 VanDerWaalsContact CE-O 3.28Å; K183-Q205 WeakPolarHBondContact CE-O 3.4Å; K183-Q205 PolarHBondContact NZ-O 2.87Å
184	D	86.8	Confident	83.9	Confident	108 Å²	108	74.5 Å²	74.5	58%	0.578	39%	0.387	S	S	*	.	H	α-helix	trans	-64.9	-43.3	179.2	-77.5	-15.2	0	0	0	111.6	A180 E181 L186 R187	A180-D184 PolarHBondContact O-N 2.93Å; E181-D184 PolarHBondContact O-N 3.39Å; D184-L186 PolarHBondContact O-N 3.24Å; D184-R187 VanDerWaalsContact O-CB 3.28Å; D184-R187 WeakPolarHBondContact O-CB 3.21Å; D184-R187 PolarHBondContact O-N 2.55Å
185	N	90.8	Very high	83.6	Confident	135 Å²	135	78.2 Å²	78.2	72%	0.722	40%	0.397	S	S	*	.	H	α-helix	trans	-62.8	-28.4	176.7	-74.8	-39.3	0	0	0	113.5	E181	E181-N185 WeakPolarHBondContact O-CB 3.23Å; E181-N185 VanDerWaalsContact O-CG 3.24Å; E181-N185 PolarHBondContact O-N 3.19Å; E181-N185 VanDerWaalsContact O-N 3.08Å; E181-N185 PolarHBondContact O-ND2 3.36Å
186	L	89.6	Confident	82.7	Confident	8 Å²	8	79.7 Å²	79.7	4%	0.042	42%	0.416	C	S	.	.	H	α-helix	trans	-102.5	2.6	-179.3	-63.1	178.4	0	0	0	113.2	E182 K183 D184 E188 K189 L190 Y225 K227 Y232	E182-L186 HydrophobicContact CG-CD1 3.95Å; E182-L186 WeakPolarHBondContact O-CB 3.31Å; E182-L186 VanDerWaalsContact O-CG 3.32Å; E182-L186 WeakPolarHBondContact O-CG 3.21Å; E182-L186 PolarHBondContact O-N 3.05Å; E182-L186 VanDerWaalsContact O-N 3.13Å; K183-L186 CarbonylContact O-C 3.56Å; K183-L186 PolarHBondContact O-N 3.4Å; D184-L186 PolarHBondContact O-N 3.24Å; L186-E188 PolarHBondContact O-N 3.46Å; L186-K189 HydrophobicContact CD2-CD 4.39Å; L186-K189 PolarHBondContact O-N 3.21Å; L186-L190 HydrophobicContact CB-CD1 4.04Å; L186-L190 HydrophobicContact CB-CG 3.99Å; L186-L190 WeakPolarHBondContact O-CG 3.43Å; L186-L190 PolarHBondContact O-N 3.19Å; L186-Y225 HydrophobicContact CD1-CE1 4.17Å; L186-Y225 HydrophobicContact CD2-CE1 3.82Å; L186-Y225 HydrophobicContact CG-CE1 4.5Å; L186-K227 HydrophobicContact CD2-CD 4.41Å; L186-Y232 HydrophobicContact CD1-CD1 3.94Å; L186-Y232 HydrophobicContact CD1-CE1 3.4Å; L186-Y232 VanDerWaalsContact CD1-CE1 3.4Å; L186-Y232 HydrophobicContact CD1-CE2 4.35Å
187	R	85.6	Confident	81.7	Confident	116 Å²	116	74.7 Å²	74.7	44%	0.438	39%	0.391	S	S	.	.	H	α-helix	trans	-49.3	-52.4	-169.1	-174.3	-176.3	-177	179.1	12.7	113.6	K183 D184 K189 L190 T191 L202 E203	K183-R187 WeakPolarHBondContact O-CA 3.49Å; K183-R187 PolarHBondContact O-N 3.39Å; D184-R187 VanDerWaalsContact O-CB 3.28Å; D184-R187 WeakPolarHBondContact O-CB 3.21Å; D184-R187 PolarHBondContact O-N 2.55Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.4Å; R187-L190 PolarHBondContact O-N 3.08Å; R187-T191 WeakPolarHBondContact O-CB 3.37Å; R187-T191 PolarHBondContact O-N 2.72Å; R187-T191 PolarHBondContact O-OG1 3.31Å; R187-L202 HydrophobicContact CG-CD2 4.06Å; R187-E203 IonicContact CZ-OE1 3.89Å; R187-E203 IonicContact NH1-OE1 3.84Å; R187-E203 IonicContact NH2-OE1 3.69Å; R187-E203 PolarHBondContact NH2-OE1 2.82Å
188	E	86.1	Confident	80.2	Confident	147 Å²	147	76.3 Å²	76.3	69%	0.687	41%	0.406	S	S	*	.	H	α-helix	trans	-59.9	-45.4	-179.4	-173.7	-177	-176.7	0	0	111.5	L186 T191 I192	L186-E188 PolarHBondContact O-N 3.46Å; E188-T191 WeakPolarHBondContact O-CB 3.45Å; E188-T191 PolarHBondContact O-N 2.93Å; E188-I192 HydrophobicContact CG-CD1 3.95Å; E188-I192 WeakPolarHBondContact O-CG1 3.48Å; E188-I192 PolarHBondContact O-N 3.25Å
189	K	89.9	Confident	78.5	Confident	102 Å²	102	79.1 Å²	79.1	44%	0.443	44%	0.439	S	S	.	.	H	α-helix	trans	-68.8	-40.1	-178	-57.2	-177.5	-177	176.2	0	112	L186 R187 T191 S193 Y225	L186-K189 HydrophobicContact CD2-CD 4.39Å; L186-K189 PolarHBondContact O-N 3.21Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.4Å; K189-T191 VanDerWaalsContact C-N 3.32Å; K189-S193 VanDerWaalsContact O-CB 3.28Å; K189-S193 WeakPolarHBondContact O-CB 3.4Å; K189-S193 PolarHBondContact O-N 2.96Å; K189-S193 PolarHBondContact O-OG 2.91Å; K189-Y225 HydrophobicContact CB-CD2 3.81Å; K189-Y225 HydrophobicContact CB-CE1 4.46Å; K189-Y225 HydrophobicContact CB-CE2 3.72Å; K189-Y225 HydrophobicContact CB-CG 4.24Å; K189-Y225 HydrophobicContact CD-CD2 4.48Å; K189-Y225 HydrophobicContact CD-CE1 4.29Å; K189-Y225 HydrophobicContact CD-CE2 3.56Å; K189-Y225 VanDerWaalsContact CD-CZ 3.44Å; K189-Y225 WeakPolarHBondContact CD-OH 3.42Å; K189-Y225 HydrophobicContact CG-CE2 4.17Å; K189-Y225 PolarHBondContact NZ-OH 3.01Å
190	L	87.4	Confident	76.9	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-63.1	-40.5	173.7	-65.8	178.4	0	0	0	111	I178 K183 L186 R187 S193 S194 L202 F207 Y225 Y232	I178-L190 HydrophobicContact CD1-CD1 4.1Å; K183-L190 HydrophobicContact CG-CD1 4.47Å; L186-L190 HydrophobicContact CB-CD1 4.04Å; L186-L190 HydrophobicContact CB-CG 3.99Å; L186-L190 WeakPolarHBondContact O-CG 3.43Å; L186-L190 PolarHBondContact O-N 3.19Å; R187-L190 PolarHBondContact O-N 3.08Å; L190-S193 WeakPolarHBondContact CA-OG 3.45Å; L190-S193 PolarHBondContact O-OG 2.95Å; L190-S193 VanDerWaalsContact O-OG 3.13Å; L190-S194 WeakPolarHBondContact O-CB 3.4Å; L190-S194 PolarHBondContact O-N 3.36Å; L190-S194 PolarHBondContact O-OG 3.45Å; L190-L202 HydrophobicContact CB-CD2 4.15Å; L190-F207 HydrophobicContact CB-CE1 4.12Å; L190-F207 HydrophobicContact CB-CZ 4.08Å; L190-F207 HydrophobicContact CD1-CD1 4.14Å; L190-F207 HydrophobicContact CD1-CD2 4.17Å; L190-F207 HydrophobicContact CD1-CE1 4.25Å; L190-F207 HydrophobicContact CD1-CE2 4.28Å; L190-F207 HydrophobicContact CD1-CG 4.1Å; L190-F207 HydrophobicContact CD1-CZ 4.32Å; L190-F207 HydrophobicContact CD2-CD1 3.93Å; L190-F207 HydrophobicContact CD2-CE1 3.96Å; L190-F207 HydrophobicContact CG-CD1 4.5Å; L190-F207 HydrophobicContact CG-CE1 4.32Å; L190-Y225 HydrophobicContact CD2-CD1 4.23Å; L190-Y225 HydrophobicContact CD2-CG 4.45Å; L190-Y232 HydrophobicContact CD2-CD1 4.42Å; L190-Y232 HydrophobicContact CD2-CG 4.16Å
191	T	82.3	Confident	75.7	Confident	69 Å²	69	82.7 Å²	82.7	42%	0.423	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-48.2	177.1	-51.9	0	0	0	0	111.9	R187 E188 K189 S193 L202	R187-T191 WeakPolarHBondContact O-CB 3.37Å; R187-T191 PolarHBondContact O-N 2.72Å; R187-T191 PolarHBondContact O-OG1 3.31Å; E188-T191 WeakPolarHBondContact O-CB 3.45Å; E188-T191 PolarHBondContact O-N 2.93Å; K189-T191 VanDerWaalsContact C-N 3.32Å; T191-S193 PolarHBondContact O-N 3.07Å; T191-L202 HydrophobicContact CG2-CD1 4.44Å; T191-L202 WeakPolarHBondContact OG1-CD1 3.42Å
192	I	83.6	Confident	74.6	Confident	131 Å²	131	76.3 Å²	76.3	67%	0.672	41%	0.409	S	S	*	.	H	α-helix	trans	-66.4	-39.2	-178.7	-66.7	164.2	0	0	0	111.7	E188	E188-I192 HydrophobicContact CG-CD1 3.95Å; E188-I192 WeakPolarHBondContact O-CG1 3.48Å; E188-I192 PolarHBondContact O-N 3.25Å
193	S	82.2	Confident	73.3	Confident	19 Å²	19	79.7 Å²	79.7	13%	0.133	43%	0.425	C	S	.	.	H	α-helix	trans	-80.7	-23.3	-175.4	58.9	0	0	0	0	114	K189 L190 T191 Y195 K223 Y225	K189-S193 VanDerWaalsContact O-CB 3.28Å; K189-S193 WeakPolarHBondContact O-CB 3.4Å; K189-S193 PolarHBondContact O-N 2.96Å; K189-S193 PolarHBondContact O-OG 2.91Å; L190-S193 WeakPolarHBondContact CA-OG 3.45Å; L190-S193 PolarHBondContact O-OG 2.95Å; L190-S193 VanDerWaalsContact O-OG 3.13Å; T191-S193 PolarHBondContact O-N 3.07Å; S193-Y195 PolarHBondContact O-N 3.42Å; S193-K223 CarbonylContact O-C 3.59Å; S193-K223 VanDerWaalsContact O-O 3.09Å; S193-Y225 WeakPolarHBondContact OG-CB 3.25Å; S193-Y225 PolarHBondContact OG-N 2.87Å
194	S	73.4	Confident	72.5	Confident	4 Å²	4	85.4 Å²	85.4	3%	0.028	45%	0.452	C	S	.	.			trans	-99.9	85.4	-175.4	-54.5	0	0	0	0	110.4	L190 A196 A197	L190-S194 WeakPolarHBondContact O-CB 3.4Å; L190-S194 PolarHBondContact O-N 3.36Å; L190-S194 PolarHBondContact O-OG 3.45Å; S194-A196 PolarHBondContact O-N 3.32Å; S194-A197 WeakPolarHBondContact O-CB 2.92Å; S194-A197 PolarHBondContact O-N 3.02Å
195	Y	62	Low	71.9	Confident	201 Å²	201	81.7 Å²	81.7	79%	0.788	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-54.9	-28	-177.1	-152.7	-92.7	0	0	0	113.8	S193 A197 S198	S193-Y195 PolarHBondContact O-N 3.42Å; Y195-A197 VanDerWaalsContact C-N 3.31Å; Y195-A197 PolarHBondContact O-N 3.44Å; Y195-S198 PolarHBondContact O-OG 2.95Å
196	A	55.5	Low	71.5	Confident	63 Å²	63	79.6 Å²	79.6	52%	0.521	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-76.9	-8.5	178.1	0	0	0	0	0	114.6	S194 S198	S194-A196 PolarHBondContact O-N 3.32Å; A196-S198 VanDerWaalsContact C-N 3.31Å; A196-S198 PolarHBondContact O-N 2.84Å
197	A	52.3	Low	71.3	Confident	13 Å²	13	79.2 Å²	79.2	11%	0.107	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-85.8	2.3	-178.3	0	0	0	0	0	114	S194 Y195 G199 L202	S194-A197 WeakPolarHBondContact O-CB 2.92Å; S194-A197 PolarHBondContact O-N 3.02Å; Y195-A197 VanDerWaalsContact C-N 3.31Å; Y195-A197 PolarHBondContact O-N 3.44Å; A197-G199 PolarHBondContact O-N 3.02Å; A197-L202 HydrophobicContact CB-CD1 3.94Å
198	S	50.4	Low	71.4	Confident	112 Å²	112	74.5 Å²	74.5	78%	0.783	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-1.9	-174.2	-55.7	0	0	0	0	115.3	Y195 A196	Y195-S198 PolarHBondContact O-OG 2.95Å; A196-S198 VanDerWaalsContact C-N 3.31Å; A196-S198 PolarHBondContact O-N 2.84Å
199	G	51.2	Low	71.6	Confident	77 Å²	77	70.6 Å²	70.6	79%	0.794	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	-4.5	179	0	0	0	0	0	116.6	A197	A197-G199 PolarHBondContact O-N 3.02Å
200	V	54.3	Low	71.5	Confident	68 Å²	68	65.8 Å²	65.8	41%	0.412	36%	0.36	S	S	.	.	S	Bend	trans	-110.5	133.1	176	-179.3	0	0	0	0	107.7	L202 Q205	V200-L202 PolarHBondContact O-N 3.23Å; V200-Q205 HydrophobicContact CG1-CG 4.05Å
201	K	61	Low	71.6	Confident	140 Å²	140	68.5 Å²	68.5	61%	0.609	38%	0.378	S	S	*	.			trans	-56.2	117.1	174.1	-70.9	-177.4	-179.3	179	0	108.4	E203 E204	K201-E203 PolarHBondContact O-N 2.94Å; K201-E204 PolarHBondContact O-N 3.12Å
202	L	65.2	Low	72	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-52.4	-25.2	177.7	-148.3	111.5	0	0	0	112.2	K183 R187 L190 T191 A197 V200 E204 Q205 F207	K183-L202 WeakPolarHBondContact CE-O 3.28Å; K183-L202 PolarHBondContact NZ-O 2.75Å; R187-L202 HydrophobicContact CG-CD2 4.06Å; L190-L202 HydrophobicContact CB-CD2 4.15Å; T191-L202 HydrophobicContact CG2-CD1 4.44Å; T191-L202 WeakPolarHBondContact OG1-CD1 3.42Å; A197-L202 HydrophobicContact CB-CD1 3.94Å; V200-L202 PolarHBondContact O-N 3.23Å; L202-E204 VanDerWaalsContact C-N 3.29Å; L202-E204 PolarHBondContact O-N 2.85Å; L202-Q205 PolarHBondContact O-N 3.16Å; L202-F207 HydrophobicContact CD1-CZ 4.34Å; L202-F207 HydrophobicContact CD2-CE2 4.14Å; L202-F207 HydrophobicContact CD2-CZ 4.43Å; L202-F207 HydrophobicContact CG-CE2 4.05Å; L202-F207 HydrophobicContact CG-CZ 4.25Å
203	E	63	Low	72.3	Confident	119 Å²	119	69 Å²	69	56%	0.556	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-58.6	-35.5	176.3	-68.1	174.8	-169.3	0	0	112.8	K183 R187 K201	K183-E203 PolarHBondContact NZ-O 2.93Å; R187-E203 IonicContact CZ-OE1 3.89Å; R187-E203 IonicContact NH1-OE1 3.84Å; R187-E203 IonicContact NH2-OE1 3.69Å; R187-E203 PolarHBondContact NH2-OE1 2.82Å; K201-E203 PolarHBondContact O-N 2.94Å
204	E	69.4	Low	72.4	Confident	146 Å²	146	71.4 Å²	71.4	68%	0.682	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-88.8	-10.3	-176.3	-66.1	172.6	-167.4	0	0	113.8	K201 L202	K201-E204 PolarHBondContact O-N 3.12Å; L202-E204 VanDerWaalsContact C-N 3.29Å; L202-E204 PolarHBondContact O-N 2.85Å
205	Q	75.6	Confident	73	Confident	30 Å²	30	71.3 Å²	71.3	14%	0.14	38%	0.382	C	S	.	.			trans	-97	129.1	-178.1	-72.7	-166.5	4	0	0	113.2	K183 V200 L202 F207	K183-Q205 VanDerWaalsContact CE-O 3.28Å; K183-Q205 WeakPolarHBondContact CE-O 3.4Å; K183-Q205 PolarHBondContact NZ-O 2.87Å; V200-Q205 HydrophobicContact CG1-CG 4.05Å; L202-Q205 PolarHBondContact O-N 3.16Å; Q205-F207 HydrophobicContact CB-CE2 4.37Å
206	D	81.1	Confident	74.3	Confident	90 Å²	90	66 Å²	66	48%	0.481	37%	0.367	S	S	.	.			trans	-74.3	143.3	169.5	-65.9	-37.5	0	0	0	111.5	T177 H235	T177-D206 HydrophobicContact CG2-CB 4.24Å; D206-H235 HydrophobicContact CB-CB 4.36Å; D206-H235 PolarHBondContact O-N 3.39Å
207	F	86.5	Confident	75.8	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.1	174.2	-78.3	-97	0	0	0	110.1	T177 I178 L190 L202 Q205 I233 P234	T177-F207 VanDerWaalsContact CA-O 3.31Å; T177-F207 WeakPolarHBondContact CA-O 3.16Å; I178-F207 HydrophobicContact CD1-CB 3.58Å; I178-F207 HydrophobicContact CD1-CG 4.37Å; I178-F207 HydrophobicContact CG1-CB 3.85Å; I178-F207 PolarHBondContact N-O 3.22Å; L190-F207 HydrophobicContact CB-CE1 4.12Å; L190-F207 HydrophobicContact CB-CZ 4.08Å; L190-F207 HydrophobicContact CD1-CD1 4.14Å; L190-F207 HydrophobicContact CD1-CD2 4.17Å; L190-F207 HydrophobicContact CD1-CE1 4.25Å; L190-F207 HydrophobicContact CD1-CE2 4.28Å; L190-F207 HydrophobicContact CD1-CG 4.1Å; L190-F207 HydrophobicContact CD1-CZ 4.32Å; L190-F207 HydrophobicContact CD2-CD1 3.93Å; L190-F207 HydrophobicContact CD2-CE1 3.96Å; L190-F207 HydrophobicContact CG-CD1 4.5Å; L190-F207 HydrophobicContact CG-CE1 4.32Å; L202-F207 HydrophobicContact CD1-CZ 4.34Å; L202-F207 HydrophobicContact CD2-CE2 4.14Å; L202-F207 HydrophobicContact CD2-CZ 4.43Å; L202-F207 HydrophobicContact CG-CE2 4.05Å; L202-F207 HydrophobicContact CG-CZ 4.25Å; Q205-F207 HydrophobicContact CB-CE2 4.37Å; F207-I233 CarbonylContact C-O 3.5Å; F207-I233 WeakPolarHBondContact CA-O 3.5Å; F207-P234 HydrophobicContact CD1-CB 4.27Å; F207-P234 HydrophobicContact CE1-CB 3.9Å; F207-P234 HydrophobicContact CE1-CG 4.43Å; F207-P234 HydrophobicContact CZ-CB 4.19Å
208	Y	87.5	Confident	77.5	Confident	16 Å²	16	65.2 Å²	65.2	6%	0.063	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.6	176.5	-64.3	-87.6	0	0	0	110.1	Y175 T177 Y232 I233 H235 I238	Y175-Y208 WeakPolarHBondContact O-CD1 3.07Å; T177-Y208 HydrophobicContact CG2-CD1 4.1Å; T177-Y208 HydrophobicContact CG2-CE1 3.65Å; Y208-Y232 WeakPolarHBondContact O-CA 3.22Å; Y208-I233 PolarHBondContact N-O 2.94Å; Y208-I233 PolarHBondContact O-N 2.8Å; Y208-H235 HydrophobicContact CE2-CB 3.8Å; Y208-H235 AromaticContact CE2-CG 3.98Å; Y208-H235 AromaticContact CE2-ND1 3.44Å; Y208-H235 WeakPolarHBondContact CE2-ND1 3.26Å; Y208-H235 AromaticContact CZ-ND1 3.61Å; Y208-H235 PolarHBondContact OH-ND1 2.85Å; Y208-I238 HydrophobicContact CD1-CD1 4.42Å; Y208-I238 HydrophobicContact CD2-CD1 4.11Å; Y208-I238 HydrophobicContact CG-CD1 4Å
209	K	90.1	Very high	79.5	Confident	66 Å²	66	61.4 Å²	61.4	29%	0.287	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115.3	172.1	-175.4	177.3	-173.4	167.7	0	109.3	N176 I178 E182 Y230 Y232	N176-K209 PolarHBondContact O-N 3.33Å; I178-K209 HydrophobicContact CG2-CB 3.78Å; E182-K209 IonicContact OE1-NZ 3.12Å; E182-K209 PolarHBondContact OE1-NZ 3.25Å; E182-K209 VanDerWaalsContact OE1-NZ 3.12Å; K209-Y230 HydrophobicContact CD-CD1 4.5Å; K209-Y230 HydrophobicContact CD-CG 4.45Å; K209-Y230 HydrophobicContact CG-CD1 3.88Å; K209-Y230 HydrophobicContact CG-CG 4.02Å; K209-Y232 HydrophobicContact CB-CE1 4.47Å; K209-Y232 HydrophobicContact CD-CE1 4.25Å; K209-Y232 WeakPolarHBondContact CE-OH 3.4Å; K209-Y232 HydrophobicContact CG-CE1 4.29Å; K209-Y232 PolarHBondContact NZ-OH 3.41Å
210	V	88	Confident	81.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153.1	-176.8	-47.2	0	0	0	0	110.9	Y175 F212 A215 Y230 A231 I233 I241	Y175-V210 HydrophobicContact CD1-CB 3.89Å; Y175-V210 HydrophobicContact CD1-CG1 3.24Å; Y175-V210 HydrophobicContact CD2-CG1 4.45Å; Y175-V210 HydrophobicContact CE1-CB 3.99Å; Y175-V210 HydrophobicContact CE1-CG1 3.72Å; Y175-V210 HydrophobicContact CG-CG1 3.65Å; V210-F212 PolarHBondContact O-N 2.98Å; V210-A215 HydrophobicContact CG2-CB 4.13Å; V210-Y230 CarbonylContact O-C 3.45Å; V210-Y230 VanDerWaalsContact O-CA 3.25Å; V210-Y230 WeakPolarHBondContact O-CA 3.36Å; V210-A231 HydrophobicContact CG2-CB 4.1Å; V210-A231 PolarHBondContact N-O 3.49Å; V210-A231 PolarHBondContact O-N 3.19Å; V210-I233 HydrophobicContact CB-CD1 4.49Å; V210-I233 HydrophobicContact CG1-CD1 4.4Å; V210-I233 HydrophobicContact CG2-CD1 3.27Å; V210-I233 HydrophobicContact CG2-CG1 4.21Å; V210-I241 HydrophobicContact CG1-CD1 4.06Å; V210-I241 HydrophobicContact CG2-CD1 4.17Å
211	P	89.8	Confident	83	Confident	58 Å²	58	66.5 Å²	66.5	38%	0.377	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	132.4	167.6	-23.3	34.2	0	0	0	110.6	Q213 D214	P211-Q213 PolarHBondContact O-N 2.82Å; P211-D214 WeakPolarHBondContact CD-OD2 3.42Å; P211-D214 PolarHBondContact O-N 3.42Å
212	F	90.4	Very high	84.4	Confident	76 Å²	76	70.4 Å²	70.4	33%	0.333	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-60.6	-23.7	-173.2	85.3	-83.2	0	0	0	113.7	V210 D214 A215 L216 V219 L226 G229 A231	V210-F212 PolarHBondContact O-N 2.98Å; F212-D214 PolarHBondContact O-N 3.35Å; F212-A215 CarbonylContact O-C 3.49Å; F212-A215 PolarHBondContact O-N 3.26Å; F212-A215 VanDerWaalsContact O-N 3.11Å; F212-L216 HydrophobicContact CD2-CD2 4.02Å; F212-L216 HydrophobicContact CE2-CD2 3.98Å; F212-L216 PolarHBondContact O-N 2.74Å; F212-V219 HydrophobicContact CB-CG2 4.45Å; F212-L226 HydrophobicContact CB-CD2 3.79Å; F212-G229 WeakPolarHBondContact CD1-O 3.42Å; F212-G229 PolarHBondContact N-O 3.43Å; F212-A231 HydrophobicContact CB-CB 4.32Å
213	Q	88.8	Confident	85.4	Confident	135 Å²	135	74.6 Å²	74.6	63%	0.631	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-64.7	-24.9	177.8	-60.2	179.5	12.3	0	0	112.7	P211 A215 L216	P211-Q213 PolarHBondContact O-N 2.82Å; Q213-A215 VanDerWaalsContact C-N 3.29Å; Q213-L216 WeakPolarHBondContact O-CG 3.46Å
214	D	84.1	Confident	86.7	Confident	69 Å²	69	69.4 Å²	69.4	37%	0.369	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-82.1	-14.2	177.5	-59.1	-29.1	0	0	0	111.5	P211 F212 I241	P211-D214 WeakPolarHBondContact CD-OD2 3.42Å; P211-D214 PolarHBondContact O-N 3.42Å; F212-D214 PolarHBondContact O-N 3.35Å; D214-I241 HydrophobicContact CB-CG2 4.15Å
215	A	87.8	Confident	87.8	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.008	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-121.1	26.2	-173.5	0	0	0	0	0	113.9	V210 F212 Q213 D217 L218 V219 A231 I233	V210-A215 HydrophobicContact CG2-CB 4.13Å; F212-A215 CarbonylContact O-C 3.49Å; F212-A215 PolarHBondContact O-N 3.26Å; F212-A215 VanDerWaalsContact O-N 3.11Å; Q213-A215 VanDerWaalsContact C-N 3.29Å; A215-D217 PolarHBondContact O-N 2.8Å; A215-D217 VanDerWaalsContact O-N 3.08Å; A215-L218 PolarHBondContact O-N 3.49Å; A215-V219 WeakPolarHBondContact O-CG2 3.4Å; A215-V219 PolarHBondContact O-N 3.04Å; A215-A231 HydrophobicContact CB-CB 4.07Å; A215-I233 HydrophobicContact CB-CD1 3.35Å; A215-I233 HydrophobicContact CB-CG1 4.5Å
216	L	88.8	Confident	88.7	Confident	90 Å²	90	66.5 Å²	66.5	47%	0.471	31%	0.312	S	S	.	.	H	α-helix	trans	-54.6	-33.5	-172.2	-69.1	173.5	0	0	0	114.3	F212 Q213 L218 V219 R220	F212-L216 HydrophobicContact CD2-CD2 4.02Å; F212-L216 HydrophobicContact CE2-CD2 3.98Å; F212-L216 PolarHBondContact O-N 2.74Å; Q213-L216 WeakPolarHBondContact O-CG 3.46Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L216-L218 PolarHBondContact O-N 3.01Å; L216-V219 PolarHBondContact O-N 3.36Å; L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 PolarHBondContact O-N 3.37Å
217	D	86.6	Confident	89.4	Confident	52 Å²	52	65.8 Å²	65.8	28%	0.278	30%	0.304	S	S	.	.	H	α-helix	trans	-69.5	-31.6	178.4	-74.5	-33	0	0	0	113.8	A215 R220 T221 N244	A215-D217 PolarHBondContact O-N 2.8Å; A215-D217 VanDerWaalsContact O-N 3.08Å; D217-R220 IonicContact OD1-CZ 3.97Å; D217-R220 IonicContact OD1-NE 2.86Å; D217-R220 IonicContact OD1-NH1 3.46Å; D217-R220 PolarHBondContact OD1-NH1 3.38Å; D217-T221 PolarHBondContact O-OG1 3.48Å; D217-N244 PolarHBondContact OD2-ND2 3.28Å; D217-N244 PolarHBondContact OD2-OD1 2.91Å
218	L	89.1	Confident	89.7	Confident	7 Å²	7	73.1 Å²	73.1	4%	0.037	34%	0.339	C	S	.	.	H	α-helix	trans	-78.4	-38	174	-60	176.4	0	0	0	110.4	A215 L216 T221 R222 K223 V224 I233 E237 T240	A215-L218 PolarHBondContact O-N 3.49Å; L216-L218 VanDerWaalsContact C-N 3.35Å; L216-L218 PolarHBondContact O-N 3.01Å; L218-T221 PolarHBondContact O-N 3.37Å; L218-T221 PolarHBondContact O-OG1 2.67Å; L218-R222 PolarHBondContact O-N 3.04Å; L218-K223 HydrophobicContact CD2-CB 4.47Å; L218-K223 PolarHBondContact O-N 2.59Å; L218-V224 HydrophobicContact CB-CB 4.36Å; L218-V224 HydrophobicContact CB-CG1 3.64Å; L218-V224 HydrophobicContact CB-CG2 3.78Å; L218-V224 HydrophobicContact CD1-CG1 3.81Å; L218-V224 HydrophobicContact CG-CG1 4.28Å; L218-I233 HydrophobicContact CD1-CD1 4.2Å; L218-I233 HydrophobicContact CD1-CG1 4.43Å; L218-I233 HydrophobicContact CD1-CG2 3.77Å; L218-E237 HydrophobicContact CD1-CB 4.01Å; L218-T240 HydrophobicContact CD2-CG2 4.12Å; L218-T240 HydrophobicContact CG-CG2 4.15Å
219	V	91.3	Very high	90	Very high	32 Å²	32	74.5 Å²	74.5	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-63.6	-49.6	176.9	170.4	0	0	0	0	111.6	F212 A215 L216 T221 R222 V224 L226 A231	F212-V219 HydrophobicContact CB-CG2 4.45Å; A215-V219 WeakPolarHBondContact O-CG2 3.4Å; A215-V219 PolarHBondContact O-N 3.04Å; L216-V219 PolarHBondContact O-N 3.36Å; V219-T221 PolarHBondContact O-N 3.46Å; V219-T221 VanDerWaalsContact O-N 3.15Å; V219-R222 PolarHBondContact O-N 3.06Å; V219-V224 HydrophobicContact CG2-CG2 3.89Å; V219-L226 HydrophobicContact CG1-CD1 3.81Å; V219-L226 HydrophobicContact CG2-CD1 4.25Å; V219-L226 HydrophobicContact CG2-CD2 3.78Å; V219-L226 HydrophobicContact CG2-CG 4.38Å; V219-A231 HydrophobicContact CG2-CB 4.5Å
220	R	90.5	Very high	90.1	Very high	188 Å²	188	76.3 Å²	76.3	71%	0.709	36%	0.363	S	S	*	.	H	α-helix	trans	-60.1	-30.5	-177.7	84.9	-173.2	-167.2	-167.2	11.2	112.3	L216 D217	L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 PolarHBondContact O-N 3.37Å; D217-R220 IonicContact OD1-CZ 3.97Å; D217-R220 IonicContact OD1-NE 2.86Å; D217-R220 IonicContact OD1-NH1 3.46Å; D217-R220 PolarHBondContact OD1-NH1 3.38Å
221	T	89.2	Confident	90.3	Very high	64 Å²	64	76.3 Å²	76.3	39%	0.393	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	4.6	-179.8	56.3	0	0	0	0	113	D217 L218 V219 K223	D217-T221 PolarHBondContact O-OG1 3.48Å; L218-T221 PolarHBondContact O-N 3.37Å; L218-T221 PolarHBondContact O-OG1 2.67Å; V219-T221 PolarHBondContact O-N 3.46Å; V219-T221 VanDerWaalsContact O-N 3.15Å; T221-K223 VanDerWaalsContact C-N 3.25Å; T221-K223 PolarHBondContact O-N 3.08Å; T221-K223 WeakPolarHBondContact OG1-CD 3.15Å; T221-K223 WeakPolarHBondContact OG1-CG 3.21Å
222	R	88.9	Confident	90.4	Very high	223 Å²	223	73.6 Å²	73.6	84%	0.842	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	38.9	-179.1	-55.1	-178.6	-175.5	178	0.8	113.1	L218 V219	L218-R222 PolarHBondContact O-N 3.04Å; V219-R222 PolarHBondContact O-N 3.06Å
223	K	87.4	Confident	90.3	Very high	103 Å²	103	70 Å²	70	45%	0.448	33%	0.33	S	S	.	.			trans	-95.1	1.5	-178.9	-70.7	-174.7	178.5	-172.4	0	114.5	S193 L218 T221	S193-K223 CarbonylContact O-C 3.59Å; S193-K223 VanDerWaalsContact O-O 3.09Å; L218-K223 HydrophobicContact CD2-CB 4.47Å; L218-K223 PolarHBondContact O-N 2.59Å; T221-K223 VanDerWaalsContact C-N 3.25Å; T221-K223 PolarHBondContact O-N 3.08Å; T221-K223 WeakPolarHBondContact OG1-CD 3.15Å; T221-K223 WeakPolarHBondContact OG1-CG 3.21Å
224	V	90.6	Very high	90.2	Very high	10 Å²	10	63.8 Å²	63.8	6%	0.061	30%	0.301	C	S	.	.	S	Bend	trans	-141.6	151	-176.2	-69.7	0	0	0	0	110.2	L218 V219 A231 I233	L218-V224 HydrophobicContact CB-CB 4.36Å; L218-V224 HydrophobicContact CB-CG1 3.64Å; L218-V224 HydrophobicContact CB-CG2 3.78Å; L218-V224 HydrophobicContact CD1-CG1 3.81Å; L218-V224 HydrophobicContact CG-CG1 4.28Å; V219-V224 HydrophobicContact CG2-CG2 3.89Å; V224-A231 HydrophobicContact CG2-CB 4.3Å; V224-I233 HydrophobicContact CB-CG1 4.48Å; V224-I233 HydrophobicContact CG1-CB 4.46Å; V224-I233 HydrophobicContact CG1-CG1 3.91Å; V224-I233 HydrophobicContact CG1-CG2 4.43Å
225	Y	93	Very high	90	Very high	37 Å²	37	63.1 Å²	63.1	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	139.2	174.7	177.5	-117	0	0	0	110.8	L186 K189 L190 S193 K227 A231 Y232	L186-Y225 HydrophobicContact CD1-CE1 4.17Å; L186-Y225 HydrophobicContact CD2-CE1 3.82Å; L186-Y225 HydrophobicContact CG-CE1 4.5Å; K189-Y225 HydrophobicContact CB-CD2 3.81Å; K189-Y225 HydrophobicContact CB-CE1 4.46Å; K189-Y225 HydrophobicContact CB-CE2 3.72Å; K189-Y225 HydrophobicContact CB-CG 4.24Å; K189-Y225 HydrophobicContact CD-CD2 4.48Å; K189-Y225 HydrophobicContact CD-CE1 4.29Å; K189-Y225 HydrophobicContact CD-CE2 3.56Å; K189-Y225 VanDerWaalsContact CD-CZ 3.44Å; K189-Y225 WeakPolarHBondContact CD-OH 3.42Å; K189-Y225 HydrophobicContact CG-CE2 4.17Å; K189-Y225 PolarHBondContact NZ-OH 3.01Å; L190-Y225 HydrophobicContact CD2-CD1 4.23Å; L190-Y225 HydrophobicContact CD2-CG 4.45Å; S193-Y225 WeakPolarHBondContact OG-CB 3.25Å; S193-Y225 PolarHBondContact OG-N 2.87Å; Y225-K227 HydrophobicContact CE1-CB 3.67Å; Y225-K227 HydrophobicContact CE1-CD 4.38Å; Y225-A231 WeakPolarHBondContact O-CA 3.19Å; Y225-Y232 AromaticContact CD1-CD2 3.63Å; Y225-Y232 HydrophobicContact CD1-CD2 3.63Å; Y225-Y232 HydrophobicContact CD1-CE2 4.15Å; Y225-Y232 HydrophobicContact CD1-CG 4.06Å; Y225-Y232 HydrophobicContact CE1-CD2 4.23Å; Y225-Y232 HydrophobicContact CE1-CE2 4.29Å; Y225-Y232 PolarHBondContact O-N 3.05Å
226	L	94.1	Very high	89.6	Confident	79 Å²	79	66.6 Å²	66.6	41%	0.414	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.9	176.4	-68.6	-176.7	0	0	0	111	F212 V219 Y230 A231	F212-L226 HydrophobicContact CB-CD2 3.79Å; V219-L226 HydrophobicContact CG1-CD1 3.81Å; V219-L226 HydrophobicContact CG2-CD1 4.25Å; V219-L226 HydrophobicContact CG2-CD2 3.78Å; V219-L226 HydrophobicContact CG2-CG 4.38Å; L226-Y230 VanDerWaalsContact CA-O 3.31Å; L226-Y230 WeakPolarHBondContact CA-O 3.13Å; L226-Y230 WeakPolarHBondContact CD2-O 3.24Å; L226-A231 HydrophobicContact CD2-CB 3.63Å
227	K	94.4	Very high	89.4	Confident	74 Å²	74	64.5 Å²	64.5	32%	0.322	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	129	171.1	-175.6	-173.4	174.3	-169.4	0	109.7	L186 Y225 G229 Y230 Y232	L186-K227 HydrophobicContact CD2-CD 4.41Å; Y225-K227 HydrophobicContact CE1-CB 3.67Å; Y225-K227 HydrophobicContact CE1-CD 4.38Å; K227-G229 VanDerWaalsContact C-N 3.28Å; K227-G229 PolarHBondContact O-N 3.43Å; K227-G229 VanDerWaalsContact O-N 3.16Å; K227-Y230 PolarHBondContact N-O 3.36Å; K227-Y230 PolarHBondContact O-N 2.91Å; K227-Y232 HydrophobicContact CB-CE2 3.9Å
228	E	94.1	Very high	89.2	Confident	156 Å²	156	62.2 Å²	62.2	73%	0.729	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	39	170.1	-66.8	164.5	-164.7	0	0	114.4	Y230	E228-Y230 VanDerWaalsContact C-N 3.33Å; E228-Y230 VanDerWaalsContact O-CD2 3.29Å; E228-Y230 WeakPolarHBondContact O-CD2 3.41Å
229	G	92.5	Very high	89.1	Confident	45 Å²	45	62.4 Å²	62.4	46%	0.464	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	4.6	-179.5	0	0	0	0	0	115	F212 K227	F212-G229 WeakPolarHBondContact CD1-O 3.42Å; F212-G229 PolarHBondContact N-O 3.43Å; K227-G229 VanDerWaalsContact C-N 3.28Å; K227-G229 PolarHBondContact O-N 3.43Å; K227-G229 VanDerWaalsContact O-N 3.16Å
230	Y	92.7	Very high	89	Confident	104 Å²	104	62.5 Å²	62.5	41%	0.408	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.9	175.9	-64	-87.1	0	0	0	111.8	K209 V210 L226 K227 E228	K209-Y230 HydrophobicContact CD-CD1 4.5Å; K209-Y230 HydrophobicContact CD-CG 4.45Å; K209-Y230 HydrophobicContact CG-CD1 3.88Å; K209-Y230 HydrophobicContact CG-CG 4.02Å; V210-Y230 CarbonylContact O-C 3.45Å; V210-Y230 VanDerWaalsContact O-CA 3.25Å; V210-Y230 WeakPolarHBondContact O-CA 3.36Å; L226-Y230 VanDerWaalsContact CA-O 3.31Å; L226-Y230 WeakPolarHBondContact CA-O 3.13Å; L226-Y230 WeakPolarHBondContact CD2-O 3.24Å; K227-Y230 PolarHBondContact N-O 3.36Å; K227-Y230 PolarHBondContact O-N 2.91Å; E228-Y230 VanDerWaalsContact C-N 3.33Å; E228-Y230 VanDerWaalsContact O-CD2 3.29Å; E228-Y230 WeakPolarHBondContact O-CD2 3.41Å
231	A	92.5	Very high	88.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.4	167.8	0	0	0	0	0	110.3	V210 F212 A215 V219 V224 Y225 L226 I233	V210-A231 HydrophobicContact CG2-CB 4.1Å; V210-A231 PolarHBondContact N-O 3.49Å; V210-A231 PolarHBondContact O-N 3.19Å; F212-A231 HydrophobicContact CB-CB 4.32Å; A215-A231 HydrophobicContact CB-CB 4.07Å; V219-A231 HydrophobicContact CG2-CB 4.5Å; V224-A231 HydrophobicContact CG2-CB 4.3Å; Y225-A231 WeakPolarHBondContact O-CA 3.19Å; L226-A231 HydrophobicContact CD2-CB 3.63Å; A231-I233 HydrophobicContact CB-CD1 4.14Å; A231-I233 HydrophobicContact CB-CG1 4.16Å
232	Y	91.2	Very high	88.8	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.4	177.8	-67.4	-105.1	0	0	0	108.8	I178 E182 L186 L190 Y208 K209 Y225 K227	I178-Y232 HydrophobicContact CD1-CD1 4.29Å; I178-Y232 HydrophobicContact CG2-CD1 3.89Å; I178-Y232 HydrophobicContact CG2-CE1 3.81Å; E182-Y232 HydrophobicContact CG-CE1 4.4Å; E182-Y232 WeakPolarHBondContact OE1-CE1 3.42Å; E182-Y232 PolarHBondContact OE1-OH 3.17Å; L186-Y232 HydrophobicContact CD1-CD1 3.94Å; L186-Y232 HydrophobicContact CD1-CE1 3.4Å; L186-Y232 VanDerWaalsContact CD1-CE1 3.4Å; L186-Y232 HydrophobicContact CD1-CE2 4.35Å; L190-Y232 HydrophobicContact CD2-CD1 4.42Å; L190-Y232 HydrophobicContact CD2-CG 4.16Å; Y208-Y232 WeakPolarHBondContact O-CA 3.22Å; K209-Y232 HydrophobicContact CB-CE1 4.47Å; K209-Y232 HydrophobicContact CD-CE1 4.25Å; K209-Y232 WeakPolarHBondContact CE-OH 3.4Å; K209-Y232 HydrophobicContact CG-CE1 4.29Å; K209-Y232 PolarHBondContact NZ-OH 3.41Å; Y225-Y232 AromaticContact CD1-CD2 3.63Å; Y225-Y232 HydrophobicContact CD1-CD2 3.63Å; Y225-Y232 HydrophobicContact CD1-CE2 4.15Å; Y225-Y232 HydrophobicContact CD1-CG 4.06Å; Y225-Y232 HydrophobicContact CE1-CD2 4.23Å; Y225-Y232 HydrophobicContact CE1-CE2 4.29Å; Y225-Y232 PolarHBondContact O-N 3.05Å; K227-Y232 HydrophobicContact CB-CE2 3.9Å
233	I	88.8	Confident	89	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.7	-162.8	-53.7	176.6	0	0	0	109.1	F207 Y208 V210 A215 L218 V224 A231 E237 I241	F207-I233 CarbonylContact C-O 3.5Å; F207-I233 WeakPolarHBondContact CA-O 3.5Å; Y208-I233 PolarHBondContact N-O 2.94Å; Y208-I233 PolarHBondContact O-N 2.8Å; V210-I233 HydrophobicContact CB-CD1 4.49Å; V210-I233 HydrophobicContact CG1-CD1 4.4Å; V210-I233 HydrophobicContact CG2-CD1 3.27Å; V210-I233 HydrophobicContact CG2-CG1 4.21Å; A215-I233 HydrophobicContact CB-CD1 3.35Å; A215-I233 HydrophobicContact CB-CG1 4.5Å; L218-I233 HydrophobicContact CD1-CD1 4.2Å; L218-I233 HydrophobicContact CD1-CG1 4.43Å; L218-I233 HydrophobicContact CD1-CG2 3.77Å; V224-I233 HydrophobicContact CB-CG1 4.48Å; V224-I233 HydrophobicContact CG1-CB 4.46Å; V224-I233 HydrophobicContact CG1-CG1 3.91Å; V224-I233 HydrophobicContact CG1-CG2 4.43Å; A231-I233 HydrophobicContact CB-CD1 4.14Å; A231-I233 HydrophobicContact CB-CG1 4.16Å; I233-E237 HydrophobicContact CG2-CB 3.52Å; I233-I241 HydrophobicContact CD1-CD1 3.28Å; I233-I241 HydrophobicContact CD1-CG1 3.96Å; I233-I241 HydrophobicContact CG1-CD1 4.45Å; I233-I241 HydrophobicContact CG2-CD1 4.32Å
234	P	86.4	Confident	89	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	152.9	177.6	29.4	-35.1	0	0	0	110.9	F207 N236 E237 I238	F207-P234 HydrophobicContact CD1-CB 4.27Å; F207-P234 HydrophobicContact CE1-CB 3.9Å; F207-P234 HydrophobicContact CE1-CG 4.43Å; F207-P234 HydrophobicContact CZ-CB 4.19Å; P234-N236 WeakPolarHBondContact CB-OD1 3.09Å; P234-N236 WeakPolarHBondContact CG-OD1 3.39Å; P234-N236 PolarHBondContact O-N 3.16Å; P234-N236 VanDerWaalsContact O-N 3.12Å; P234-E237 HydrophobicContact CG-CB 4.06Å; P234-E237 HydrophobicContact CG-CG 3.87Å; P234-E237 PolarHBondContact O-N 2.92Å; P234-I238 PolarHBondContact O-N 3.49Å
235	H	80.3	Confident	89	Confident	56 Å²	56	38.7 Å²	38.7	26%	0.259	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-54.4	-34.9	-176.4	-178.9	88.3	0	0	0	114	D206 Y208 E237 I238	D206-H235 HydrophobicContact CB-CB 4.36Å; D206-H235 PolarHBondContact O-N 3.39Å; Y208-H235 HydrophobicContact CE2-CB 3.8Å; Y208-H235 AromaticContact CE2-CG 3.98Å; Y208-H235 AromaticContact CE2-ND1 3.44Å; Y208-H235 WeakPolarHBondContact CE2-ND1 3.26Å; Y208-H235 AromaticContact CZ-ND1 3.61Å; Y208-H235 PolarHBondContact OH-ND1 2.85Å; H235-E237 PolarHBondContact O-N 2.95Å; H235-I238 WeakPolarHBondContact O-CG2 3.45Å; H235-I238 PolarHBondContact O-N 2.79Å
236	N	79.4	Confident	89.1	Confident	74 Å²	74	37 Å²	37	40%	0.396	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-65	-22.9	176.8	63	-19.6	0	0	0	113.8	P234 V239	P234-N236 WeakPolarHBondContact CB-OD1 3.09Å; P234-N236 WeakPolarHBondContact CG-OD1 3.39Å; P234-N236 PolarHBondContact O-N 3.16Å; P234-N236 VanDerWaalsContact O-N 3.12Å; N236-V239 WeakPolarHBondContact O-CG1 3.45Å
237	E	84.4	Confident	89	Confident	45 Å²	45	37.9 Å²	37.9	21%	0.21	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-96.9	-6.2	-179.3	-71.3	-66.2	170.8	0	0	113.5	L218 I233 P234 H235 V239 T240	L218-E237 HydrophobicContact CD1-CB 4.01Å; I233-E237 HydrophobicContact CG2-CB 3.52Å; P234-E237 HydrophobicContact CG-CB 4.06Å; P234-E237 HydrophobicContact CG-CG 3.87Å; P234-E237 PolarHBondContact O-N 2.92Å; H235-E237 PolarHBondContact O-N 2.95Å; E237-V239 PolarHBondContact O-N 3.29Å; E237-V239 VanDerWaalsContact O-N 3.12Å; E237-T240 VanDerWaalsContact O-CB 3.31Å; E237-T240 WeakPolarHBondContact O-CB 3.35Å; E237-T240 PolarHBondContact O-N 2.81Å; E237-T240 PolarHBondContact OE2-OG1 3.47Å
238	I	83.6	Confident	88.9	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-56.1	-32.4	175.7	-162.7	69.3	0	0	0	111.8	F156 L168 Y175 Y208 P234 H235 T240 I241 V242	F156-I238 HydrophobicContact CE1-CG2 4.46Å; L168-I238 HydrophobicContact CD1-CG1 4.22Å; Y175-I238 HydrophobicContact CD2-CD1 3.58Å; Y175-I238 HydrophobicContact CD2-CG1 4.49Å; Y175-I238 HydrophobicContact CE2-CD1 4.17Å; Y175-I238 HydrophobicContact CG-CD1 4.23Å; Y208-I238 HydrophobicContact CD1-CD1 4.42Å; Y208-I238 HydrophobicContact CD2-CD1 4.11Å; Y208-I238 HydrophobicContact CG-CD1 4Å; P234-I238 PolarHBondContact O-N 3.49Å; H235-I238 WeakPolarHBondContact O-CG2 3.45Å; H235-I238 PolarHBondContact O-N 2.79Å; I238-T240 PolarHBondContact O-N 2.95Å; I238-I241 HydrophobicContact CD1-CD1 3.7Å; I238-I241 WeakPolarHBondContact O-CB 3.48Å; I238-I241 PolarHBondContact O-N 3.26Å; I238-I241 VanDerWaalsContact O-N 3.11Å; I238-V242 WeakPolarHBondContact O-CG2 3.24Å; I238-V242 PolarHBondContact O-N 3.1Å; I238-V242 VanDerWaalsContact O-N 3.15Å
239	V	87.1	Confident	89	Confident	12 Å²	12	36.4 Å²	36.4	7%	0.073	19%	0.185	C	C	.	.	H	α-helix	trans	-55.8	-37.1	176.3	66.6	0	0	0	0	111.5	F156 N236 E237 I241 V242 L243	F156-V239 HydrophobicContact CD1-CB 3.9Å; F156-V239 HydrophobicContact CD1-CG2 3.47Å; F156-V239 VanDerWaalsContact CD1-CG2 3.47Å; F156-V239 HydrophobicContact CE1-CB 3.88Å; F156-V239 HydrophobicContact CE1-CG2 3.98Å; F156-V239 HydrophobicContact CG-CG2 4.29Å; N236-V239 WeakPolarHBondContact O-CG1 3.45Å; E237-V239 PolarHBondContact O-N 3.29Å; E237-V239 VanDerWaalsContact O-N 3.12Å; V239-I241 VanDerWaalsContact C-N 3.32Å; V239-I241 PolarHBondContact O-N 2.97Å; V239-V242 PolarHBondContact O-N 3.46Å; V239-L243 HydrophobicContact CG2-CD1 3.89Å; V239-L243 HydrophobicContact CG2-CG 4.14Å; V239-L243 WeakPolarHBondContact O-CB 3.44Å; V239-L243 WeakPolarHBondContact O-CG 3.46Å; V239-L243 PolarHBondContact O-N 2.66Å
240	T	87.3	Confident	89.2	Confident	33 Å²	33	34.3 Å²	34.3	20%	0.202	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-39.5	-178.9	-58.1	0	0	0	0	111	L218 E237 I238 N244	L218-T240 HydrophobicContact CD2-CG2 4.12Å; L218-T240 HydrophobicContact CG-CG2 4.15Å; E237-T240 VanDerWaalsContact O-CB 3.31Å; E237-T240 WeakPolarHBondContact O-CB 3.35Å; E237-T240 PolarHBondContact O-N 2.81Å; E237-T240 PolarHBondContact OE2-OG1 3.47Å; I238-T240 PolarHBondContact O-N 2.95Å; T240-N244 VanDerWaalsContact O-CG 3.3Å; T240-N244 PolarHBondContact O-N 2.87Å; T240-N244 VanDerWaalsContact O-N 3.13Å
241	I	87.6	Confident	89.3	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-66.7	-49	177.2	-52.1	172.5	0	0	0	110.4	Y175 V210 D214 I233 I238 V239 L243 N244 D245	Y175-I241 HydrophobicContact CE2-CG2 3.94Å; Y175-I241 WeakPolarHBondContact OH-CG2 3.07Å; V210-I241 HydrophobicContact CG1-CD1 4.06Å; V210-I241 HydrophobicContact CG2-CD1 4.17Å; D214-I241 HydrophobicContact CB-CG2 4.15Å; I233-I241 HydrophobicContact CD1-CD1 3.28Å; I233-I241 HydrophobicContact CD1-CG1 3.96Å; I233-I241 HydrophobicContact CG1-CD1 4.45Å; I233-I241 HydrophobicContact CG2-CD1 4.32Å; I238-I241 HydrophobicContact CD1-CD1 3.7Å; I238-I241 WeakPolarHBondContact O-CB 3.48Å; I238-I241 PolarHBondContact O-N 3.26Å; I238-I241 VanDerWaalsContact O-N 3.11Å; V239-I241 VanDerWaalsContact C-N 3.32Å; V239-I241 PolarHBondContact O-N 2.97Å; I241-L243 VanDerWaalsContact C-N 3.28Å; I241-L243 PolarHBondContact O-N 3.44Å; I241-N244 PolarHBondContact O-N 3.43Å; I241-N244 VanDerWaalsContact O-N 3.12Å; I241-D245 PolarHBondContact O-N 2.79Å
242	V	89.9	Confident	89.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-41.3	-179.3	179.5	0	0	0	0	110.9	F54 F152 F156 F167 L168 L173 I238 V239 N244 D245 F246	F54-V242 HydrophobicContact CE1-CG1 3.85Å; F54-V242 HydrophobicContact CZ-CG1 3.84Å; F152-V242 HydrophobicContact CE1-CG1 3.7Å; F152-V242 HydrophobicContact CZ-CG1 3.92Å; F156-V242 HydrophobicContact CD2-CG1 4.23Å; F156-V242 HydrophobicContact CE2-CB 4.47Å; F156-V242 HydrophobicContact CE2-CG1 4.02Å; F156-V242 HydrophobicContact CE2-CG2 4.26Å; F156-V242 HydrophobicContact CZ-CG2 4.11Å; F167-V242 HydrophobicContact CE1-CG1 3.82Å; L168-V242 HydrophobicContact CD2-CG2 3.5Å; L173-V242 HydrophobicContact CD1-CG2 4.26Å; I238-V242 WeakPolarHBondContact O-CG2 3.24Å; I238-V242 PolarHBondContact O-N 3.1Å; I238-V242 VanDerWaalsContact O-N 3.15Å; V239-V242 PolarHBondContact O-N 3.46Å; V242-N244 VanDerWaalsContact C-N 3.34Å; V242-N244 PolarHBondContact O-N 3.4Å; V242-D245 PolarHBondContact O-N 3.39Å; V242-F246 WeakPolarHBondContact O-CB 3.44Å; V242-F246 PolarHBondContact O-N 3.26Å
243	L	91.1	Very high	89.7	Confident	15 Å²	15	40.2 Å²	40.2	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-38.2	176.8	-70.8	171.8	0	0	0	112.6	V149 F152 K153 V239 I241 F246 R247	V149-L243 HydrophobicContact CG1-CB 4.47Å; V149-L243 HydrophobicContact CG1-CD2 4.09Å; F152-L243 HydrophobicContact CB-CD2 4.41Å; F152-L243 HydrophobicContact CD1-CD2 3.55Å; F152-L243 HydrophobicContact CE1-CD2 4.32Å; F152-L243 HydrophobicContact CG-CD2 4.39Å; K153-L243 HydrophobicContact CB-CD1 3.87Å; K153-L243 HydrophobicContact CB-CD2 3.67Å; K153-L243 HydrophobicContact CB-CG 4.41Å; K153-L243 HydrophobicContact CD-CD1 3.79Å; K153-L243 HydrophobicContact CG-CD1 3.78Å; K153-L243 HydrophobicContact CG-CD2 4.46Å; V239-L243 HydrophobicContact CG2-CD1 3.89Å; V239-L243 HydrophobicContact CG2-CG 4.14Å; V239-L243 WeakPolarHBondContact O-CB 3.44Å; V239-L243 WeakPolarHBondContact O-CG 3.46Å; V239-L243 PolarHBondContact O-N 2.66Å; I241-L243 VanDerWaalsContact C-N 3.28Å; I241-L243 PolarHBondContact O-N 3.44Å; L243-F246 PolarHBondContact O-N 2.9Å; L243-R247 VanDerWaalsContact O-CB 3.3Å; L243-R247 WeakPolarHBondContact O-CB 3.03Å; L243-R247 PolarHBondContact O-N 2.92Å
244	N	89	Confident	90	Very high	37 Å²	37	40.2 Å²	40.2	20%	0.198	20%	0.202	C	C	.	.	H	α-helix	trans	-69.8	-40.5	178.8	-77.6	-8.8	0	0	0	112.2	D217 T240 I241 V242 R247 T248	D217-N244 PolarHBondContact OD2-ND2 3.28Å; D217-N244 PolarHBondContact OD2-OD1 2.91Å; T240-N244 VanDerWaalsContact O-CG 3.3Å; T240-N244 PolarHBondContact O-N 2.87Å; T240-N244 VanDerWaalsContact O-N 3.13Å; I241-N244 PolarHBondContact O-N 3.43Å; I241-N244 VanDerWaalsContact O-N 3.12Å; V242-N244 VanDerWaalsContact C-N 3.34Å; V242-N244 PolarHBondContact O-N 3.4Å; N244-R247 PolarHBondContact O-N 3.29Å; N244-T248 WeakPolarHBondContact O-CB 3.31Å; N244-T248 PolarHBondContact O-N 3.47Å; N244-T248 PolarHBondContact O-OG1 2.77Å
245	D	90	Very high	90.4	Very high	35 Å²	35	42 Å²	42	19%	0.187	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-47.2	172.9	-173.2	35.5	0	0	0	110.6	F54 I241 V242 R247 T248 R249	F54-D245 WeakPolarHBondContact CE2-OD2 3.46Å; I241-D245 PolarHBondContact O-N 2.79Å; V242-D245 PolarHBondContact O-N 3.39Å; D245-R247 PolarHBondContact O-N 2.9Å; D245-T248 PolarHBondContact O-N 3.06Å; D245-R249 WeakPolarHBondContact O-CB 3.43Å; D245-R249 WeakPolarHBondContact O-CG 3.35Å; D245-R249 PolarHBondContact O-N 3.07Å; D245-R249 IonicContact OD1-CZ 3.63Å; D245-R249 IonicContact OD1-NE 2.82Å; D245-R249 PolarHBondContact OD1-NE 3.37Å; D245-R249 IonicContact OD1-NH2 3.49Å; D245-R249 PolarHBondContact OD1-NH2 3Å; D245-R249 IonicContact OD2-CZ 3.23Å; D245-R249 VanDerWaalsContact OD2-CZ 3.23Å; D245-R249 IonicContact OD2-NE 2.75Å; D245-R249 PolarHBondContact OD2-NE 3.45Å; D245-R249 IonicContact OD2-NH2 2.84Å; D245-R249 PolarHBondContact OD2-NH2 3.46Å
246	F	94.1	Very high	91.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-49	175.7	179.3	-115.8	0	0	0	112.3	F54 Y55 E148 V149 F152 V242 L243 T248 R249 L250	F54-F246 HydrophobicContact CB-CD2 4.49Å; F54-F246 HydrophobicContact CD1-CB 4.09Å; F54-F246 AromaticContact CD1-CD2 3.68Å; F54-F246 HydrophobicContact CD1-CD2 3.68Å; F54-F246 HydrophobicContact CD1-CG 4.26Å; F54-F246 HydrophobicContact CE1-CB 3.83Å; F54-F246 HydrophobicContact CE1-CD2 4.29Å; F54-F246 HydrophobicContact CE1-CG 4.44Å; F54-F246 HydrophobicContact CG-CD2 4.37Å; Y55-F246 AromaticContact CD2-CE2 3.85Å; Y55-F246 HydrophobicContact CD2-CE2 3.85Å; Y55-F246 HydrophobicContact CD2-CZ 4.02Å; Y55-F246 HydrophobicContact CE2-CE2 4.31Å; Y55-F246 HydrophobicContact CE2-CZ 4.14Å; E148-F246 HydrophobicContact CB-CE1 4.18Å; E148-F246 HydrophobicContact CB-CZ 4.44Å; V149-F246 HydrophobicContact CG2-CD1 3.94Å; V149-F246 HydrophobicContact CG2-CE1 4.24Å; F152-F246 HydrophobicContact CB-CD1 3.95Å; F152-F246 HydrophobicContact CB-CE1 3.83Å; F152-F246 HydrophobicContact CD2-CD1 4.06Å; F152-F246 HydrophobicContact CD2-CD2 4.12Å; F152-F246 HydrophobicContact CD2-CE1 4.12Å; F152-F246 HydrophobicContact CD2-CE2 4.18Å; F152-F246 HydrophobicContact CD2-CG 4.06Å; F152-F246 HydrophobicContact CD2-CZ 4.18Å; F152-F246 HydrophobicContact CE2-CD2 4.31Å; F152-F246 HydrophobicContact CE2-CG 4.4Å; F152-F246 AromaticContact CG-CD1 3.94Å; F152-F246 HydrophobicContact CG-CD1 3.94Å; F152-F246 HydrophobicContact CG-CE1 4.15Å; F152-F246 HydrophobicContact CG-CG 4.26Å; V242-F246 WeakPolarHBondContact O-CB 3.44Å; V242-F246 PolarHBondContact O-N 3.26Å; L243-F246 PolarHBondContact O-N 2.9Å; F246-T248 VanDerWaalsContact C-N 3.33Å; F246-T248 PolarHBondContact O-N 3.28Å; F246-R249 PolarHBondContact O-N 3.14Å; F246-L250 HydrophobicContact CE1-CD2 4.3Å; F246-L250 HydrophobicContact CZ-CD2 4.22Å; F246-L250 VanDerWaalsContact O-CB 3.29Å; F246-L250 WeakPolarHBondContact O-CB 3.23Å; F246-L250 PolarHBondContact O-N 3.38Å
247	R	93.9	Very high	91.7	Very high	98 Å²	98	41.9 Å²	41.9	37%	0.37	22%	0.219	S	C	.	.	H	α-helix	trans	-57	-46.1	177.8	-175.1	-179.4	179.9	100.8	-1.2	111.7	I145 V149 L243 N244 D245 L250 S251	I145-R247 HydrophobicContact CG2-CG 3.64Å; V149-R247 HydrophobicContact CG2-CB 3.85Å; V149-R247 HydrophobicContact CG2-CG 4.14Å; L243-R247 VanDerWaalsContact O-CB 3.3Å; L243-R247 WeakPolarHBondContact O-CB 3.03Å; L243-R247 PolarHBondContact O-N 2.92Å; N244-R247 PolarHBondContact O-N 3.29Å; D245-R247 PolarHBondContact O-N 2.9Å; R247-L250 PolarHBondContact O-N 3.4Å; R247-S251 WeakPolarHBondContact O-CB 3.47Å; R247-S251 PolarHBondContact O-N 2.84Å
248	T	91.9	Very high	92.1	Very high	94 Å²	94	40.8 Å²	40.8	58%	0.577	22%	0.218	S	C	*	.	H	α-helix	trans	-66.4	-46.3	-177.8	-58.4	0	0	0	0	111.2	N244 D245 F246 S251 K252	N244-T248 WeakPolarHBondContact O-CB 3.31Å; N244-T248 PolarHBondContact O-N 3.47Å; N244-T248 PolarHBondContact O-OG1 2.77Å; D245-T248 PolarHBondContact O-N 3.06Å; F246-T248 VanDerWaalsContact C-N 3.33Å; F246-T248 PolarHBondContact O-N 3.28Å; T248-S251 PolarHBondContact O-N 3.35Å; T248-K252 PolarHBondContact O-N 2.89Å
249	R	94.5	Very high	92.5	Very high	105 Å²	105	50.5 Å²	50.5	40%	0.396	25%	0.254	S	S	.	.	H	α-helix	trans	-62.2	-44.5	176.6	-69.9	178.3	-169.9	-130.5	14.5	111.8	D245 F246 K252 A253	D245-R249 WeakPolarHBondContact O-CB 3.43Å; D245-R249 WeakPolarHBondContact O-CG 3.35Å; D245-R249 PolarHBondContact O-N 3.07Å; D245-R249 IonicContact OD1-CZ 3.63Å; D245-R249 IonicContact OD1-NE 2.82Å; D245-R249 PolarHBondContact OD1-NE 3.37Å; D245-R249 IonicContact OD1-NH2 3.49Å; D245-R249 PolarHBondContact OD1-NH2 3Å; D245-R249 IonicContact OD2-CZ 3.23Å; D245-R249 VanDerWaalsContact OD2-CZ 3.23Å; D245-R249 IonicContact OD2-NE 2.75Å; D245-R249 PolarHBondContact OD2-NE 3.45Å; D245-R249 IonicContact OD2-NH2 2.84Å; D245-R249 PolarHBondContact OD2-NH2 3.46Å; F246-R249 PolarHBondContact O-N 3.14Å; R249-K252 PolarHBondContact O-N 2.91Å; R249-A253 WeakPolarHBondContact O-CB 3.44Å; R249-A253 PolarHBondContact O-N 2.94Å
250	L	96.8	Very high	92.6	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-43.9	178.4	-177.6	58.4	0	0	0	111.6	H127 F144 I145 E148 F246 R247 K252 A253 L254	H127-L250 WeakPolarHBondContact NE2-CD1 3.44Å; F144-L250 HydrophobicContact CE1-CD1 4.16Å; F144-L250 HydrophobicContact CE1-CD2 4.45Å; I145-L250 HydrophobicContact CB-CD2 4.45Å; I145-L250 HydrophobicContact CG1-CD2 4.09Å; I145-L250 HydrophobicContact CG1-CG 4.13Å; E148-L250 HydrophobicContact CB-CD2 3.79Å; E148-L250 HydrophobicContact CG-CD2 4.21Å; F246-L250 HydrophobicContact CE1-CD2 4.3Å; F246-L250 HydrophobicContact CZ-CD2 4.22Å; F246-L250 VanDerWaalsContact O-CB 3.29Å; F246-L250 WeakPolarHBondContact O-CB 3.23Å; F246-L250 PolarHBondContact O-N 3.38Å; R247-L250 PolarHBondContact O-N 3.4Å; L250-K252 PolarHBondContact O-N 2.86Å; L250-A253 PolarHBondContact O-N 3.45Å; L250-L254 HydrophobicContact CD1-CG 4.41Å; L250-L254 HydrophobicContact CG-CD1 4.29Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 2.85Å
251	S	95.9	Very high	92.5	Very high	60 Å²	60	52.9 Å²	52.9	42%	0.42	27%	0.272	S	S	.	.	H	α-helix	trans	-58.6	-48	175.9	-175.2	0	0	0	0	111.8	R247 T248 A253 L254 A255	R247-S251 WeakPolarHBondContact O-CB 3.47Å; R247-S251 PolarHBondContact O-N 2.84Å; T248-S251 PolarHBondContact O-N 3.35Å; S251-A253 PolarHBondContact O-N 2.99Å; S251-L254 PolarHBondContact O-N 3.22Å; S251-A255 PolarHBondContact O-N 3.35Å; S251-A255 VanDerWaalsContact O-N 3.09Å
252	K	95.8	Very high	92.5	Very high	149 Å²	149	57 Å²	57	65%	0.648	30%	0.299	S	S	*	.	H	α-helix	trans	-60.7	-43.5	175.6	-175.2	177.4	179.3	179.5	0	111.7	T248 R249 L250 A255 L256	T248-K252 PolarHBondContact O-N 2.89Å; R249-K252 PolarHBondContact O-N 2.91Å; L250-K252 PolarHBondContact O-N 2.86Å; K252-A255 PolarHBondContact O-N 3.23Å; K252-L256 HydrophobicContact CG-CD1 4.46Å; K252-L256 WeakPolarHBondContact O-CG 3.18Å; K252-L256 PolarHBondContact O-N 3.49Å
253	A	96.3	Very high	92.3	Very high	21 Å²	21	60.7 Å²	60.7	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-45.3	178.5	0	0	0	0	0	111.9	R249 L250 S251 A255 L256 T257	R249-A253 WeakPolarHBondContact O-CB 3.44Å; R249-A253 PolarHBondContact O-N 2.94Å; L250-A253 PolarHBondContact O-N 3.45Å; S251-A253 PolarHBondContact O-N 2.99Å; A253-A255 VanDerWaalsContact C-N 3.32Å; A253-A255 PolarHBondContact O-N 3.32Å; A253-L256 PolarHBondContact O-N 3.11Å; A253-T257 PolarHBondContact O-N 3.18Å; A253-T257 PolarHBondContact O-OG1 3.29Å
254	L	95.6	Very high	91.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-38.7	176.8	-70.9	168.6	0	0	0	112.4	R131 C135 R141 F144 I145 L250 S251 L256 T257 A258	R131-L254 HydrophobicContact CB-CD2 3.82Å; R131-L254 HydrophobicContact CG-CD2 3.78Å; C135-L254 HydrophobicContact CB-CB 4.39Å; C135-L254 HydrophobicContact CB-CD2 3.99Å; R141-L254 HydrophobicContact CB-CD1 4.32Å; R141-L254 HydrophobicContact CG-CB 4.36Å; R141-L254 HydrophobicContact CG-CD1 4.29Å; F144-L254 HydrophobicContact CD1-CD1 3.92Å; F144-L254 HydrophobicContact CD1-CD2 4.1Å; F144-L254 HydrophobicContact CE1-CD2 4.18Å; I145-L254 HydrophobicContact CD1-CD1 3.87Å; I145-L254 HydrophobicContact CG1-CD1 3.6Å; L250-L254 HydrophobicContact CD1-CG 4.41Å; L250-L254 HydrophobicContact CG-CD1 4.29Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 2.85Å; S251-L254 PolarHBondContact O-N 3.22Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L254-T257 PolarHBondContact O-N 3.27Å; L254-A258 WeakPolarHBondContact O-CB 3.34Å; L254-A258 PolarHBondContact O-N 3.2Å
255	A	94.3	Very high	91.4	Very high	41 Å²	41	63 Å²	63	34%	0.339	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-39.5	175.6	0	0	0	0	0	111.9	S251 K252 A253 R259	S251-A255 PolarHBondContact O-N 3.35Å; S251-A255 VanDerWaalsContact O-N 3.09Å; K252-A255 PolarHBondContact O-N 3.23Å; A253-A255 VanDerWaalsContact C-N 3.32Å; A253-A255 PolarHBondContact O-N 3.32Å; A255-R259 WeakPolarHBondContact O-CG 3.34Å; A255-R259 PolarHBondContact O-N 3.17Å
256	L	94	Very high	90.9	Very high	94 Å²	94	66 Å²	66	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-68.3	-44.9	174.5	-67.2	173.9	0	0	0	111.7	K252 A253 L254 A258 R259 S260	K252-L256 HydrophobicContact CG-CD1 4.46Å; K252-L256 WeakPolarHBondContact O-CG 3.18Å; K252-L256 PolarHBondContact O-N 3.49Å; A253-L256 PolarHBondContact O-N 3.11Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L256-A258 VanDerWaalsContact C-N 3.32Å; L256-A258 PolarHBondContact O-N 2.89Å; L256-R259 PolarHBondContact O-N 2.97Å; L256-S260 PolarHBondContact O-N 2.95Å
257	T	93.4	Very high	90.4	Very high	34 Å²	34	68.1 Å²	68.1	21%	0.209	38%	0.375	C	S	.	.	H	α-helix	trans	-57.6	-45.2	176.4	-58.3	0	0	0	0	111.2	L132 C135 A253 L254 R259 S260 L261	L132-T257 HydrophobicContact CD2-CG2 3.84Å; C135-T257 HydrophobicContact CB-CG2 4.41Å; A253-T257 PolarHBondContact O-N 3.18Å; A253-T257 PolarHBondContact O-OG1 3.29Å; L254-T257 PolarHBondContact O-N 3.27Å; T257-R259 VanDerWaalsContact C-N 3.28Å; T257-R259 PolarHBondContact O-N 3.25Å; T257-S260 CarbonylContact O-C 3.54Å; T257-S260 PolarHBondContact O-N 3.2Å; T257-S260 VanDerWaalsContact O-N 3.12Å; T257-L261 WeakPolarHBondContact O-CB 3.48Å; T257-L261 PolarHBondContact O-N 3.28Å
258	A	92.3	Very high	89.8	Confident	21 Å²	21	71.6 Å²	71.6	17%	0.174	40%	0.396	C	S	.	.	H	α-helix	trans	-59.8	-36.3	179.1	0	0	0	0	0	113.2	C135 L254 L256 S260 L261	C135-A258 HydrophobicContact CB-CB 4.06Å; C135-A258 WeakPolarHBondContact O-CB 3.13Å; L254-A258 WeakPolarHBondContact O-CB 3.34Å; L254-A258 PolarHBondContact O-N 3.2Å; L256-A258 VanDerWaalsContact C-N 3.32Å; L256-A258 PolarHBondContact O-N 2.89Å; A258-S260 VanDerWaalsContact C-N 3.32Å; A258-L261 VanDerWaalsContact O-CB 3.26Å; A258-L261 WeakPolarHBondContact O-CB 3.46Å; A258-L261 PolarHBondContact O-N 3.1Å
259	R	91.6	Very high	89.4	Confident	208 Å²	208	74.2 Å²	74.2	79%	0.785	40%	0.395	S	S	*	.	H	α-helix	trans	-67.5	-33.9	177.3	-71.2	175.6	66.2	175.4	1.3	112.5	A255 L256 T257	A255-R259 WeakPolarHBondContact O-CG 3.34Å; A255-R259 PolarHBondContact O-N 3.17Å; L256-R259 PolarHBondContact O-N 2.97Å; T257-R259 VanDerWaalsContact C-N 3.28Å; T257-R259 PolarHBondContact O-N 3.25Å
260	S	89.4	Confident	88.6	Confident	82 Å²	82	70.5 Å²	70.5	57%	0.573	38%	0.383	S	S	*	.	H	α-helix	trans	-91.2	-6.6	179.4	-57.5	0	0	0	0	113.3	L256 T257 A258 A263	L256-S260 PolarHBondContact O-N 2.95Å; T257-S260 CarbonylContact O-C 3.54Å; T257-S260 PolarHBondContact O-N 3.2Å; T257-S260 VanDerWaalsContact O-N 3.12Å; A258-S260 VanDerWaalsContact C-N 3.32Å; S260-A263 PolarHBondContact O-N 3.32Å
261	L	86.3	Confident	87.8	Confident	13 Å²	13	72.3 Å²	72.3	7%	0.068	39%	0.392	C	S	.	.	H	α-helix	trans	-58.2	-33.8	-175.6	-168.6	65.8	0	0	0	114.6	L132 Q136 T257 A258 A263 V264 H265	L132-L261 HydrophobicContact CD2-CD1 4.41Å; Q136-L261 HydrophobicContact CG-CD2 3.85Å; T257-L261 WeakPolarHBondContact O-CB 3.48Å; T257-L261 PolarHBondContact O-N 3.28Å; A258-L261 VanDerWaalsContact O-CB 3.26Å; A258-L261 WeakPolarHBondContact O-CB 3.46Å; A258-L261 PolarHBondContact O-N 3.1Å; L261-A263 VanDerWaalsContact C-N 3.25Å; L261-A263 PolarHBondContact O-N 3.46Å; L261-V264 HydrophobicContact CD1-CB 4.49Å; L261-V264 WeakPolarHBondContact O-CA 3.26Å; L261-V264 WeakPolarHBondContact O-CB 3.38Å; L261-V264 PolarHBondContact O-N 2.94Å; L261-H265 VanDerWaalsContact CD2-CE1 3.46Å; L261-H265 WeakPolarHBondContact CD2-CE1 3.46Å; L261-H265 WeakPolarHBondContact CG-CE1 3.46Å; L261-H265 WeakPolarHBondContact CG-ND1 2.97Å; L261-H265 PolarHBondContact O-N 3.49Å; L261-H265 PolarHBondContact O-ND1 3.42Å
262	P	87.2	Confident	86.8	Confident	90 Å²	90	72.4 Å²	72.4	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-58.2	-32.6	176.2	-27.9	36.8	0	0	0	114.4	V264 H265 S266	P262-V264 PolarHBondContact O-N 2.87Å; P262-H265 PolarHBondContact O-N 3.41Å; P262-H265 VanDerWaalsContact O-N 3.15Å; P262-S266 PolarHBondContact O-N 3.43Å
263	A	85	Confident	85.8	Confident	77 Å²	77	66.7 Å²	66.7	64%	0.636	37%	0.367	S	S	*	.	H	α-helix	trans	-70.2	-21.9	175.9	0	0	0	0	0	112.8	S260 L261 S266	S260-A263 PolarHBondContact O-N 3.32Å; L261-A263 VanDerWaalsContact C-N 3.25Å; L261-A263 PolarHBondContact O-N 3.46Å; A263-S266 PolarHBondContact O-OG 3.41Å
264	V	82	Confident	85	Confident	37 Å²	37	65.7 Å²	65.7	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-84.8	-28.6	172.3	-174.5	0	0	0	0	110.4	L132 L261 P262 S266 D267 L270 L274	L132-V264 HydrophobicContact CD2-CG2 4.47Å; L261-V264 HydrophobicContact CD1-CB 4.49Å; L261-V264 WeakPolarHBondContact O-CA 3.26Å; L261-V264 WeakPolarHBondContact O-CB 3.38Å; L261-V264 PolarHBondContact O-N 2.94Å; P262-V264 PolarHBondContact O-N 2.87Å; V264-S266 PolarHBondContact O-N 2.9Å; V264-D267 PolarHBondContact O-N 3.35Å; V264-D267 VanDerWaalsContact O-N 3.15Å; V264-L270 HydrophobicContact CG1-CD1 3.74Å; V264-L274 HydrophobicContact CG1-CD1 4.26Å
265	H	79.1	Confident	83.9	Confident	64 Å²	64	68.8 Å²	68.8	30%	0.296	38%	0.375	S	S	.	.	H	α-helix	trans	-67.9	-22.1	178.5	-77.2	51.9	0	0	0	114.1	L261 P262 D267 Q271	L261-H265 VanDerWaalsContact CD2-CE1 3.46Å; L261-H265 WeakPolarHBondContact CD2-CE1 3.46Å; L261-H265 WeakPolarHBondContact CG-CE1 3.46Å; L261-H265 WeakPolarHBondContact CG-ND1 2.97Å; L261-H265 PolarHBondContact O-N 3.49Å; L261-H265 PolarHBondContact O-ND1 3.42Å; P262-H265 PolarHBondContact O-N 3.41Å; P262-H265 VanDerWaalsContact O-N 3.15Å; H265-D267 PolarHBondContact O-N 2.86Å; H265-Q271 VanDerWaalsContact CA-NE2 3.28Å; H265-Q271 HydrophobicContact CB-CG 4.49Å; H265-Q271 PolarHBondContact CD2-NE2 3.25Å; H265-Q271 PolarHBondContact CD2-OE1 3.4Å; H265-Q271 PolarHBondContact CE1-NE2 3.16Å; H265-Q271 PolarHBondContact ND1-NE2 3.22Å; H265-Q271 PolarHBondContact NE2-NE2 3.38Å; H265-Q271 VanDerWaalsContact NE2-NE2 3.16Å; H265-Q271 WeakPolarHBondContact O-CG 3.45Å
266	S	80.8	Confident	83	Confident	96 Å²	96	72.1 Å²	72.1	67%	0.671	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.3	172.9	49.5	0	0	0	0	113.8	P262 A263 V264 E268	P262-S266 PolarHBondContact O-N 3.43Å; A263-S266 PolarHBondContact O-OG 3.41Å; V264-S266 PolarHBondContact O-N 2.9Å; S266-E268 PolarHBondContact O-N 3.28Å
267	D	82.1	Confident	82.1	Confident	45 Å²	45	68.3 Å²	68.3	24%	0.241	36%	0.364	C	S	.	.			trans	-87	106.7	173.8	-166.5	-35.9	0	0	0	110.3	V264 H265 R269 L270 Q271	V264-D267 PolarHBondContact O-N 3.35Å; V264-D267 VanDerWaalsContact O-N 3.15Å; H265-D267 PolarHBondContact O-N 2.86Å; D267-R269 PolarHBondContact O-N 3.32Å; D267-R269 VanDerWaalsContact O-N 3.09Å; D267-R269 VanDerWaalsContact OD1-CB 3.23Å; D267-R269 WeakPolarHBondContact OD1-CB 3.37Å; D267-R269 WeakPolarHBondContact OD1-CG 3.4Å; D267-R269 IonicContact OD1-CZ 2.67Å; D267-R269 PolarHBondContact OD1-N 2.98Å; D267-R269 IonicContact OD1-NE 2.66Å; D267-R269 PolarHBondContact OD1-NE 3.1Å; D267-R269 IonicContact OD1-NH2 2.65Å; D267-R269 IonicContact OD2-CZ 3.84Å; D267-R269 IonicContact OD2-NE 3.39Å; D267-R269 PolarHBondContact OD2-NE 3Å; D267-R269 IonicContact OD2-NH2 3.02Å; D267-R269 PolarHBondContact OD2-NH2 3.25Å; D267-L270 HydrophobicContact CB-CB 4.47Å; D267-L270 HydrophobicContact CB-CD1 4.27Å; D267-L270 HydrophobicContact CB-CG 4.36Å; D267-L270 PolarHBondContact O-N 2.95Å; D267-L270 VanDerWaalsContact O-N 3.16Å; D267-Q271 PolarHBondContact O-N 3.22Å
268	E	82.1	Confident	80.7	Confident	171 Å²	171	67.4 Å²	67.4	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.3	-179.8	-65.2	-172.4	163.3	0	0	113.6	S266 P272	S266-E268 PolarHBondContact O-N 3.28Å; E268-P272 WeakPolarHBondContact O-CD 3.29Å
269	R	82.1	Confident	79.2	Confident	150 Å²	150	72.7 Å²	72.7	57%	0.566	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-34.8	-179.8	-53.8	172.4	-62.7	162.9	2.1	112	D267	D267-R269 PolarHBondContact O-N 3.32Å; D267-R269 VanDerWaalsContact O-N 3.09Å; D267-R269 VanDerWaalsContact OD1-CB 3.23Å; D267-R269 WeakPolarHBondContact OD1-CB 3.37Å; D267-R269 WeakPolarHBondContact OD1-CG 3.4Å; D267-R269 IonicContact OD1-CZ 2.67Å; D267-R269 PolarHBondContact OD1-N 2.98Å; D267-R269 IonicContact OD1-NE 2.66Å; D267-R269 PolarHBondContact OD1-NE 3.1Å; D267-R269 IonicContact OD1-NH2 2.65Å; D267-R269 IonicContact OD2-CZ 3.84Å; D267-R269 IonicContact OD2-NE 3.39Å; D267-R269 PolarHBondContact OD2-NE 3Å; D267-R269 IonicContact OD2-NH2 3.02Å; D267-R269 PolarHBondContact OD2-NH2 3.25Å
270	L	79.3	Confident	77.5	Confident	27 Å²	27	65 Å²	65	14%	0.141	36%	0.358	C	S	.	.	H	α-helix	trans	-86.2	-28.8	-175.4	-65.2	178.9	0	0	0	112.2	L65 F68 V264 D267 L273 L274	L65-L270 HydrophobicContact CD2-CD2 4.47Å; F68-L270 HydrophobicContact CE1-CD2 4.13Å; F68-L270 HydrophobicContact CE2-CD2 4.16Å; F68-L270 HydrophobicContact CZ-CD2 3.87Å; V264-L270 HydrophobicContact CG1-CD1 3.74Å; D267-L270 HydrophobicContact CB-CB 4.47Å; D267-L270 HydrophobicContact CB-CD1 4.27Å; D267-L270 HydrophobicContact CB-CG 4.36Å; D267-L270 PolarHBondContact O-N 2.95Å; D267-L270 VanDerWaalsContact O-N 3.16Å; L270-L273 PolarHBondContact O-N 3.46Å; L270-L274 WeakPolarHBondContact O-CG 3.25Å; L270-L274 PolarHBondContact O-N 2.93Å
271	Q	78.7	Confident	75.8	Confident	39 Å²	39	63.6 Å²	63.6	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-55.7	-53.7	-177.8	-83.5	-62.3	-70.1	0	0	114.1	H265 D267 L273 L274 N275	H265-Q271 VanDerWaalsContact CA-NE2 3.28Å; H265-Q271 HydrophobicContact CB-CG 4.49Å; H265-Q271 PolarHBondContact CD2-NE2 3.25Å; H265-Q271 PolarHBondContact CD2-OE1 3.4Å; H265-Q271 PolarHBondContact CE1-NE2 3.16Å; H265-Q271 PolarHBondContact ND1-NE2 3.22Å; H265-Q271 PolarHBondContact NE2-NE2 3.38Å; H265-Q271 VanDerWaalsContact NE2-NE2 3.16Å; H265-Q271 WeakPolarHBondContact O-CG 3.45Å; D267-Q271 PolarHBondContact O-N 3.22Å; Q271-L273 VanDerWaalsContact C-N 3.32Å; Q271-L273 PolarHBondContact O-N 3.11Å; Q271-L274 PolarHBondContact O-N 3.17Å; Q271-N275 WeakPolarHBondContact O-CB 3.29Å; Q271-N275 PolarHBondContact O-N 3.45Å; Q271-N275 VanDerWaalsContact O-N 3.1Å; Q271-N275 PolarHBondContact O-ND2 2.91Å
272	P	75.9	Confident	74.5	Confident	62 Å²	62	65.3 Å²	65.3	40%	0.403	35%	0.349	S	S	.	.	H	α-helix	trans	-59.9	-42.8	177.2	-23.2	33.9	0	0	0	111.9	E268 L274 N275 H276	E268-P272 WeakPolarHBondContact O-CD 3.29Å; P272-L274 PolarHBondContact O-N 2.9Å; P272-N275 PolarHBondContact O-N 3.24Å; P272-H276 WeakPolarHBondContact O-CB 3.34Å; P272-H276 PolarHBondContact O-N 3.45Å; P272-H276 PolarHBondContact O-ND1 3.17Å; P272-H276 VanDerWaalsContact O-ND1 3.16Å
273	L	74.9	Confident	73.1	Confident	28 Å²	28	62.3 Å²	62.3	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-45.4	-179	-71.1	170.6	0	0	0	112.2	F68 E69 L270 Q271 H276 L277	F68-L273 HydrophobicContact CD1-CD1 4.15Å; F68-L273 HydrophobicContact CE1-CD1 4.31Å; E69-L273 HydrophobicContact CB-CD2 4.23Å; E69-L273 HydrophobicContact CG-CD2 3.93Å; L270-L273 PolarHBondContact O-N 3.46Å; Q271-L273 VanDerWaalsContact C-N 3.32Å; Q271-L273 PolarHBondContact O-N 3.11Å; L273-H276 PolarHBondContact O-N 2.91Å; L273-L277 VanDerWaalsContact O-CG 3.25Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.37Å
274	L	78.3	Confident	72	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.6	-40	-179	-65.7	178.6	0	0	0	112.5	F68 L132 A133 V264 L270 Q271 P272 H276 L277	F68-L274 HydrophobicContact CZ-CD2 4.47Å; L132-L274 HydrophobicContact CB-CD1 4.02Å; L132-L274 HydrophobicContact CB-CD2 3.59Å; L132-L274 HydrophobicContact CB-CG 4.49Å; L132-L274 HydrophobicContact CD1-CD2 4.49Å; A133-L274 HydrophobicContact CB-CD2 4.09Å; V264-L274 HydrophobicContact CG1-CD1 4.26Å; L270-L274 WeakPolarHBondContact O-CG 3.25Å; L270-L274 PolarHBondContact O-N 2.93Å; Q271-L274 PolarHBondContact O-N 3.17Å; P272-L274 PolarHBondContact O-N 2.9Å; L274-H276 VanDerWaalsContact C-N 3.3Å; L274-L277 HydrophobicContact CD2-CD1 4.46Å; L274-L277 PolarHBondContact O-N 3.4Å
275	N	74	Confident	71.2	Confident	65 Å²	65	67 Å²	67	35%	0.348	35%	0.345	S	S	.	.	H	α-helix	trans	-68.5	-34	175.7	-69.2	-22.9	0	0	0	111.5	Q271 P272 S278	Q271-N275 WeakPolarHBondContact O-CB 3.29Å; Q271-N275 PolarHBondContact O-N 3.45Å; Q271-N275 VanDerWaalsContact O-N 3.1Å; Q271-N275 PolarHBondContact O-ND2 2.91Å; P272-N275 PolarHBondContact O-N 3.24Å; N275-S278 PolarHBondContact O-OG 2.94Å
276	H	73.9	Confident	70.9	Confident	111 Å²	111	64.4 Å²	64.4	51%	0.514	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-50.1	171.3	-71.1	159.8	0	0	0	110.2	P272 L273 L274 S278 H279 S280	P272-H276 WeakPolarHBondContact O-CB 3.34Å; P272-H276 PolarHBondContact O-N 3.45Å; P272-H276 PolarHBondContact O-ND1 3.17Å; P272-H276 VanDerWaalsContact O-ND1 3.16Å; L273-H276 PolarHBondContact O-N 2.91Å; L274-H276 VanDerWaalsContact C-N 3.3Å; H276-S278 VanDerWaalsContact C-N 3.26Å; H276-S278 PolarHBondContact O-N 3.39Å; H276-S278 VanDerWaalsContact O-N 3.08Å; H276-H279 CarbonylContact O-C 3.6Å; H276-H279 PolarHBondContact O-N 2.61Å; H276-S280 WeakPolarHBondContact CA-OG 3.09Å; H276-S280 WeakPolarHBondContact CB-OG 3.47Å; H276-S280 VanDerWaalsContact O-CA 3.28Å; H276-S280 WeakPolarHBondContact O-CA 3.49Å; H276-S280 WeakPolarHBondContact O-CB 3.4Å; H276-S280 PolarHBondContact O-N 2.67Å; H276-S280 PolarHBondContact O-OG 3.04Å
277	L	74.8	Confident	70	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.073	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-27.9	-174.2	-73	163.4	0	0	0	115.7	A72 V73 L76 L130 A133 Y134 L273 L274	A72-L277 HydrophobicContact CB-CD1 3.58Å; A72-L277 HydrophobicContact CB-CD2 3.64Å; A72-L277 HydrophobicContact CB-CG 4.26Å; V73-L277 HydrophobicContact CG2-CD2 4.42Å; L76-L277 HydrophobicContact CD2-CD2 4.29Å; L76-L277 WeakPolarHBondContact CD2-O 3.38Å; L130-L277 HydrophobicContact CD2-CD1 4.4Å; L130-L277 HydrophobicContact CD2-CD2 4.41Å; A133-L277 HydrophobicContact CB-CB 3.88Å; A133-L277 HydrophobicContact CB-CD1 4.37Å; Y134-L277 PolarHBondContact OH-O 3.35Å; L273-L277 VanDerWaalsContact O-CG 3.25Å; L273-L277 WeakPolarHBondContact O-CG 3.36Å; L273-L277 PolarHBondContact O-N 3.37Å; L274-L277 HydrophobicContact CD2-CD1 4.46Å; L274-L277 PolarHBondContact O-N 3.4Å
278	S	64.3	Low	68.8	Low	16 Å²	16	63.1 Å²	63.1	11%	0.112	32%	0.323	C	S	.	.	H	α-helix	trans	-82.7	-23.5	177.7	55.5	0	0	0	0	113.7	N275 H276	N275-S278 PolarHBondContact O-OG 2.94Å; H276-S278 VanDerWaalsContact C-N 3.26Å; H276-S278 PolarHBondContact O-N 3.39Å; H276-S278 VanDerWaalsContact O-N 3.08Å
279	H	61.1	Low	67.4	Low	131 Å²	131	57.4 Å²	57.4	61%	0.606	30%	0.296	S	S	*	.	H	α-helix	trans	-121.4	-6	-174.5	-66.4	-64.4	0	0	0	114.3	H276	H276-H279 CarbonylContact O-C 3.6Å; H276-H279 PolarHBondContact O-N 2.61Å
280	S	55.3	Low	65.8	Low	48 Å²	48	58.7 Å²	58.7	34%	0.336	31%	0.306	S	S	.	.			trans	-82.7	136.9	-167.4	-71.6	0	0	0	0	113.3	H276 L282	H276-S280 WeakPolarHBondContact CA-OG 3.09Å; H276-S280 WeakPolarHBondContact CB-OG 3.47Å; H276-S280 VanDerWaalsContact O-CA 3.28Å; H276-S280 WeakPolarHBondContact O-CA 3.49Å; H276-S280 WeakPolarHBondContact O-CB 3.4Å; H276-S280 PolarHBondContact O-N 2.67Å; H276-S280 PolarHBondContact O-OG 3.04Å; S280-L282 PolarHBondContact O-N 2.65Å
281	Y	55.7	Low	64.2	Low	52 Å²	52	64.9 Å²	64.9	20%	0.204	34%	0.339	C	S	.	.			trans	-63.8	118.3	160.2	170.8	-106.9	0	0	0	109.9	G283 Q284 S390 S466 H467	Y281-G283 VanDerWaalsContact CE1-O 3.22Å; Y281-G283 WeakPolarHBondContact CE1-O 3.49Å; Y281-G283 VanDerWaalsContact OH-C 3.24Å; Y281-G283 VanDerWaalsContact OH-CA 3.22Å; Y281-G283 WeakPolarHBondContact OH-CA 3.46Å; Y281-Q284 VanDerWaalsContact CE1-O 3.28Å; Y281-Q284 WeakPolarHBondContact CE1-O 3.18Å; Y281-Q284 PolarHBondContact OH-N 2.77Å; Y281-Q284 PolarHBondContact OH-O 2.88Å; Y281-S390 VanDerWaalsContact CD2-CB 3.44Å; Y281-S466 WeakPolarHBondContact CD2-O 3.44Å; Y281-S466 WeakPolarHBondContact CE2-O 3.38Å; Y281-S466 WeakPolarHBondContact CE2-OG 3.34Å; Y281-S466 PolarHBondContact OH-OG 3.26Å; Y281-H467 AromaticContact CE1-CD2 3.94Å; Y281-H467 HydrophobicContact CE2-CB 3.67Å; Y281-H467 AromaticContact CE2-CD2 3.99Å; Y281-H467 AromaticContact CZ-CD2 3.59Å; Y281-H467 AromaticContact CZ-CG 3.97Å; Y281-H467 WeakPolarHBondContact OH-CB 3.48Å
282	L	57.3	Low	62.9	Low	48 Å²	48	64.7 Å²	64.7	25%	0.251	34%	0.34	S	S	.	.			trans	-91.7	5.3	179.7	-58.8	171.7	0	0	0	113.8	V73 L76 K77 K80 S280	V73-L282 HydrophobicContact CG1-CD2 4.3Å; L76-L282 HydrophobicContact CB-CD1 4.13Å; L76-L282 HydrophobicContact CD2-CD1 3.83Å; L76-L282 HydrophobicContact CD2-CD2 3.96Å; L76-L282 HydrophobicContact CD2-CG 4.3Å; L76-L282 HydrophobicContact CG-CD1 3.59Å; K77-L282 HydrophobicContact CG-CB 4.27Å; K77-L282 HydrophobicContact CG-CD1 3.93Å; K80-L282 HydrophobicContact CG-CD1 4.44Å; S280-L282 PolarHBondContact O-N 2.65Å
283	G	58	Low	62	Low	27 Å²	27	63.8 Å²	63.8	28%	0.278	34%	0.342	S	S	.	.	S	Bend	trans	-88.4	-178.3	-177.9	0	0	0	0	0	112.8	Y281	Y281-G283 VanDerWaalsContact CE1-O 3.22Å; Y281-G283 WeakPolarHBondContact CE1-O 3.49Å; Y281-G283 VanDerWaalsContact OH-C 3.24Å; Y281-G283 VanDerWaalsContact OH-CA 3.22Å; Y281-G283 WeakPolarHBondContact OH-CA 3.46Å
284	Q	63.4	Low	61.6	Low	113 Å²	113	72 Å²	72	53%	0.528	38%	0.376	S	S	.	.			trans	-61.5	138.1	-176	-174.4	173.2	12.6	0	0	112.3	Y281 Y286	Y281-Q284 VanDerWaalsContact CE1-O 3.28Å; Y281-Q284 WeakPolarHBondContact CE1-O 3.18Å; Y281-Q284 PolarHBondContact OH-N 2.77Å; Y281-Q284 PolarHBondContact OH-O 2.88Å; Q284-Y286 HydrophobicContact CB-CE2 4.05Å; Q284-Y286 WeakPolarHBondContact O-CD2 3.42Å; Q284-Y286 VanDerWaalsContact O-CE2 3.23Å; Q284-Y286 WeakPolarHBondContact O-CE2 3.4Å; Q284-Y286 PolarHBondContact O-N 2.92Å
285	D	64.6	Low	61.6	Low	101 Å²	101	72.4 Å²	72.4	54%	0.54	38%	0.379	S	S	.	.			trans	-71.5	119.5	171.7	-169.2	1.3	0	0	0	110.5	S287	D285-S287 WeakPolarHBondContact OD1-CB 3.35Å; D285-S287 PolarHBondContact OD1-N 3.39Å; D285-S287 PolarHBondContact OD1-OG 2.93Å; D285-S287 PolarHBondContact OD2-OG 3.07Å
286	Y	71.6	Confident	62.1	Low	8 Å²	8	71 Å²	71	3%	0.031	37%	0.374	C	S	.	.			trans	-94.5	7.7	177.9	-70.4	-86.7	0	0	0	112.8	Q284 Q289 H467 N469 Q470	Q284-Y286 HydrophobicContact CB-CE2 4.05Å; Q284-Y286 WeakPolarHBondContact O-CD2 3.42Å; Q284-Y286 VanDerWaalsContact O-CE2 3.23Å; Q284-Y286 WeakPolarHBondContact O-CE2 3.4Å; Q284-Y286 PolarHBondContact O-N 2.92Å; Y286-Q289 VanDerWaalsContact CD1-CD 3.43Å; Y286-Q289 HydrophobicContact CD1-CG 4.19Å; Y286-H467 HydrophobicContact CD2-CB 4.23Å; Y286-H467 AromaticContact CD2-CD2 3.6Å; Y286-H467 AromaticContact CD2-CE1 3.72Å; Y286-H467 AromaticContact CD2-CG 3.55Å; Y286-H467 AromaticContact CD2-ND1 3.57Å; Y286-H467 AromaticContact CD2-NE2 3.75Å; Y286-H467 HydrophobicContact CE2-CB 3.79Å; Y286-H467 AromaticContact CE2-CG 3.62Å; Y286-H467 AromaticContact CE2-ND1 3.83Å; Y286-N469 HydrophobicContact CD1-CB 3.27Å; Y286-N469 HydrophobicContact CD2-CB 4.14Å; Y286-N469 HydrophobicContact CE1-CB 3.41Å; Y286-N469 VanDerWaalsContact CE1-CB 3.41Å; Y286-N469 HydrophobicContact CE2-CB 4.27Å; Y286-N469 HydrophobicContact CG-CB 3.69Å; Y286-Q470 HydrophobicContact CE2-CB 4.32Å; Y286-Q470 WeakPolarHBondContact OH-CA 3.14Å; Y286-Q470 WeakPolarHBondContact OH-CB 3.33Å; Y286-Q470 PolarHBondContact OH-N 3.02Å
287	S	62.7	Low	62.7	Low	22 Å²	22	66.6 Å²	66.6	15%	0.154	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-42.2	174.5	63.5	0	0	0	0	112.5	D285	D285-S287 WeakPolarHBondContact OD1-CB 3.35Å; D285-S287 PolarHBondContact OD1-N 3.39Å; D285-S287 PolarHBondContact OD1-OG 2.93Å; D285-S287 PolarHBondContact OD2-OG 3.07Å
288	V	56.3	Low	63.3	Low	93 Å²	93	72.6 Å²	72.6	56%	0.564	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	62.1	-174	-165.6	0	0	0	0	111.2	K290	V288-K290 HydrophobicContact CG1-CG 4.31Å; V288-K290 PolarHBondContact O-N 3.5Å
289	Q	53.4	Low	64.5	Low	50 Å²	50	76.3 Å²	76.3	23%	0.234	40%	0.397	C	S	.	.			trans	-86.5	98.5	166.9	-81.7	-163.8	-20.9	0	0	111	Y286 N291 V292 G339	Y286-Q289 VanDerWaalsContact CD1-CD 3.43Å; Y286-Q289 HydrophobicContact CD1-CG 4.19Å; Q289-N291 VanDerWaalsContact C-N 3.33Å; Q289-V292 HydrophobicContact CB-CG2 4.29Å; Q289-G339 PolarHBondContact OE1-O 3.43Å
290	K	47.4	Very low	66.1	Low	178 Å²	178	70.1 Å²	70.1	77%	0.774	37%	0.369	S	S	*	.			trans	-74.9	-13	175.9	-79.5	-178.7	175.7	178.6	0	114.6	V288	V288-K290 HydrophobicContact CG1-CG 4.31Å; V288-K290 PolarHBondContact O-N 3.5Å
291	N	46.8	Very low	67.9	Low	156 Å²	156	71.5 Å²	71.5	83%	0.834	37%	0.372	S	S	*	.			trans	-146.3	36.7	-164.3	-66.4	-38.5	0	0	0	115	Q289	Q289-N291 VanDerWaalsContact C-N 3.33Å
292	V	51.4	Low	69.7	Low	35 Å²	35	72.2 Å²	72.2	21%	0.212	39%	0.385	C	S	.	.	S	Bend	trans	-79.3	125	154.2	-173.3	0	0	0	0	105.2	Q289 K294 I340 F472	Q289-V292 HydrophobicContact CB-CG2 4.29Å; V292-K294 PolarHBondContact O-N 3.41Å; V292-I340 WeakPolarHBondContact CB-O 3.44Å; V292-I340 WeakPolarHBondContact CG1-O 3.32Å; V292-F472 HydrophobicContact CG1-CE1 4.07Å
293	G	56.1	Low	71.4	Confident	43 Å²	43	70.9 Å²	70.9	44%	0.443	38%	0.378	S	S	.	.			trans	-45.3	138.3	-176.5	0	0	0	0	0	111.1	I295	G293-I295 WeakPolarHBondContact O-CG1 3.44Å; G293-I295 PolarHBondContact O-N 2.85Å
294	K	66.1	Low	73.2	Confident	200 Å²	200	69.7 Å²	69.7	87%	0.87	37%	0.366	S	S	*	.			trans	-53.6	103.7	-175.5	-69.9	-179.6	179.8	177.3	0	109.6	V292 S296	V292-K294 PolarHBondContact O-N 3.41Å; K294-S296 PolarHBondContact O-N 3.39Å
295	I	79.6	Confident	74.5	Confident	10 Å²	10	66 Å²	66	5%	0.051	36%	0.358	C	S	.	.			trans	-73.6	127.3	175.5	-62.6	177.9	0	0	0	107.2	G293 Q299 I300 L303 I340 Q346 F472	G293-I295 WeakPolarHBondContact O-CG1 3.44Å; G293-I295 PolarHBondContact O-N 2.85Å; I295-Q299 HydrophobicContact CG2-CB 4.3Å; I295-I300 HydrophobicContact CG2-CG1 4.31Å; I295-L303 HydrophobicContact CD1-CD1 4Å; I295-L303 HydrophobicContact CG1-CD1 4.32Å; I295-L303 HydrophobicContact CG2-CD1 3.62Å; I295-I340 HydrophobicContact CD1-CB 3.74Å; I295-I340 HydrophobicContact CD1-CD1 3.66Å; I295-I340 HydrophobicContact CD1-CG1 3.7Å; I295-I340 WeakPolarHBondContact CD1-O 3.45Å; I295-Q346 PolarHBondContact O-NE2 2.94Å; I295-F472 HydrophobicContact CD1-CE1 3.79Å; I295-F472 HydrophobicContact CD1-CE2 4.43Å; I295-F472 HydrophobicContact CD1-CZ 3.45Å; I295-F472 VanDerWaalsContact CD1-CZ 3.45Å
296	S	83.8	Confident	75.8	Confident	34 Å²	34	67.8 Å²	67.8	24%	0.238	36%	0.361	C	S	.	.			trans	-84	156.9	174.1	88.4	0	0	0	0	110.6	K294 E298 Q299	K294-S296 PolarHBondContact O-N 3.39Å; S296-E298 WeakPolarHBondContact CB-OE2 3.36Å; S296-E298 PolarHBondContact O-N 3.37Å; S296-E298 PolarHBondContact OG-OE2 3.21Å; S296-Q299 VanDerWaalsContact N-OE1 3.07Å; S296-Q299 PolarHBondContact O-N 3.23Å; S296-Q299 VanDerWaalsContact O-N 3.16Å; S296-Q299 WeakPolarHBondContact OG-CG 3.33Å
297	L	86.7	Confident	76.9	Confident	20 Å²	20	67.4 Å²	67.4	11%	0.105	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-62.6	-33.7	-176.8	-74.7	176.1	0	0	0	112.5	Q299 I300 L342 Q346 Q349 F350	L297-Q299 PolarHBondContact O-N 2.66Å; L297-I300 HydrophobicContact CD2-CD1 3.93Å; L297-I300 PolarHBondContact O-N 2.73Å; L297-L342 HydrophobicContact CD2-CD1 3.94Å; L297-Q346 HydrophobicContact CD1-CB 4.4Å; L297-Q346 HydrophobicContact CD2-CB 4Å; L297-Q346 WeakPolarHBondContact CD2-O 3.42Å; L297-Q346 HydrophobicContact CG-CB 4.16Å; L297-Q346 HydrophobicContact CG-CG 4.32Å; L297-Q349 HydrophobicContact CD1-CB 4.08Å; L297-Q349 VanDerWaalsContact CD1-CD 3.48Å; L297-Q349 HydrophobicContact CD1-CG 3.86Å; L297-F350 HydrophobicContact CD2-CB 3.71Å; L297-F350 HydrophobicContact CD2-CD2 4.24Å; L297-F350 HydrophobicContact CD2-CG 4.35Å
298	E	88.4	Confident	78.6	Confident	140 Å²	140	66.5 Å²	66.5	65%	0.654	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-71.1	-22.2	-178.3	-49.5	73.7	-153.8	0	0	111.8	S296	S296-E298 WeakPolarHBondContact CB-OE2 3.36Å; S296-E298 PolarHBondContact O-N 3.37Å; S296-E298 PolarHBondContact OG-OE2 3.21Å
299	Q	89.5	Confident	80.5	Confident	94 Å²	94	62.1 Å²	62.1	44%	0.439	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-81	-20.8	-179.8	-69.7	171.7	-20.9	0	0	112.8	I295 S296 L297 D301 S302 L303	I295-Q299 HydrophobicContact CG2-CB 4.3Å; S296-Q299 VanDerWaalsContact N-OE1 3.07Å; S296-Q299 PolarHBondContact O-N 3.23Å; S296-Q299 VanDerWaalsContact O-N 3.16Å; S296-Q299 WeakPolarHBondContact OG-CG 3.33Å; L297-Q299 PolarHBondContact O-N 2.66Å; Q299-D301 VanDerWaalsContact C-N 3.32Å; Q299-D301 PolarHBondContact O-N 2.99Å; Q299-S302 PolarHBondContact O-N 3.33Å; Q299-S302 VanDerWaalsContact O-N 3.16Å; Q299-L303 HydrophobicContact CB-CD1 4.11Å; Q299-L303 HydrophobicContact CB-CG 4.45Å; Q299-L303 VanDerWaalsContact O-CG 3.3Å; Q299-L303 WeakPolarHBondContact O-CG 3.41Å; Q299-L303 PolarHBondContact O-N 3.26Å
300	I	92.9	Very high	82.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-43.2	-170.5	-63	178.4	0	0	0	111.6	I295 L297 S302 L303 A304 F308 L337 L342 F350	I295-I300 HydrophobicContact CG2-CG1 4.31Å; L297-I300 HydrophobicContact CD2-CD1 3.93Å; L297-I300 PolarHBondContact O-N 2.73Å; I300-S302 PolarHBondContact O-N 3.48Å; I300-L303 PolarHBondContact O-N 2.86Å; I300-A304 WeakPolarHBondContact O-CB 3.46Å; I300-A304 PolarHBondContact O-N 3.31Å; I300-F308 HydrophobicContact CG2-CE2 4.47Å; I300-F308 HydrophobicContact CG2-CZ 4.3Å; I300-L337 HydrophobicContact CG2-CD2 4.48Å; I300-L342 HydrophobicContact CD1-CD1 4.07Å; I300-L342 HydrophobicContact CD1-CD2 4.31Å; I300-F350 HydrophobicContact CD1-CD2 3.93Å; I300-F350 HydrophobicContact CD1-CE2 4.08Å; I300-F350 HydrophobicContact CD1-CG 4.49Å; I300-F350 HydrophobicContact CG2-CE2 4.28Å
301	D	94	Very high	85	Confident	78 Å²	78	51.9 Å²	51.9	42%	0.417	28%	0.282	S	S	.	.	H	α-helix	trans	-64.2	-42.1	-178.8	-63.4	-33.4	0	0	0	111.9	Q299 A304 G305 H316 R320	Q299-D301 VanDerWaalsContact C-N 3.32Å; Q299-D301 PolarHBondContact O-N 2.99Å; D301-A304 PolarHBondContact O-N 3.29Å; D301-G305 PolarHBondContact O-N 3.49Å; D301-H316 IonicContact OD1-CE1 2.89Å; D301-H316 PolarHBondContact OD1-CE1 3.31Å; D301-H316 IonicContact OD1-NE2 3.78Å; D301-H316 PolarHBondContact OD1-NE2 3.01Å; D301-R320 IonicContact OD1-CZ 3.45Å; D301-R320 IonicContact OD1-NE 3.84Å; D301-R320 PolarHBondContact OD1-NE 3.47Å; D301-R320 IonicContact OD1-NH2 3.99Å; D301-R320 PolarHBondContact OD1-NH2 3.38Å; D301-R320 IonicContact OD2-CZ 2.77Å; D301-R320 IonicContact OD2-NH2 3.83Å; D301-R320 PolarHBondContact OD2-NH2 3.46Å
302	S	93.4	Very high	87.4	Confident	66 Å²	66	44.6 Å²	44.6	46%	0.462	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-43.2	176.2	-178.4	0	0	0	0	111.5	Q299 I300 A304 G305 K306	Q299-S302 PolarHBondContact O-N 3.33Å; Q299-S302 VanDerWaalsContact O-N 3.16Å; I300-S302 PolarHBondContact O-N 3.48Å; S302-A304 VanDerWaalsContact C-N 3.33Å; S302-A304 PolarHBondContact O-N 2.9Å; S302-G305 PolarHBondContact O-N 2.84Å; S302-K306 PolarHBondContact O-N 3.29Å
303	L	94.1	Very high	89.6	Confident	20 Å²	20	45.4 Å²	45.4	11%	0.105	24%	0.243	C	C	.	.	H	α-helix	trans	-66.9	-33.9	177.5	-67.9	174.4	0	0	0	112.1	I295 Q299 I300 G305 K306 S307 F308 F472 Q476	I295-L303 HydrophobicContact CD1-CD1 4Å; I295-L303 HydrophobicContact CG1-CD1 4.32Å; I295-L303 HydrophobicContact CG2-CD1 3.62Å; Q299-L303 HydrophobicContact CB-CD1 4.11Å; Q299-L303 HydrophobicContact CB-CG 4.45Å; Q299-L303 VanDerWaalsContact O-CG 3.3Å; Q299-L303 WeakPolarHBondContact O-CG 3.41Å; Q299-L303 PolarHBondContact O-N 3.26Å; I300-L303 PolarHBondContact O-N 2.86Å; L303-G305 VanDerWaalsContact C-N 3.29Å; L303-G305 PolarHBondContact O-N 2.98Å; L303-K306 PolarHBondContact O-N 2.96Å; L303-S307 WeakPolarHBondContact O-CA 3.42Å; L303-S307 PolarHBondContact O-N 3.34Å; L303-F308 HydrophobicContact CB-CD1 4.47Å; L303-F308 HydrophobicContact CB-CE1 3.88Å; L303-F308 HydrophobicContact CB-CZ 4.39Å; L303-F308 PolarHBondContact O-N 2.87Å; L303-F308 VanDerWaalsContact O-N 3.13Å; L303-F472 HydrophobicContact CB-CE2 4.32Å; L303-F472 HydrophobicContact CD1-CE2 4.16Å; L303-F472 HydrophobicContact CD1-CZ 4.16Å; L303-F472 HydrophobicContact CD2-CE2 4.11Å; L303-F472 HydrophobicContact CD2-CZ 4.41Å; L303-F472 HydrophobicContact CG-CE2 4.43Å; L303-Q476 VanDerWaalsContact CD2-NE2 3.31Å
304	A	94.9	Very high	91.5	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-36.8	177.4	0	0	0	0	0	112.5	I300 D301 S302 F308 R313 H316	I300-A304 WeakPolarHBondContact O-CB 3.46Å; I300-A304 PolarHBondContact O-N 3.31Å; D301-A304 PolarHBondContact O-N 3.29Å; S302-A304 VanDerWaalsContact C-N 3.33Å; S302-A304 PolarHBondContact O-N 2.9Å; A304-F308 HydrophobicContact CB-CD2 3.7Å; A304-F308 HydrophobicContact CB-CE2 3.83Å; A304-F308 HydrophobicContact CB-CG 4.29Å; A304-R313 WeakPolarHBondContact O-CG 3.38Å; A304-H316 HydrophobicContact CB-CB 4.07Å; A304-H316 WeakPolarHBondContact CB-CD2 2.98Å; A304-H316 VanDerWaalsContact CB-CG 3.49Å
305	G	91.6	Very high	93	Very high	36 Å²	36	35.1 Å²	35.1	37%	0.371	19%	0.186	S	C	.	.	H	α-helix	trans	-74.6	-32.7	177.1	0	0	0	0	0	114.3	D301 S302 L303	D301-G305 PolarHBondContact O-N 3.49Å; S302-G305 PolarHBondContact O-N 2.84Å; L303-G305 VanDerWaalsContact C-N 3.29Å; L303-G305 PolarHBondContact O-N 2.98Å
306	K	91.8	Very high	93.9	Very high	137 Å²	137	35.2 Å²	35.2	60%	0.596	19%	0.186	S	C	*	.	H	α-helix	trans	-106.4	-34.9	-169	-64.7	179.5	-178.9	176.8	0	114.5	S302 L303 H456 S475 L479	S302-K306 PolarHBondContact O-N 3.29Å; L303-K306 PolarHBondContact O-N 2.96Å; K306-H456 PolarHBondContact O-NE2 3.49Å; K306-S475 PolarHBondContact O-OG 3.48Å; K306-L479 HydrophobicContact CB-CD1 4.05Å
307	S	95	Very high	94.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-8.2	-165.6	-63.5	0	0	0	0	115.4	L303 Y471 S475 Q476 L479	L303-S307 WeakPolarHBondContact O-CA 3.42Å; L303-S307 PolarHBondContact O-N 3.34Å; S307-Y471 WeakPolarHBondContact O-CD1 3.17Å; S307-Y471 WeakPolarHBondContact O-CE1 3.46Å; S307-S475 WeakPolarHBondContact CA-OG 3.25Å; S307-S475 WeakPolarHBondContact CB-OG 3.3Å; S307-S475 PolarHBondContact OG-OG 3.16Å; S307-Q476 PolarHBondContact OG-NE2 3.06Å; S307-L479 WeakPolarHBondContact OG-CD1 3.34Å
308	F	97.1	Very high	94.9	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.013	19%	0.192	C	C	.	.	S	Bend	trans	-82.4	138	175.2	-73	12	0	0	0	110.5	I300 L303 A304 M312 R313 Y333 F336 L337 I340 F472	I300-F308 HydrophobicContact CG2-CE2 4.47Å; I300-F308 HydrophobicContact CG2-CZ 4.3Å; L303-F308 HydrophobicContact CB-CD1 4.47Å; L303-F308 HydrophobicContact CB-CE1 3.88Å; L303-F308 HydrophobicContact CB-CZ 4.39Å; L303-F308 PolarHBondContact O-N 2.87Å; L303-F308 VanDerWaalsContact O-N 3.13Å; A304-F308 HydrophobicContact CB-CD2 3.7Å; A304-F308 HydrophobicContact CB-CE2 3.83Å; A304-F308 HydrophobicContact CB-CG 4.29Å; F308-M312 HydrophobicContact CB-CB 4.13Å; F308-M312 HydrophobicContact CD2-CB 4.03Å; F308-M312 HydrophobicContact CG-CB 4.25Å; F308-R313 HydrophobicContact CB-CB 4.34Å; F308-Y333 HydrophobicContact CD2-CE2 4.25Å; F308-Y333 AromaticContact CE2-CE2 3.8Å; F308-Y333 HydrophobicContact CE2-CE2 3.8Å; F308-F336 AromaticContact CD1-CE1 3.8Å; F308-F336 HydrophobicContact CD1-CE1 3.8Å; F308-F336 AromaticContact CD1-CZ 3.78Å; F308-F336 HydrophobicContact CD1-CZ 3.78Å; F308-F336 AromaticContact CD2-CE1 3.94Å; F308-F336 HydrophobicContact CD2-CE1 3.94Å; F308-F336 AromaticContact CE1-CE1 3.69Å; F308-F336 HydrophobicContact CE1-CE1 3.69Å; F308-F336 AromaticContact CE1-CZ 3.95Å; F308-F336 HydrophobicContact CE1-CZ 3.95Å; F308-F336 AromaticContact CE2-CE1 3.86Å; F308-F336 HydrophobicContact CE2-CE1 3.86Å; F308-F336 AromaticContact CG-CE1 3.93Å; F308-F336 HydrophobicContact CG-CE1 3.93Å; F308-F336 HydrophobicContact CG-CZ 4.12Å; F308-F336 AromaticContact CZ-CE1 3.73Å; F308-F336 HydrophobicContact CZ-CE1 3.73Å; F308-F336 HydrophobicContact CZ-CZ 4.45Å; F308-L337 HydrophobicContact CZ-CD2 4.21Å; F308-I340 HydrophobicContact CE1-CD1 3.91Å; F308-I340 HydrophobicContact CZ-CD1 3.96Å; F308-F472 AromaticContact CD1-CD2 3.88Å; F308-F472 HydrophobicContact CD1-CD2 3.88Å; F308-F472 HydrophobicContact CD1-CE2 4.25Å; F308-F472 AromaticContact CE1-CD2 3.94Å; F308-F472 HydrophobicContact CE1-CD2 3.94Å; F308-F472 AromaticContact CE1-CE2 3.94Å; F308-F472 HydrophobicContact CE1-CE2 3.94Å
309	P	97.1	Very high	95.3	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.013	16%	0.16	C	C	.	.			trans	-63.6	159.2	166.3	27.5	-32.5	0	0	0	109.7	C311 M312 R313 P468 Y471	P309-C311 PolarHBondContact O-N 3.3Å; P309-M312 HydrophobicContact CG-CB 4.3Å; P309-M312 HydrophobicContact CG-CG 3.93Å; P309-M312 PolarHBondContact O-N 3.29Å; P309-R313 PolarHBondContact O-N 3.32Å; P309-P468 HydrophobicContact CG-CB 3.88Å; P309-Y471 HydrophobicContact CB-CD1 3.86Å; P309-Y471 HydrophobicContact CB-CD2 3.78Å; P309-Y471 HydrophobicContact CB-CE1 4.22Å; P309-Y471 HydrophobicContact CB-CE2 4.08Å; P309-Y471 HydrophobicContact CB-CG 3.66Å; P309-Y471 HydrophobicContact CG-CD1 4.2Å; P309-Y471 HydrophobicContact CG-CG 4.14Å
310	L	96.9	Very high	95.6	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-53.2	-36.8	-173.9	-161.2	62	0	0	0	113.6	M312 Q314 P409 F410 L418 L422 Y425 Y451	L310-M312 PolarHBondContact O-N 3.46Å; L310-Q314 WeakPolarHBondContact O-CB 3.49Å; L310-Q314 PolarHBondContact O-N 3.15Å; L310-P409 HydrophobicContact CB-CG 4.23Å; L310-P409 HydrophobicContact CD2-CB 3.84Å; L310-P409 HydrophobicContact CD2-CG 4.31Å; L310-P409 HydrophobicContact CG-CB 4.06Å; L310-P409 HydrophobicContact CG-CG 3.98Å; L310-F410 HydrophobicContact CB-CE2 3.9Å; L310-F410 HydrophobicContact CB-CZ 4.11Å; L310-F410 HydrophobicContact CD2-CE1 3.99Å; L310-F410 HydrophobicContact CD2-CE2 3.99Å; L310-F410 HydrophobicContact CD2-CZ 3.6Å; L310-L418 HydrophobicContact CD2-CD1 3.8Å; L310-L422 HydrophobicContact CD2-CD2 4.13Å; L310-Y425 HydrophobicContact CD1-CD2 3.62Å; L310-Y425 HydrophobicContact CD1-CE2 3.3Å; L310-Y451 HydrophobicContact CB-CE1 4.5Å; L310-Y451 HydrophobicContact CD1-CE2 4.44Å
311	C	97.4	Very high	95.7	Very high	11 Å²	11	33.5 Å²	33.5	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-62	-39.6	177	52.6	0	0	0	0	113.3	P309 L315 G407 P409	P309-C311 PolarHBondContact O-N 3.3Å; C311-L315 PolarHBondContact O-N 2.96Å; C311-G407 WeakPolarHBondContact CB-O 3.31Å; C311-P409 VanDerWaalsContact CA-CD 3.47Å; C311-P409 HydrophobicContact CB-CG 4.32Å
312	M	97.9	Very high	95.7	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-85.1	-32.9	-180	-55.7	-51.4	162.3	0	0	111.4	F308 P309 L310 Q314 L315 H316 Q332 Y333 F336 P468	F308-M312 HydrophobicContact CB-CB 4.13Å; F308-M312 HydrophobicContact CD2-CB 4.03Å; F308-M312 HydrophobicContact CG-CB 4.25Å; P309-M312 HydrophobicContact CG-CB 4.3Å; P309-M312 HydrophobicContact CG-CG 3.93Å; P309-M312 PolarHBondContact O-N 3.29Å; L310-M312 PolarHBondContact O-N 3.46Å; M312-Q314 VanDerWaalsContact C-N 3.32Å; M312-Q314 PolarHBondContact O-N 3.08Å; M312-L315 PolarHBondContact O-N 3.24Å; M312-L315 HydrophobicContact SD-CD1 4.04Å; M312-H316 WeakPolarHBondContact O-CB 3.19Å; M312-H316 PolarHBondContact O-N 2.88Å; M312-Q332 HydrophobicContact CE-CG 3.68Å; M312-Q332 HydrophobicContact SD-CG 4.08Å; M312-Y333 HydrophobicContact CB-CD2 4.43Å; M312-Y333 HydrophobicContact SD-CD2 4.43Å; M312-F336 HydrophobicContact CB-CD1 3.96Å; M312-F336 HydrophobicContact CB-CE1 3.85Å; M312-F336 HydrophobicContact CB-CG 4.44Å; M312-F336 HydrophobicContact CB-CZ 4.25Å; M312-F336 HydrophobicContact CE-CB 4.2Å; M312-F336 HydrophobicContact CE-CG 4.4Å; M312-F336 HydrophobicContact CG-CB 4.33Å; M312-F336 HydrophobicContact CG-CD1 3.72Å; M312-F336 HydrophobicContact CG-CD2 3.87Å; M312-F336 HydrophobicContact CG-CE1 3.93Å; M312-F336 HydrophobicContact CG-CE2 4.08Å; M312-F336 HydrophobicContact CG-CG 3.69Å; M312-F336 HydrophobicContact CG-CZ 4.1Å; M312-F336 HydrophobicContact SD-CB 3.9Å; M312-F336 HydrophobicContact SD-CD1 4.19Å; M312-F336 HydrophobicContact SD-CD2 4.47Å; M312-F336 HydrophobicContact SD-CG 3.93Å; M312-P468 HydrophobicContact CE-CB 3.54Å; M312-P468 HydrophobicContact CE-CG 3.49Å; M312-P468 VanDerWaalsContact CE-CG 3.49Å; M312-P468 HydrophobicContact CG-CB 4.16Å
313	R	97.1	Very high	95.9	Very high	53 Å²	53	33.6 Å²	33.6	20%	0.2	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-42	171.7	-173.5	174.6	-176.2	171.2	7	111.7	A304 F308 P309 H316 Q317 Y425 Y451	A304-R313 WeakPolarHBondContact O-CG 3.38Å; F308-R313 HydrophobicContact CB-CB 4.34Å; P309-R313 PolarHBondContact O-N 3.32Å; R313-H316 PolarHBondContact O-N 3.35Å; R313-Q317 WeakPolarHBondContact O-CB 3.46Å; R313-Q317 PolarHBondContact O-N 3.08Å; R313-Y425 VanDerWaalsContact CZ-CD1 3.41Å; R313-Y451 PolarHBondContact NH1-OH 3.33Å
314	Q	96.1	Very high	95.9	Very high	27 Å²	27	35.3 Å²	35.3	13%	0.126	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-45.7	175.2	178.5	172.8	-62.3	0	0	112.1	L310 M312 Q317 A318 Y405	L310-Q314 WeakPolarHBondContact O-CB 3.49Å; L310-Q314 PolarHBondContact O-N 3.15Å; M312-Q314 VanDerWaalsContact C-N 3.32Å; M312-Q314 PolarHBondContact O-N 3.08Å; Q314-Q317 PolarHBondContact O-N 3.17Å; Q314-A318 WeakPolarHBondContact O-CB 3.4Å; Q314-A318 PolarHBondContact O-N 3.49Å; Q314-Y405 HydrophobicContact CG-CD1 4.48Å; Q314-Y405 PolarHBondContact NE2-O 3.28Å
315	L	97.8	Very high	95.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-41.1	178.1	-76.7	164.9	0	0	0	112.1	C311 M312 L319 L325 Q332 Y333 H406	C311-L315 PolarHBondContact O-N 2.96Å; M312-L315 PolarHBondContact O-N 3.24Å; M312-L315 HydrophobicContact SD-CD1 4.04Å; L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.43Å; L315-L319 PolarHBondContact O-N 3.23Å; L315-L325 HydrophobicContact CD2-CD1 4.19Å; L315-L325 HydrophobicContact CD2-CD2 4.09Å; L315-Q332 HydrophobicContact CD1-CB 4.05Å; L315-Q332 HydrophobicContact CD1-CG 3.77Å; L315-Y333 HydrophobicContact CB-CD2 4.05Å; L315-Y333 HydrophobicContact CB-CG 4.05Å; L315-H406 HydrophobicContact CD2-CB 4.16Å
316	H	97.8	Very high	96	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-48.3	175.3	-177.4	84	0	0	0	111.6	D301 A304 M312 R313 L319 R320 Y333	D301-H316 IonicContact OD1-CE1 2.89Å; D301-H316 PolarHBondContact OD1-CE1 3.31Å; D301-H316 IonicContact OD1-NE2 3.78Å; D301-H316 PolarHBondContact OD1-NE2 3.01Å; A304-H316 HydrophobicContact CB-CB 4.07Å; A304-H316 WeakPolarHBondContact CB-CD2 2.98Å; A304-H316 VanDerWaalsContact CB-CG 3.49Å; M312-H316 WeakPolarHBondContact O-CB 3.19Å; M312-H316 PolarHBondContact O-N 2.88Å; R313-H316 PolarHBondContact O-N 3.35Å; H316-L319 PolarHBondContact O-N 3.26Å; H316-R320 WeakPolarHBondContact O-CG 3.47Å; H316-R320 PolarHBondContact O-N 2.99Å; H316-Y333 HydrophobicContact CB-CE2 4.15Å; H316-Y333 AromaticContact ND1-CZ 3.81Å; H316-Y333 PolarHBondContact ND1-OH 3.41Å
317	Q	96.2	Very high	95.9	Very high	88 Å²	88	38.6 Å²	38.6	41%	0.411	18%	0.175	S	C	.	.	H	α-helix	trans	-61.6	-48.1	178.2	-172.8	63.2	48.8	0	0	111.5	R313 Q314 L319 R320 D321	R313-Q317 WeakPolarHBondContact O-CB 3.46Å; R313-Q317 PolarHBondContact O-N 3.08Å; Q314-Q317 PolarHBondContact O-N 3.17Å; Q317-L319 VanDerWaalsContact C-N 3.29Å; Q317-L319 PolarHBondContact O-N 3.43Å; Q317-R320 PolarHBondContact O-N 3.21Å; Q317-R320 VanDerWaalsContact O-N 3.14Å; Q317-D321 WeakPolarHBondContact CG-OD2 3.4Å; Q317-D321 PolarHBondContact NE2-OD1 3.04Å; Q317-D321 PolarHBondContact NE2-OD2 3.49Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.23Å; Q317-D321 PolarHBondContact O-N 2.82Å
318	A	96.3	Very high	95.8	Very high	5 Å²	5	39.4 Å²	39.4	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-40.2	178.2	0	0	0	0	0	112.2	Q314 D321 Q322 L325 Y405	Q314-A318 WeakPolarHBondContact O-CB 3.4Å; Q314-A318 PolarHBondContact O-N 3.49Å; A318-D321 PolarHBondContact O-N 2.79Å; A318-Q322 VanDerWaalsContact O-CB 3.27Å; A318-Q322 WeakPolarHBondContact O-CB 3.19Å; A318-Q322 WeakPolarHBondContact O-CG 3.48Å; A318-Q322 PolarHBondContact O-N 3.16Å; A318-L325 HydrophobicContact CB-CD2 4.06Å; A318-Y405 HydrophobicContact CB-CD1 3.63Å; A318-Y405 HydrophobicContact CB-CD2 3.71Å; A318-Y405 HydrophobicContact CB-CE1 4.2Å; A318-Y405 HydrophobicContact CB-CE2 4.29Å; A318-Y405 HydrophobicContact CB-CG 3.37Å
319	L	96.6	Very high	95.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-43.7	175.5	176.1	58.7	0	0	0	111.9	L315 H316 Q317 H323 L325 Y333 F350 W351 E354 F355	L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.43Å; L315-L319 PolarHBondContact O-N 3.23Å; H316-L319 PolarHBondContact O-N 3.26Å; Q317-L319 VanDerWaalsContact C-N 3.29Å; Q317-L319 PolarHBondContact O-N 3.43Å; L319-H323 WeakPolarHBondContact O-CA 3.42Å; L319-H323 PolarHBondContact O-N 3.39Å; L319-L325 HydrophobicContact CB-CD1 3.84Å; L319-L325 HydrophobicContact CB-CG 3.94Å; L319-L325 HydrophobicContact CD1-CD1 4.36Å; L319-L325 HydrophobicContact CD1-CG 4.15Å; L319-L325 HydrophobicContact CD2-CD1 4.39Å; L319-L325 HydrophobicContact CG-CD1 4.41Å; L319-Y333 HydrophobicContact CD2-CD1 4.17Å; L319-Y333 HydrophobicContact CD2-CE1 3.85Å; L319-F350 HydrophobicContact CD2-CE1 3.48Å; L319-F350 VanDerWaalsContact CD2-CE1 3.48Å; L319-F350 HydrophobicContact CD2-CZ 3.63Å; L319-W351 HydrophobicContact CD1-CE3 4.2Å; L319-W351 HydrophobicContact CD1-CZ3 3.84Å; L319-W351 HydrophobicContact CD2-CE3 4.14Å; L319-W351 HydrophobicContact CD2-CH2 4.14Å; L319-W351 HydrophobicContact CD2-CZ3 3.72Å; L319-W351 HydrophobicContact CG-CZ3 4.42Å; L319-E354 HydrophobicContact CD1-CB 4.35Å; L319-E354 HydrophobicContact CD1-CG 3.68Å; L319-E354 HydrophobicContact CD2-CG 4.48Å; L319-E354 HydrophobicContact CG-CG 3.78Å; L319-F355 HydrophobicContact CD1-CD1 4.14Å; L319-F355 HydrophobicContact CD1-CE1 3.62Å
320	R	95.9	Very high	95.6	Very high	56 Å²	56	41.1 Å²	41.1	21%	0.211	19%	0.19	C	C	.	.	H	α-helix	trans	-70.3	-31.9	178.3	-67.9	-59.7	-165.6	-171.5	3	113.2	D301 H316 Q317 H323 E354	D301-R320 IonicContact OD1-CZ 3.45Å; D301-R320 IonicContact OD1-NE 3.84Å; D301-R320 PolarHBondContact OD1-NE 3.47Å; D301-R320 IonicContact OD1-NH2 3.99Å; D301-R320 PolarHBondContact OD1-NH2 3.38Å; D301-R320 IonicContact OD2-CZ 2.77Å; D301-R320 IonicContact OD2-NH2 3.83Å; D301-R320 PolarHBondContact OD2-NH2 3.46Å; H316-R320 WeakPolarHBondContact O-CG 3.47Å; H316-R320 PolarHBondContact O-N 2.99Å; Q317-R320 PolarHBondContact O-N 3.21Å; Q317-R320 VanDerWaalsContact O-N 3.14Å; R320-H323 PolarHBondContact O-CE1 3.42Å; R320-H323 PolarHBondContact O-ND1 3.43Å; R320-E354 WeakPolarHBondContact CA-OE1 3.4Å; R320-E354 IonicContact CZ-OE2 2.9Å; R320-E354 IonicContact NH1-OE2 2.68Å; R320-E354 PolarHBondContact NH1-OE2 3.19Å
321	D	94.9	Very high	95.4	Very high	103 Å²	103	41.8 Å²	41.8	55%	0.551	19%	0.194	S	C	*	.	H	α-helix	trans	-83	-38.9	-178.5	-67.8	-19.5	0	0	0	112.6	Q317 A318	Q317-D321 WeakPolarHBondContact CG-OD2 3.4Å; Q317-D321 PolarHBondContact NE2-OD1 3.04Å; Q317-D321 PolarHBondContact NE2-OD2 3.49Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.23Å; Q317-D321 PolarHBondContact O-N 2.82Å; A318-D321 PolarHBondContact O-N 2.79Å
322	Q	94.8	Very high	95.3	Very high	89 Å²	89	41.5 Å²	41.5	42%	0.416	19%	0.191	S	C	.	.	H	α-helix	trans	-100.1	-11.5	-173.9	-57.9	-171.1	-12.3	0	0	113.1	A318 H324 Y405	A318-Q322 VanDerWaalsContact O-CB 3.27Å; A318-Q322 WeakPolarHBondContact O-CB 3.19Å; A318-Q322 WeakPolarHBondContact O-CG 3.48Å; A318-Q322 PolarHBondContact O-N 3.16Å; Q322-H324 PolarHBondContact O-N 2.93Å; Q322-Y405 PolarHBondContact NE2-OH 3.16Å
323	H	95.6	Very high	95.2	Very high	57 Å²	57	41.4 Å²	41.4	26%	0.264	19%	0.191	S	C	.	.	S	Bend	trans	54.1	24.5	-173.1	-52.4	-50.2	0	0	0	112.7	L319 R320 E354 F355 R357 G358	L319-H323 WeakPolarHBondContact O-CA 3.42Å; L319-H323 PolarHBondContact O-N 3.39Å; R320-H323 PolarHBondContact O-CE1 3.42Å; R320-H323 PolarHBondContact O-ND1 3.43Å; H323-E354 WeakPolarHBondContact CB-O 3.44Å; H323-E354 IonicContact CE1-OE1 3.54Å; H323-E354 IonicContact CG-OE1 2.7Å; H323-E354 IonicContact ND1-OE1 3.19Å; H323-E354 PolarHBondContact ND1-OE1 2.88Å; H323-F355 WeakPolarHBondContact O-CA 3.31Å; H323-F355 WeakPolarHBondContact O-CD1 3.42Å; H323-R357 HydrophobicContact CB-CB 4.4Å; H323-G358 VanDerWaalsContact CB-CA 3.5Å
324	H	94.2	Very high	95.1	Very high	55 Å²	55	39 Å²	39	26%	0.255	18%	0.182	S	C	.	.			trans	-159.2	154	179.8	-169.4	-97.4	0	0	0	111.1	Q322 F355 Y369	Q322-H324 PolarHBondContact O-N 2.93Å; H324-F355 AromaticContact CD2-CE2 3.96Å; H324-F355 AromaticContact CD2-CZ 3.97Å; H324-Y369 AromaticContact NE2-CE1 3.99Å; H324-Y369 AromaticContact NE2-CZ 3.8Å; H324-Y369 PolarHBondContact NE2-OH 3.47Å
325	L	94.6	Very high	94.9	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	18%	0.176	C	C	.	.			trans	-136.2	142.2	166.1	-77.2	176.9	0	0	0	109.9	L315 A318 L319 R330 Y333 W351	L315-L325 HydrophobicContact CD2-CD1 4.19Å; L315-L325 HydrophobicContact CD2-CD2 4.09Å; A318-L325 HydrophobicContact CB-CD2 4.06Å; L319-L325 HydrophobicContact CB-CD1 3.84Å; L319-L325 HydrophobicContact CB-CG 3.94Å; L319-L325 HydrophobicContact CD1-CD1 4.36Å; L319-L325 HydrophobicContact CD1-CG 4.15Å; L319-L325 HydrophobicContact CD2-CD1 4.39Å; L319-L325 HydrophobicContact CG-CD1 4.41Å; L325-R330 HydrophobicContact CB-CG 3.88Å; L325-R330 WeakPolarHBondContact O-CD 3.42Å; L325-R330 VanDerWaalsContact O-CG 3.31Å; L325-R330 WeakPolarHBondContact O-CG 3.23Å; L325-R330 PolarHBondContact O-NH1 3.44Å; L325-Y333 HydrophobicContact CD1-CD1 4.39Å; L325-W351 HydrophobicContact CB-CZ3 4.4Å; L325-W351 HydrophobicContact CD1-CH2 3.84Å; L325-W351 HydrophobicContact CD1-CZ3 3.99Å
326	R	94.1	Very high	94.7	Very high	127 Å²	127	37.8 Å²	37.8	48%	0.479	18%	0.177	S	C	.	.			trans	-66.4	165.6	170.3	-69	179.3	174	-143	-0.8	111.7	G328 G329 R330 D404	R326-G328 PolarHBondContact O-N 3.25Å; R326-G329 PolarHBondContact O-N 3Å; R326-R330 WeakPolarHBondContact O-CG 3.36Å; R326-R330 PolarHBondContact O-N 3.47Å; R326-D404 WeakPolarHBondContact CB-OD1 3.37Å; R326-D404 WeakPolarHBondContact CD-OD1 3.46Å
327	H	91.3	Very high	94.4	Very high	115 Å²	115	37.3 Å²	37.3	53%	0.532	17%	0.174	S	C	.	.	H	α-helix	trans	-51.8	-48.7	-172	179	82.3	0	0	0	113.2	G329 R330 M331	H327-G329 VanDerWaalsContact C-N 3.33Å; H327-G329 PolarHBondContact O-N 2.89Å; H327-R330 PolarHBondContact O-N 3.28Å; H327-M331 WeakPolarHBondContact O-CG 3.15Å; H327-M331 PolarHBondContact O-N 2.99Å
328	G	92.3	Very high	94.1	Very high	17 Å²	17	34.4 Å²	34.4	18%	0.175	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-42	178.2	0	0	0	0	0	113.3	R326 M331 Q332	R326-G328 PolarHBondContact O-N 3.25Å; G328-M331 PolarHBondContact O-N 3.35Å; G328-Q332 WeakPolarHBondContact O-CB 3.28Å; G328-Q332 PolarHBondContact O-N 3.08Å
329	G	95.3	Very high	93.7	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-44	175	0	0	0	0	0	113.4	R326 H327 M331 Y333	R326-G329 PolarHBondContact O-N 3Å; H327-G329 VanDerWaalsContact C-N 3.33Å; H327-G329 PolarHBondContact O-N 2.89Å; G329-M331 VanDerWaalsContact C-N 3.34Å; G329-M331 PolarHBondContact O-N 2.99Å; G329-Y333 VanDerWaalsContact O-CB 3.23Å; G329-Y333 WeakPolarHBondContact O-CB 3.1Å; G329-Y333 PolarHBondContact O-N 3.35Å
330	R	94.2	Very high	93.3	Very high	39 Å²	39	34.4 Å²	34.4	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-43.5	176.4	-64.3	-170.2	-54.2	-97.1	10.6	111.7	L325 R326 H327 G334 W351 F355	L325-R330 HydrophobicContact CB-CG 3.88Å; L325-R330 WeakPolarHBondContact O-CD 3.42Å; L325-R330 VanDerWaalsContact O-CG 3.31Å; L325-R330 WeakPolarHBondContact O-CG 3.23Å; L325-R330 PolarHBondContact O-NH1 3.44Å; R326-R330 WeakPolarHBondContact O-CG 3.36Å; R326-R330 PolarHBondContact O-N 3.47Å; H327-R330 PolarHBondContact O-N 3.28Å; R330-G334 VanDerWaalsContact O-CA 3.28Å; R330-G334 WeakPolarHBondContact O-CA 3.39Å; R330-G334 PolarHBondContact O-N 3.43Å; R330-W351 HydrophobicContact CB-CH2 4.37Å; R330-W351 HydrophobicContact CG-CH2 4.23Å; R330-W351 HydrophobicContact CG-CZ3 4.14Å; R330-F355 HydrophobicContact CG-CZ 4.38Å
331	M	92.5	Very high	92.9	Very high	16 Å²	16	33 Å²	33	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-67	-50.9	178.7	-68.8	-59.7	-64.5	0	0	111.9	H327 G328 G329 Y333 L335 M376 Y386 Y389	H327-M331 WeakPolarHBondContact O-CG 3.15Å; H327-M331 PolarHBondContact O-N 2.99Å; G328-M331 PolarHBondContact O-N 3.35Å; G329-M331 VanDerWaalsContact C-N 3.34Å; G329-M331 PolarHBondContact O-N 2.99Å; M331-Y333 PolarHBondContact O-N 3.18Å; M331-L335 HydrophobicContact CE-CD1 4.04Å; M331-L335 VanDerWaalsContact O-CB 3.31Å; M331-L335 WeakPolarHBondContact O-CB 3.38Å; M331-L335 WeakPolarHBondContact O-CD1 3.21Å; M331-L335 WeakPolarHBondContact O-CG 3.35Å; M331-L335 PolarHBondContact O-N 3.42Å; M331-L335 VanDerWaalsContact O-N 3.09Å; M331-M376 HydrophobicContact CE-CG 3.95Å; M331-M376 HydrophobicContact CE-SD 4.31Å; M331-M376 HydrophobicContact SD-CG 3.66Å; M331-M376 HydrophobicContact SD-SD 3.56Å; M331-Y386 HydrophobicContact CE-CD1 4.38Å; M331-Y389 HydrophobicContact CB-CE2 4.5Å
332	Q	95	Very high	92.5	Very high	5 Å²	5	28.3 Å²	28.3	2%	0.023	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-47	-178.3	179.2	174.1	-39.9	0	0	111.8	M312 L315 G328 F336 Y389 V394 H406 G407	M312-Q332 HydrophobicContact CE-CG 3.68Å; M312-Q332 HydrophobicContact SD-CG 4.08Å; L315-Q332 HydrophobicContact CD1-CB 4.05Å; L315-Q332 HydrophobicContact CD1-CG 3.77Å; G328-Q332 WeakPolarHBondContact O-CB 3.28Å; G328-Q332 PolarHBondContact O-N 3.08Å; Q332-F336 WeakPolarHBondContact O-CB 3.22Å; Q332-F336 PolarHBondContact O-N 2.88Å; Q332-Y389 HydrophobicContact CB-CD2 4.07Å; Q332-Y389 HydrophobicContact CB-CE2 4.27Å; Q332-Y389 HydrophobicContact CG-CD2 4.28Å; Q332-V394 HydrophobicContact CG-CG2 4.22Å; Q332-H406 HydrophobicContact CB-CB 4.44Å; Q332-G407 PolarHBondContact NE2-O 3.45Å
333	Y	96.8	Very high	92.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-76.6	-43.4	-177.9	-170.3	-127	0	0	0	112.3	F308 M312 L315 H316 L319 L325 G329 M331 L335 F336 L337 F350 W351	F308-Y333 HydrophobicContact CD2-CE2 4.25Å; F308-Y333 AromaticContact CE2-CE2 3.8Å; F308-Y333 HydrophobicContact CE2-CE2 3.8Å; M312-Y333 HydrophobicContact CB-CD2 4.43Å; M312-Y333 HydrophobicContact SD-CD2 4.43Å; L315-Y333 HydrophobicContact CB-CD2 4.05Å; L315-Y333 HydrophobicContact CB-CG 4.05Å; H316-Y333 HydrophobicContact CB-CE2 4.15Å; H316-Y333 AromaticContact ND1-CZ 3.81Å; H316-Y333 PolarHBondContact ND1-OH 3.41Å; L319-Y333 HydrophobicContact CD2-CD1 4.17Å; L319-Y333 HydrophobicContact CD2-CE1 3.85Å; L325-Y333 HydrophobicContact CD1-CD1 4.39Å; G329-Y333 VanDerWaalsContact O-CB 3.23Å; G329-Y333 WeakPolarHBondContact O-CB 3.1Å; G329-Y333 PolarHBondContact O-N 3.35Å; M331-Y333 PolarHBondContact O-N 3.18Å; Y333-L335 PolarHBondContact O-N 3.37Å; Y333-F336 HydrophobicContact CD2-CD1 4.23Å; Y333-F336 HydrophobicContact CE2-CD1 4.25Å; Y333-F336 WeakPolarHBondContact O-CB 3.22Å; Y333-F336 PolarHBondContact O-N 3.49Å; Y333-L337 HydrophobicContact CD1-CD1 3.9Å; Y333-L337 HydrophobicContact CD1-CG 4.38Å; Y333-L337 HydrophobicContact CD2-CG 4.42Å; Y333-L337 HydrophobicContact CE1-CD1 3.5Å; Y333-L337 VanDerWaalsContact CE1-CD1 3.5Å; Y333-L337 HydrophobicContact CE1-CD2 4.45Å; Y333-L337 HydrophobicContact CE1-CG 4.07Å; Y333-L337 HydrophobicContact CE2-CD1 4.43Å; Y333-L337 HydrophobicContact CE2-CD2 4.06Å; Y333-L337 HydrophobicContact CE2-CG 4.1Å; Y333-L337 WeakPolarHBondContact O-CG 3.43Å; Y333-L337 PolarHBondContact O-N 3.27Å; Y333-F350 AromaticContact CE1-CE1 3.83Å; Y333-F350 HydrophobicContact CE1-CE1 3.83Å; Y333-F350 HydrophobicContact CE1-CZ 4.03Å; Y333-W351 AromaticContact CD1-CH2 3.79Å; Y333-W351 HydrophobicContact CD1-CH2 3.79Å; Y333-W351 AromaticContact CD1-CZ2 3.92Å; Y333-W351 HydrophobicContact CD1-CZ2 3.92Å
334	G	94.1	Very high	91.8	Very high	2 Å²	2	25.3 Å²	25.3	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-43	-179.5	0	0	0	0	0	112.7	R330 L337 K338	R330-G334 VanDerWaalsContact O-CA 3.28Å; R330-G334 WeakPolarHBondContact O-CA 3.39Å; R330-G334 PolarHBondContact O-N 3.43Å; G334-L337 PolarHBondContact O-N 3.21Å; G334-K338 PolarHBondContact O-N 2.96Å
335	L	91.8	Very high	91.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.1	-34.9	175.8	-63.6	172.1	0	0	0	112.1	M331 Y333 K338 G339 M376 P388 Y389	M331-L335 HydrophobicContact CE-CD1 4.04Å; M331-L335 VanDerWaalsContact O-CB 3.31Å; M331-L335 WeakPolarHBondContact O-CB 3.38Å; M331-L335 WeakPolarHBondContact O-CD1 3.21Å; M331-L335 WeakPolarHBondContact O-CG 3.35Å; M331-L335 PolarHBondContact O-N 3.42Å; M331-L335 VanDerWaalsContact O-N 3.09Å; Y333-L335 PolarHBondContact O-N 3.37Å; L335-K338 HydrophobicContact CD2-CD 4.4Å; L335-K338 WeakPolarHBondContact O-CB 3.37Å; L335-K338 PolarHBondContact O-N 3.47Å; L335-G339 PolarHBondContact O-N 2.95Å; L335-M376 HydrophobicContact CD2-CB 3.97Å; L335-M376 HydrophobicContact CD2-CG 4.22Å; L335-M376 HydrophobicContact CD2-SD 4.49Å; L335-M376 HydrophobicContact CG-SD 4.35Å; L335-P388 WeakPolarHBondContact O-CG 3.47Å; L335-Y389 HydrophobicContact CD1-CD1 3.83Å; L335-Y389 HydrophobicContact CD1-CE1 3.42Å; L335-Y389 VanDerWaalsContact CD1-CE1 3.42Å
336	F	94.1	Very high	91.4	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-46.6	171.1	168.1	-101.3	0	0	0	111.5	F308 M312 Q332 Y333 K338 G339 I340 P468 N469 F472	F308-F336 AromaticContact CD1-CE1 3.8Å; F308-F336 HydrophobicContact CD1-CE1 3.8Å; F308-F336 AromaticContact CD1-CZ 3.78Å; F308-F336 HydrophobicContact CD1-CZ 3.78Å; F308-F336 AromaticContact CD2-CE1 3.94Å; F308-F336 HydrophobicContact CD2-CE1 3.94Å; F308-F336 AromaticContact CE1-CE1 3.69Å; F308-F336 HydrophobicContact CE1-CE1 3.69Å; F308-F336 AromaticContact CE1-CZ 3.95Å; F308-F336 HydrophobicContact CE1-CZ 3.95Å; F308-F336 AromaticContact CE2-CE1 3.86Å; F308-F336 HydrophobicContact CE2-CE1 3.86Å; F308-F336 AromaticContact CG-CE1 3.93Å; F308-F336 HydrophobicContact CG-CE1 3.93Å; F308-F336 HydrophobicContact CG-CZ 4.12Å; F308-F336 AromaticContact CZ-CE1 3.73Å; F308-F336 HydrophobicContact CZ-CE1 3.73Å; F308-F336 HydrophobicContact CZ-CZ 4.45Å; M312-F336 HydrophobicContact CB-CD1 3.96Å; M312-F336 HydrophobicContact CB-CE1 3.85Å; M312-F336 HydrophobicContact CB-CG 4.44Å; M312-F336 HydrophobicContact CB-CZ 4.25Å; M312-F336 HydrophobicContact CE-CB 4.2Å; M312-F336 HydrophobicContact CE-CG 4.4Å; M312-F336 HydrophobicContact CG-CB 4.33Å; M312-F336 HydrophobicContact CG-CD1 3.72Å; M312-F336 HydrophobicContact CG-CD2 3.87Å; M312-F336 HydrophobicContact CG-CE1 3.93Å; M312-F336 HydrophobicContact CG-CE2 4.08Å; M312-F336 HydrophobicContact CG-CG 3.69Å; M312-F336 HydrophobicContact CG-CZ 4.1Å; M312-F336 HydrophobicContact SD-CB 3.9Å; M312-F336 HydrophobicContact SD-CD1 4.19Å; M312-F336 HydrophobicContact SD-CD2 4.47Å; M312-F336 HydrophobicContact SD-CG 3.93Å; Q332-F336 WeakPolarHBondContact O-CB 3.22Å; Q332-F336 PolarHBondContact O-N 2.88Å; Y333-F336 HydrophobicContact CD2-CD1 4.23Å; Y333-F336 HydrophobicContact CE2-CD1 4.25Å; Y333-F336 WeakPolarHBondContact O-CB 3.22Å; Y333-F336 PolarHBondContact O-N 3.49Å; F336-K338 PolarHBondContact O-N 3.21Å; F336-G339 CarbonylContact O-C 3.56Å; F336-G339 WeakPolarHBondContact O-CA 3.36Å; F336-G339 PolarHBondContact O-N 3.08Å; F336-I340 HydrophobicContact CD2-CG2 4.32Å; F336-I340 HydrophobicContact CE1-CD1 4.15Å; F336-I340 HydrophobicContact CE1-CG2 4.23Å; F336-I340 HydrophobicContact CE2-CG2 3.78Å; F336-I340 HydrophobicContact CZ-CG2 3.73Å; F336-I340 PolarHBondContact O-N 3.4Å; F336-P468 HydrophobicContact CD2-CB 3.82Å; F336-P468 HydrophobicContact CE2-CB 4.09Å; F336-N469 WeakPolarHBondContact CD2-OD1 3.41Å; F336-N469 PolarHBondContact O-ND2 3.35Å; F336-F472 HydrophobicContact CE2-CB 4.14Å; F336-F472 HydrophobicContact CZ-CB 4.12Å; F336-F472 HydrophobicContact CZ-CG 4.46Å
337	L	92.8	Very high	91.3	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-43.4	177.3	-72.9	-178.8	0	0	0	112.3	I300 F308 Y333 G334 G339 I340 G341 L342 F350	I300-L337 HydrophobicContact CG2-CD2 4.48Å; F308-L337 HydrophobicContact CZ-CD2 4.21Å; Y333-L337 HydrophobicContact CD1-CD1 3.9Å; Y333-L337 HydrophobicContact CD1-CG 4.38Å; Y333-L337 HydrophobicContact CD2-CG 4.42Å; Y333-L337 HydrophobicContact CE1-CD1 3.5Å; Y333-L337 VanDerWaalsContact CE1-CD1 3.5Å; Y333-L337 HydrophobicContact CE1-CD2 4.45Å; Y333-L337 HydrophobicContact CE1-CG 4.07Å; Y333-L337 HydrophobicContact CE2-CD1 4.43Å; Y333-L337 HydrophobicContact CE2-CD2 4.06Å; Y333-L337 HydrophobicContact CE2-CG 4.1Å; Y333-L337 WeakPolarHBondContact O-CG 3.43Å; Y333-L337 PolarHBondContact O-N 3.27Å; G334-L337 PolarHBondContact O-N 3.21Å; L337-G339 VanDerWaalsContact C-N 3.32Å; L337-G339 PolarHBondContact O-N 2.75Å; L337-I340 HydrophobicContact CD2-CD1 3.81Å; L337-I340 WeakPolarHBondContact O-CG1 3.38Å; L337-I340 PolarHBondContact O-N 2.93Å; L337-G341 PolarHBondContact O-N 3.31Å; L337-L342 HydrophobicContact CB-CB 4.3Å; L337-L342 HydrophobicContact CB-CD2 3.98Å; L337-L342 HydrophobicContact CD1-CD2 4.07Å; L337-L342 WeakPolarHBondContact O-CB 3.27Å; L337-L342 PolarHBondContact O-N 3.49Å; L337-F350 HydrophobicContact CD1-CD1 4.02Å; L337-F350 HydrophobicContact CD1-CE1 3.77Å; L337-F350 HydrophobicContact CD1-CZ 4.47Å
338	K	89	Confident	91.4	Very high	28 Å²	28	22.3 Å²	22.3	12%	0.122	12%	0.123	C	C	.	.	H	α-helix	trans	-55.7	-48.5	170.2	173.9	-175.4	170.3	-167.7	0	111	G334 L335 F336 I340 G341 M376 F377 D385 Y386	G334-K338 PolarHBondContact O-N 2.96Å; L335-K338 HydrophobicContact CD2-CD 4.4Å; L335-K338 WeakPolarHBondContact O-CB 3.37Å; L335-K338 PolarHBondContact O-N 3.47Å; F336-K338 PolarHBondContact O-N 3.21Å; K338-I340 VanDerWaalsContact C-N 3.29Å; K338-I340 PolarHBondContact O-N 2.89Å; K338-G341 PolarHBondContact O-N 3.43Å; K338-M376 PolarHBondContact NZ-O 3.29Å; K338-F377 HydrophobicContact CB-CE1 3.83Å; K338-F377 HydrophobicContact CB-CE2 4.18Å; K338-F377 HydrophobicContact CB-CZ 3.61Å; K338-F377 HydrophobicContact CD-CD1 4.07Å; K338-F377 HydrophobicContact CD-CE1 4.14Å; K338-F377 HydrophobicContact CD-CG 4.29Å; K338-F377 HydrophobicContact CD-CZ 4.43Å; K338-F377 HydrophobicContact CG-CD1 4.01Å; K338-F377 HydrophobicContact CG-CE1 3.63Å; K338-F377 HydrophobicContact CG-CZ 3.96Å; K338-D385 IonicContact NZ-OD1 2.62Å; K338-D385 PolarHBondContact NZ-OD1 3.48Å; K338-Y386 PolarHBondContact NZ-O 3.07Å
339	G	87.4	Confident	91.4	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-66.6	-24.2	-178.1	0	0	0	0	0	114.6	Q289 L335 F336 L337 G341 N469	Q289-G339 PolarHBondContact OE1-O 3.43Å; L335-G339 PolarHBondContact O-N 2.95Å; F336-G339 CarbonylContact O-C 3.56Å; F336-G339 WeakPolarHBondContact O-CA 3.36Å; F336-G339 PolarHBondContact O-N 3.08Å; L337-G339 VanDerWaalsContact C-N 3.32Å; L337-G339 PolarHBondContact O-N 2.75Å; G339-G341 VanDerWaalsContact C-N 3.28Å; G339-N469 VanDerWaalsContact CA-ND2 3.34Å; G339-N469 WeakPolarHBondContact CA-ND2 3.33Å; G339-N469 PolarHBondContact O-ND2 3.47Å
340	I	89.1	Confident	91.4	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	0.6	172.5	65.7	173.6	0	0	0	112.6	V292 I295 F308 F336 L337 K338 N469 F472	V292-I340 WeakPolarHBondContact CB-O 3.44Å; V292-I340 WeakPolarHBondContact CG1-O 3.32Å; I295-I340 HydrophobicContact CD1-CB 3.74Å; I295-I340 HydrophobicContact CD1-CD1 3.66Å; I295-I340 HydrophobicContact CD1-CG1 3.7Å; I295-I340 WeakPolarHBondContact CD1-O 3.45Å; F308-I340 HydrophobicContact CE1-CD1 3.91Å; F308-I340 HydrophobicContact CZ-CD1 3.96Å; F336-I340 HydrophobicContact CD2-CG2 4.32Å; F336-I340 HydrophobicContact CE1-CD1 4.15Å; F336-I340 HydrophobicContact CE1-CG2 4.23Å; F336-I340 HydrophobicContact CE2-CG2 3.78Å; F336-I340 HydrophobicContact CZ-CG2 3.73Å; F336-I340 PolarHBondContact O-N 3.4Å; L337-I340 HydrophobicContact CD2-CD1 3.81Å; L337-I340 WeakPolarHBondContact O-CG1 3.38Å; L337-I340 PolarHBondContact O-N 2.93Å; K338-I340 VanDerWaalsContact C-N 3.29Å; K338-I340 PolarHBondContact O-N 2.89Å; I340-N469 VanDerWaalsContact CG2-ND2 3.27Å; I340-N469 WeakPolarHBondContact CG2-ND2 3.19Å; I340-N469 PolarHBondContact N-ND2 3.42Å; I340-N469 VanDerWaalsContact N-ND2 3.18Å; I340-F472 HydrophobicContact CB-CD1 3.84Å; I340-F472 HydrophobicContact CB-CE1 3.78Å; I340-F472 HydrophobicContact CB-CG 4.43Å; I340-F472 HydrophobicContact CB-CZ 4.33Å; I340-F472 HydrophobicContact CG2-CB 4.04Å; I340-F472 HydrophobicContact CG2-CD1 3.36Å; I340-F472 HydrophobicContact CG2-CD2 4.25Å; I340-F472 HydrophobicContact CG2-CE1 3.85Å; I340-F472 HydrophobicContact CG2-CG 3.6Å; I340-F472 HydrophobicContact CG2-CZ 4.46Å
341	G	86.2	Confident	91.4	Very high	25 Å²	25	24.9 Å²	24.9	26%	0.258	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	106.1	13.1	172.1	0	0	0	0	0	115.7	L337 K338 G339 S343	L337-G341 PolarHBondContact O-N 3.31Å; K338-G341 PolarHBondContact O-N 3.43Å; G339-G341 VanDerWaalsContact C-N 3.28Å; G341-S343 PolarHBondContact O-N 3.17Å
342	L	88.3	Confident	91.5	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.026	14%	0.143	C	C	.	.			trans	-69	128.2	174.9	-161.7	68.4	0	0	0	110.4	L297 I300 L337 Q346 A347 F377	L297-L342 HydrophobicContact CD2-CD1 3.94Å; I300-L342 HydrophobicContact CD1-CD1 4.07Å; I300-L342 HydrophobicContact CD1-CD2 4.31Å; L337-L342 HydrophobicContact CB-CB 4.3Å; L337-L342 HydrophobicContact CB-CD2 3.98Å; L337-L342 HydrophobicContact CD1-CD2 4.07Å; L337-L342 WeakPolarHBondContact O-CB 3.27Å; L337-L342 PolarHBondContact O-N 3.49Å; L342-Q346 HydrophobicContact CD1-CB 3.63Å; L342-Q346 HydrophobicContact CD1-CG 4.42Å; L342-Q346 HydrophobicContact CG-CB 3.86Å; L342-A347 HydrophobicContact CD2-CB 4.03Å; L342-A347 HydrophobicContact CG-CB 4.5Å; L342-F377 VanDerWaalsContact O-CE1 3.25Å; L342-F377 WeakPolarHBondContact O-CE1 3.02Å
343	S	88	Confident	91.4	Very high	46 Å²	46	32.5 Å²	32.5	32%	0.322	16%	0.164	S	C	.	.			trans	-72.2	161.9	177.8	85.9	0	0	0	0	111.8	G341 E345 Q346 A347	G341-S343 PolarHBondContact O-N 3.17Å; S343-E345 VanDerWaalsContact C-N 3.3Å; S343-E345 PolarHBondContact O-N 3.18Å; S343-E345 PolarHBondContact OG-N 2.94Å; S343-Q346 PolarHBondContact O-N 3.18Å; S343-Q346 WeakPolarHBondContact OG-CG 3.37Å; S343-Q346 PolarHBondContact OG-N 3.29Å; S343-Q346 VanDerWaalsContact OG-N 3.11Å; S343-Q346 PolarHBondContact OG-OE1 3.44Å; S343-A347 WeakPolarHBondContact O-CB 3.46Å; S343-A347 PolarHBondContact O-N 3.4Å
344	L	87.8	Confident	91.2	Very high	38 Å²	38	32.6 Å²	32.6	20%	0.199	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-42.4	175	172.3	58.9	0	0	0	111.8	A347 L348 I373 R374 F377 K379	L344-A347 PolarHBondContact O-N 3.3Å; L344-L348 HydrophobicContact CD1-CD1 4.09Å; L344-L348 HydrophobicContact CD1-CG 4.09Å; L344-L348 HydrophobicContact CG-CD1 4.2Å; L344-L348 WeakPolarHBondContact O-CG 3.46Å; L344-L348 PolarHBondContact O-N 3.18Å; L344-I373 HydrophobicContact CD1-CG2 4.06Å; L344-R374 HydrophobicContact CD1-CG 4.15Å; L344-R374 HydrophobicContact CD2-CG 4.32Å; L344-F377 HydrophobicContact CB-CB 4.37Å; L344-F377 HydrophobicContact CB-CD1 3.95Å; L344-F377 HydrophobicContact CB-CE1 4.38Å; L344-F377 HydrophobicContact CB-CG 4.09Å; L344-F377 HydrophobicContact CD1-CB 4.01Å; L344-F377 HydrophobicContact CD1-CD2 3.91Å; L344-F377 HydrophobicContact CD1-CG 3.93Å; L344-F377 HydrophobicContact CD2-CB 4.47Å; L344-K379 HydrophobicContact CD2-CB 4.2Å; L344-K379 HydrophobicContact CD2-CG 3.84Å
345	E	89.3	Confident	91.2	Very high	160 Å²	160	32.6 Å²	32.6	75%	0.748	16%	0.164	S	C	*	.	H	α-helix	trans	-62.5	-46.7	179	-67.1	170.9	-172.8	0	0	110.9	S343 A347 L348 Q349	S343-E345 VanDerWaalsContact C-N 3.3Å; S343-E345 PolarHBondContact O-N 3.18Å; S343-E345 PolarHBondContact OG-N 2.94Å; E345-A347 PolarHBondContact O-N 3.49Å; E345-L348 PolarHBondContact O-N 2.74Å; E345-Q349 WeakPolarHBondContact O-CB 3.36Å; E345-Q349 PolarHBondContact O-N 2.91Å
346	Q	90.8	Very high	91.3	Very high	43 Å²	43	36.1 Å²	36.1	20%	0.201	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-41.4	175.8	-70.7	174.8	-53.5	0	0	111.4	I295 L297 L342 S343 Q349 F350	I295-Q346 PolarHBondContact O-NE2 2.94Å; L297-Q346 HydrophobicContact CD1-CB 4.4Å; L297-Q346 HydrophobicContact CD2-CB 4Å; L297-Q346 WeakPolarHBondContact CD2-O 3.42Å; L297-Q346 HydrophobicContact CG-CB 4.16Å; L297-Q346 HydrophobicContact CG-CG 4.32Å; L342-Q346 HydrophobicContact CD1-CB 3.63Å; L342-Q346 HydrophobicContact CD1-CG 4.42Å; L342-Q346 HydrophobicContact CG-CB 3.86Å; S343-Q346 PolarHBondContact O-N 3.18Å; S343-Q346 WeakPolarHBondContact OG-CG 3.37Å; S343-Q346 PolarHBondContact OG-N 3.29Å; S343-Q346 VanDerWaalsContact OG-N 3.11Å; S343-Q346 PolarHBondContact OG-OE1 3.44Å; Q346-Q349 PolarHBondContact O-N 3.27Å; Q346-F350 VanDerWaalsContact O-CB 3.25Å; Q346-F350 WeakPolarHBondContact O-CB 3.48Å; Q346-F350 PolarHBondContact O-N 3.29Å
347	A	91.6	Very high	91.1	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-47.4	177.3	0	0	0	0	0	111.3	L342 S343 L344 E345 Q349 F350 W351 I373 F377	L342-A347 HydrophobicContact CD2-CB 4.03Å; L342-A347 HydrophobicContact CG-CB 4.5Å; S343-A347 WeakPolarHBondContact O-CB 3.46Å; S343-A347 PolarHBondContact O-N 3.4Å; L344-A347 PolarHBondContact O-N 3.3Å; E345-A347 PolarHBondContact O-N 3.49Å; A347-Q349 VanDerWaalsContact C-N 3.31Å; A347-Q349 PolarHBondContact O-N 3.42Å; A347-F350 PolarHBondContact O-N 3.11Å; A347-W351 PolarHBondContact O-N 2.99Å; A347-I373 HydrophobicContact CB-CG2 4.23Å; A347-F377 HydrophobicContact CB-CE2 3.72Å; A347-F377 HydrophobicContact CB-CZ 3.75Å
348	L	92.6	Very high	91	Very high	32 Å²	32	44.8 Å²	44.8	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-57.9	-45.6	175.8	-75.2	169.7	0	0	0	111.1	L344 E345 R352 A370 I373 R374	L344-L348 HydrophobicContact CD1-CD1 4.09Å; L344-L348 HydrophobicContact CD1-CG 4.09Å; L344-L348 HydrophobicContact CG-CD1 4.2Å; L344-L348 WeakPolarHBondContact O-CG 3.46Å; L344-L348 PolarHBondContact O-N 3.18Å; E345-L348 PolarHBondContact O-N 2.74Å; L348-R352 WeakPolarHBondContact O-CB 3.4Å; L348-R352 PolarHBondContact O-N 3.44Å; L348-A370 HydrophobicContact CD2-CB 3.91Å; L348-I373 HydrophobicContact CD2-CB 3.97Å; L348-I373 HydrophobicContact CD2-CD1 4.21Å; L348-I373 HydrophobicContact CD2-CG2 3.87Å; L348-I373 HydrophobicContact CG-CG2 4.16Å; L348-R374 HydrophobicContact CD1-CG 4.48Å
349	Q	93.4	Very high	90.8	Very high	100 Å²	100	53.6 Å²	53.6	47%	0.467	26%	0.262	S	S	.	.	H	α-helix	trans	-61.9	-47	176.4	-176.8	178.5	-2.6	0	0	111.9	L297 E345 Q346 A347 R352 M353	L297-Q349 HydrophobicContact CD1-CB 4.08Å; L297-Q349 VanDerWaalsContact CD1-CD 3.48Å; L297-Q349 HydrophobicContact CD1-CG 3.86Å; E345-Q349 WeakPolarHBondContact O-CB 3.36Å; E345-Q349 PolarHBondContact O-N 2.91Å; Q346-Q349 PolarHBondContact O-N 3.27Å; A347-Q349 VanDerWaalsContact C-N 3.31Å; A347-Q349 PolarHBondContact O-N 3.42Å; Q349-R352 PolarHBondContact O-N 2.97Å; Q349-M353 HydrophobicContact CG-CG 4.24Å; Q349-M353 HydrophobicContact CG-SD 3.68Å; Q349-M353 VanDerWaalsContact O-CB 3.31Å; Q349-M353 WeakPolarHBondContact O-CB 3.38Å; Q349-M353 VanDerWaalsContact O-CG 3.23Å; Q349-M353 WeakPolarHBondContact O-CG 3.39Å; Q349-M353 PolarHBondContact O-N 2.88Å
350	F	94.3	Very high	90.9	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.035	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-54.4	179.6	176.9	-105.6	0	0	0	112	L297 I300 L319 Y333 L337 Q346 A347 E354	L297-F350 HydrophobicContact CD2-CB 3.71Å; L297-F350 HydrophobicContact CD2-CD2 4.24Å; L297-F350 HydrophobicContact CD2-CG 4.35Å; I300-F350 HydrophobicContact CD1-CD2 3.93Å; I300-F350 HydrophobicContact CD1-CE2 4.08Å; I300-F350 HydrophobicContact CD1-CG 4.49Å; I300-F350 HydrophobicContact CG2-CE2 4.28Å; L319-F350 HydrophobicContact CD2-CE1 3.48Å; L319-F350 VanDerWaalsContact CD2-CE1 3.48Å; L319-F350 HydrophobicContact CD2-CZ 3.63Å; Y333-F350 AromaticContact CE1-CE1 3.83Å; Y333-F350 HydrophobicContact CE1-CE1 3.83Å; Y333-F350 HydrophobicContact CE1-CZ 4.03Å; L337-F350 HydrophobicContact CD1-CD1 4.02Å; L337-F350 HydrophobicContact CD1-CE1 3.77Å; L337-F350 HydrophobicContact CD1-CZ 4.47Å; Q346-F350 VanDerWaalsContact O-CB 3.25Å; Q346-F350 WeakPolarHBondContact O-CB 3.48Å; Q346-F350 PolarHBondContact O-N 3.29Å; A347-F350 PolarHBondContact O-N 3.11Å; F350-E354 PolarHBondContact O-N 3.42Å
351	W	94.8	Very high	90.9	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-39.1	-178.8	-70.2	110.3	0	0	0	111.8	L319 L325 R330 Y333 A347 E354 F355 F365 I373	L319-W351 HydrophobicContact CD1-CE3 4.2Å; L319-W351 HydrophobicContact CD1-CZ3 3.84Å; L319-W351 HydrophobicContact CD2-CE3 4.14Å; L319-W351 HydrophobicContact CD2-CH2 4.14Å; L319-W351 HydrophobicContact CD2-CZ3 3.72Å; L319-W351 HydrophobicContact CG-CZ3 4.42Å; L325-W351 HydrophobicContact CB-CZ3 4.4Å; L325-W351 HydrophobicContact CD1-CH2 3.84Å; L325-W351 HydrophobicContact CD1-CZ3 3.99Å; R330-W351 HydrophobicContact CB-CH2 4.37Å; R330-W351 HydrophobicContact CG-CH2 4.23Å; R330-W351 HydrophobicContact CG-CZ3 4.14Å; Y333-W351 AromaticContact CD1-CH2 3.79Å; Y333-W351 HydrophobicContact CD1-CH2 3.79Å; Y333-W351 AromaticContact CD1-CZ2 3.92Å; Y333-W351 HydrophobicContact CD1-CZ2 3.92Å; A347-W351 PolarHBondContact O-N 2.99Å; W351-E354 PolarHBondContact O-N 3Å; W351-F355 HydrophobicContact CE3-CD1 4.42Å; W351-F355 AromaticContact CE3-CE1 3.65Å; W351-F355 HydrophobicContact CE3-CE1 3.65Å; W351-F355 AromaticContact CE3-CZ 3.76Å; W351-F355 HydrophobicContact CE3-CZ 3.76Å; W351-F355 AromaticContact CZ3-CE1 3.93Å; W351-F355 HydrophobicContact CZ3-CE1 3.93Å; W351-F355 AromaticContact CZ3-CZ 3.99Å; W351-F355 HydrophobicContact CZ3-CZ 3.99Å; W351-F355 WeakPolarHBondContact O-CB 3.48Å; W351-F355 WeakPolarHBondContact O-CG 3.5Å; W351-F355 PolarHBondContact O-N 2.87Å; W351-F365 HydrophobicContact CB-CE2 3.8Å; W351-F365 HydrophobicContact CB-CZ 3.87Å; W351-I373 HydrophobicContact CB-CD1 3.63Å; W351-I373 HydrophobicContact CG-CD1 3.73Å
352	R	93.7	Very high	91.1	Very high	86 Å²	86	58.6 Å²	58.6	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-50.6	177.7	-174.3	177.4	-173.8	134.2	6	111.3	L348 Q349 E354 F355 I356 F365 D366	L348-R352 WeakPolarHBondContact O-CB 3.4Å; L348-R352 PolarHBondContact O-N 3.44Å; Q349-R352 PolarHBondContact O-N 2.97Å; R352-E354 PolarHBondContact O-N 2.97Å; R352-F355 PolarHBondContact O-N 2.76Å; R352-I356 HydrophobicContact CG-CD1 3.46Å; R352-I356 VanDerWaalsContact CG-CD1 3.46Å; R352-I356 HydrophobicContact CG-CG1 4.34Å; R352-I356 WeakPolarHBondContact O-CB 3.23Å; R352-I356 WeakPolarHBondContact O-CD1 3.46Å; R352-I356 WeakPolarHBondContact O-CG1 3.45Å; R352-I356 PolarHBondContact O-N 3.44Å; R352-I356 VanDerWaalsContact O-N 3.1Å; R352-F365 HydrophobicContact CB-CD1 3.87Å; R352-F365 HydrophobicContact CB-CD2 4.47Å; R352-F365 HydrophobicContact CB-CE1 3.57Å; R352-F365 HydrophobicContact CB-CE2 4.2Å; R352-F365 HydrophobicContact CB-CG 4.31Å; R352-F365 HydrophobicContact CB-CZ 3.74Å; R352-F365 HydrophobicContact CG-CD1 3.83Å; R352-F365 HydrophobicContact CG-CE1 4.04Å; R352-F365 HydrophobicContact CG-CG 4.22Å; R352-D366 IonicContact CZ-OD1 3.18Å; R352-D366 IonicContact CZ-OD2 3.25Å; R352-D366 VanDerWaalsContact CZ-OD2 3.25Å; R352-D366 IonicContact NH1-OD1 3.07Å; R352-D366 PolarHBondContact NH1-OD1 3.11Å; R352-D366 IonicContact NH1-OD2 2.79Å; R352-D366 PolarHBondContact NH1-OD2 2.98Å; R352-D366 IonicContact NH2-OD2 2.97Å; R352-D366 PolarHBondContact NH2-OD2 3.46Å
353	M	92.8	Very high	91	Very high	96 Å²	96	63.7 Å²	63.7	47%	0.473	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-37.3	180	-76.4	178.1	64.4	0	0	111.9	Q349 R357	Q349-M353 HydrophobicContact CG-CG 4.24Å; Q349-M353 HydrophobicContact CG-SD 3.68Å; Q349-M353 VanDerWaalsContact O-CB 3.31Å; Q349-M353 WeakPolarHBondContact O-CB 3.38Å; Q349-M353 VanDerWaalsContact O-CG 3.23Å; Q349-M353 WeakPolarHBondContact O-CG 3.39Å; Q349-M353 PolarHBondContact O-N 2.88Å; M353-R357 WeakPolarHBondContact O-CG 3.4Å
354	E	94.3	Very high	91.1	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-78.6	-45.1	-179.4	-162.5	59.2	-149.4	0	0	112.5	L319 R320 H323 F350 W351 R352 I356 R357	L319-E354 HydrophobicContact CD1-CB 4.35Å; L319-E354 HydrophobicContact CD1-CG 3.68Å; L319-E354 HydrophobicContact CD2-CG 4.48Å; L319-E354 HydrophobicContact CG-CG 3.78Å; R320-E354 WeakPolarHBondContact CA-OE1 3.4Å; R320-E354 IonicContact CZ-OE2 2.9Å; R320-E354 IonicContact NH1-OE2 2.68Å; R320-E354 PolarHBondContact NH1-OE2 3.19Å; H323-E354 WeakPolarHBondContact CB-O 3.44Å; H323-E354 IonicContact CE1-OE1 3.54Å; H323-E354 IonicContact CG-OE1 2.7Å; H323-E354 IonicContact ND1-OE1 3.19Å; H323-E354 PolarHBondContact ND1-OE1 2.88Å; F350-E354 PolarHBondContact O-N 3.42Å; W351-E354 PolarHBondContact O-N 3Å; R352-E354 PolarHBondContact O-N 2.97Å; E354-I356 VanDerWaalsContact C-N 3.31Å; E354-I356 PolarHBondContact O-N 3.07Å; E354-R357 WeakPolarHBondContact O-CB 3.48Å; E354-R357 PolarHBondContact O-N 3.39Å
355	F	93.9	Very high	91.3	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.009	31%	0.313	C	S	.	.	H	α-helix	trans	-67.7	-31.9	-176.9	-79.5	15.3	0	0	0	113	L319 H323 H324 R330 W351 R352 R357 G358 V360 F365 Y369	L319-F355 HydrophobicContact CD1-CD1 4.14Å; L319-F355 HydrophobicContact CD1-CE1 3.62Å; H323-F355 WeakPolarHBondContact O-CA 3.31Å; H323-F355 WeakPolarHBondContact O-CD1 3.42Å; H324-F355 AromaticContact CD2-CE2 3.96Å; H324-F355 AromaticContact CD2-CZ 3.97Å; R330-F355 HydrophobicContact CG-CZ 4.38Å; W351-F355 HydrophobicContact CE3-CD1 4.42Å; W351-F355 AromaticContact CE3-CE1 3.65Å; W351-F355 HydrophobicContact CE3-CE1 3.65Å; W351-F355 AromaticContact CE3-CZ 3.76Å; W351-F355 HydrophobicContact CE3-CZ 3.76Å; W351-F355 AromaticContact CZ3-CE1 3.93Å; W351-F355 HydrophobicContact CZ3-CE1 3.93Å; W351-F355 AromaticContact CZ3-CZ 3.99Å; W351-F355 HydrophobicContact CZ3-CZ 3.99Å; W351-F355 WeakPolarHBondContact O-CB 3.48Å; W351-F355 WeakPolarHBondContact O-CG 3.5Å; W351-F355 PolarHBondContact O-N 2.87Å; R352-F355 PolarHBondContact O-N 2.76Å; F355-R357 VanDerWaalsContact C-N 3.28Å; F355-R357 PolarHBondContact O-N 2.75Å; F355-G358 WeakPolarHBondContact O-CA 3.39Å; F355-G358 PolarHBondContact O-N 2.96Å; F355-V360 HydrophobicContact CB-CB 4.08Å; F355-V360 HydrophobicContact CB-CG1 4.42Å; F355-V360 HydrophobicContact CB-CG2 4.34Å; F355-V360 HydrophobicContact CD2-CG2 4.5Å; F355-V360 PolarHBondContact O-N 2.98Å; F355-F365 HydrophobicContact CB-CD2 4.13Å; F355-F365 AromaticContact CD2-CD2 3.96Å; F355-F365 HydrophobicContact CD2-CD2 3.96Å; F355-F365 HydrophobicContact CD2-CE2 4.11Å; F355-F365 HydrophobicContact CG-CD2 4.41Å; F355-Y369 HydrophobicContact CD2-CD1 4.23Å; F355-Y369 HydrophobicContact CD2-CD2 4.41Å; F355-Y369 HydrophobicContact CD2-CE1 4.35Å; F355-Y369 HydrophobicContact CD2-CG 4.23Å; F355-Y369 AromaticContact CE2-CD1 3.62Å; F355-Y369 HydrophobicContact CE2-CD1 3.62Å; F355-Y369 AromaticContact CE2-CE1 3.69Å; F355-Y369 HydrophobicContact CE2-CE1 3.69Å; F355-Y369 HydrophobicContact CE2-CG 4.07Å
356	I	92.4	Very high	91.3	Very high	74 Å²	74	60.4 Å²	60.4	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-70.8	-23	176.8	-65.1	172.2	0	0	0	112.4	R352 E354 G358 V360 A362	R352-I356 HydrophobicContact CG-CD1 3.46Å; R352-I356 VanDerWaalsContact CG-CD1 3.46Å; R352-I356 HydrophobicContact CG-CG1 4.34Å; R352-I356 WeakPolarHBondContact O-CB 3.23Å; R352-I356 WeakPolarHBondContact O-CD1 3.46Å; R352-I356 WeakPolarHBondContact O-CG1 3.45Å; R352-I356 PolarHBondContact O-N 3.44Å; R352-I356 VanDerWaalsContact O-N 3.1Å; E354-I356 VanDerWaalsContact C-N 3.31Å; E354-I356 PolarHBondContact O-N 3.07Å; I356-G358 PolarHBondContact O-N 3.48Å; I356-V360 WeakPolarHBondContact CA-O 3.23Å; I356-A362 HydrophobicContact CD1-CB 3.92Å
357	R	91.4	Very high	91.1	Very high	156 Å²	156	66.8 Å²	66.8	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-68.9	-23.4	169.3	-67.9	172.7	177.2	-162.2	-3.4	112.2	H323 M353 E354 F355	H323-R357 HydrophobicContact CB-CB 4.4Å; M353-R357 WeakPolarHBondContact O-CG 3.4Å; E354-R357 WeakPolarHBondContact O-CB 3.48Å; E354-R357 PolarHBondContact O-N 3.39Å; F355-R357 VanDerWaalsContact C-N 3.28Å; F355-R357 PolarHBondContact O-N 2.75Å
358	G	89.2	Confident	90.8	Very high	30 Å²	30	69.4 Å²	69.4	31%	0.309	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-142.6	175.9	0	0	0	0	0	112.5	H323 F355 I356	H323-G358 VanDerWaalsContact CB-CA 3.5Å; F355-G358 WeakPolarHBondContact O-CA 3.39Å; F355-G358 PolarHBondContact O-N 2.96Å; I356-G358 PolarHBondContact O-N 3.48Å
359	K	86.3	Confident	90.5	Very high	214 Å²	214	69.5 Å²	69.5	93%	0.93	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	8.8	-177.8	-59.9	-177.4	-179.2	179.5	0	113.6
360	V	88.7	Confident	90.2	Very high	13 Å²	13	64.7 Å²	64.7	8%	0.079	32%	0.318	C	S	.	.			trans	-99.2	117.3	-176.5	-177.3	0	0	0	0	108.6	F355 I356 K364 F365 Y369	F355-V360 HydrophobicContact CB-CB 4.08Å; F355-V360 HydrophobicContact CB-CG1 4.42Å; F355-V360 HydrophobicContact CB-CG2 4.34Å; F355-V360 HydrophobicContact CD2-CG2 4.5Å; F355-V360 PolarHBondContact O-N 2.98Å; I356-V360 WeakPolarHBondContact CA-O 3.23Å; V360-K364 HydrophobicContact CG1-CB 4.3Å; V360-K364 HydrophobicContact CG1-CG 4.33Å; V360-F365 HydrophobicContact CG1-CB 4.2Å; V360-Y369 HydrophobicContact CG1-CD2 4.37Å; V360-Y369 HydrophobicContact CG1-CE2 4.08Å
361	D	89.8	Confident	89.8	Confident	89 Å²	89	70.4 Å²	70.4	48%	0.476	34%	0.341	S	S	.	.			trans	-72.5	164.2	173.2	66.1	63.1	0	0	0	112.1	D363 K364 F365	D361-D363 VanDerWaalsContact C-N 3.33Å; D361-D363 PolarHBondContact O-N 2.96Å; D361-D363 PolarHBondContact OD1-N 3.06Å; D361-D363 VanDerWaalsContact OD1-N 3.12Å; D361-K364 PolarHBondContact O-N 3.45Å; D361-K364 WeakPolarHBondContact OD1-CA 3.27Å; D361-K364 WeakPolarHBondContact OD1-CB 2.95Å; D361-K364 PolarHBondContact OD1-N 2.93Å; D361-F365 PolarHBondContact O-N 2.88Å
362	A	88.9	Confident	89.3	Confident	33 Å²	33	71.6 Å²	71.6	27%	0.273	35%	0.349	S	S	.	.	H	α-helix	trans	-62.1	-37.9	-176	0	0	0	0	0	113.2	I356 F365 D366	I356-A362 HydrophobicContact CD1-CB 3.92Å; A362-F365 WeakPolarHBondContact O-CB 3.41Å; A362-F365 PolarHBondContact O-N 3.47Å; A362-D366 PolarHBondContact O-N 3.41Å; A362-D366 VanDerWaalsContact O-N 3.11Å
363	D	88.1	Confident	88.9	Confident	112 Å²	112	67.9 Å²	67.9	60%	0.599	34%	0.336	S	S	*	.	H	α-helix	trans	-73.9	-38.8	-177.3	-69.8	-17.4	0	0	0	111.4	D361 F365 D366 K367	D361-D363 VanDerWaalsContact C-N 3.33Å; D361-D363 PolarHBondContact O-N 2.96Å; D361-D363 PolarHBondContact OD1-N 3.06Å; D361-D363 VanDerWaalsContact OD1-N 3.12Å; D363-F365 VanDerWaalsContact C-N 3.32Å; D363-D366 PolarHBondContact O-N 3.37Å; D363-K367 WeakPolarHBondContact O-CB 3.28Å; D363-K367 WeakPolarHBondContact O-CG 3.28Å; D363-K367 PolarHBondContact O-N 3.48Å
364	K	88.9	Confident	88.6	Confident	111 Å²	111	67 Å²	67	48%	0.483	33%	0.327	S	S	.	.	H	α-helix	trans	-65.5	-37	173.4	-173.4	173.6	-174	173.4	0	110.7	V360 D361 A368	V360-K364 HydrophobicContact CG1-CB 4.3Å; V360-K364 HydrophobicContact CG1-CG 4.33Å; D361-K364 PolarHBondContact O-N 3.45Å; D361-K364 WeakPolarHBondContact OD1-CA 3.27Å; D361-K364 WeakPolarHBondContact OD1-CB 2.95Å; D361-K364 PolarHBondContact OD1-N 2.93Å; K364-A368 VanDerWaalsContact O-CB 3.28Å; K364-A368 WeakPolarHBondContact O-CB 3.48Å; K364-A368 PolarHBondContact O-N 3.07Å
365	F	92.1	Very high	87.9	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.009	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-52.1	171.2	-178.8	-89.8	0	0	0	111.5	W351 R352 F355 V360 D361 A362 D363 K367 Y369 A370 I373	W351-F365 HydrophobicContact CB-CE2 3.8Å; W351-F365 HydrophobicContact CB-CZ 3.87Å; R352-F365 HydrophobicContact CB-CD1 3.87Å; R352-F365 HydrophobicContact CB-CD2 4.47Å; R352-F365 HydrophobicContact CB-CE1 3.57Å; R352-F365 HydrophobicContact CB-CE2 4.2Å; R352-F365 HydrophobicContact CB-CG 4.31Å; R352-F365 HydrophobicContact CB-CZ 3.74Å; R352-F365 HydrophobicContact CG-CD1 3.83Å; R352-F365 HydrophobicContact CG-CE1 4.04Å; R352-F365 HydrophobicContact CG-CG 4.22Å; F355-F365 HydrophobicContact CB-CD2 4.13Å; F355-F365 AromaticContact CD2-CD2 3.96Å; F355-F365 HydrophobicContact CD2-CD2 3.96Å; F355-F365 HydrophobicContact CD2-CE2 4.11Å; F355-F365 HydrophobicContact CG-CD2 4.41Å; V360-F365 HydrophobicContact CG1-CB 4.2Å; D361-F365 PolarHBondContact O-N 2.88Å; A362-F365 WeakPolarHBondContact O-CB 3.41Å; A362-F365 PolarHBondContact O-N 3.47Å; D363-F365 VanDerWaalsContact C-N 3.32Å; F365-K367 VanDerWaalsContact C-N 3.31Å; F365-K367 PolarHBondContact O-N 3.23Å; F365-Y369 HydrophobicContact CD2-CD2 4.49Å; F365-Y369 HydrophobicContact CD2-CG 4.44Å; F365-Y369 WeakPolarHBondContact O-CA 3.2Å; F365-Y369 WeakPolarHBondContact O-CB 3.31Å; F365-Y369 PolarHBondContact O-N 2.94Å; F365-A370 HydrophobicContact CE1-CB 4.23Å; F365-A370 PolarHBondContact O-N 2.94Å; F365-I373 HydrophobicContact CE2-CD1 4.19Å; F365-I373 HydrophobicContact CZ-CD1 3.71Å
366	D	88.8	Confident	87.3	Confident	61 Å²	61	69.1 Å²	69.1	33%	0.326	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-35.4	-176.2	-74.7	-32.6	0	0	0	112.4	R352 A362 D363 A370	R352-D366 IonicContact CZ-OD1 3.18Å; R352-D366 IonicContact CZ-OD2 3.25Å; R352-D366 VanDerWaalsContact CZ-OD2 3.25Å; R352-D366 IonicContact NH1-OD1 3.07Å; R352-D366 PolarHBondContact NH1-OD1 3.11Å; R352-D366 IonicContact NH1-OD2 2.79Å; R352-D366 PolarHBondContact NH1-OD2 2.98Å; R352-D366 IonicContact NH2-OD2 2.97Å; R352-D366 PolarHBondContact NH2-OD2 3.46Å; A362-D366 PolarHBondContact O-N 3.41Å; A362-D366 VanDerWaalsContact O-N 3.11Å; D363-D366 PolarHBondContact O-N 3.37Å; D366-A370 WeakPolarHBondContact O-CB 3.41Å
367	K	87.1	Confident	86.7	Confident	177 Å²	177	67.1 Å²	67.1	77%	0.77	33%	0.326	S	S	*	.	H	α-helix	trans	-78.9	-46.8	178.1	-69.9	174.9	-177.8	175.2	0	113.7	D363 F365	D363-K367 WeakPolarHBondContact O-CB 3.28Å; D363-K367 WeakPolarHBondContact O-CG 3.28Å; D363-K367 PolarHBondContact O-N 3.48Å; F365-K367 VanDerWaalsContact C-N 3.31Å; F365-K367 PolarHBondContact O-N 3.23Å
368	A	84.4	Confident	85.8	Confident	58 Å²	58	60.5 Å²	60.5	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-98.3	-23.9	-168	0	0	0	0	0	114.4	K364	K364-A368 VanDerWaalsContact O-CB 3.28Å; K364-A368 WeakPolarHBondContact O-CB 3.48Å; K364-A368 PolarHBondContact O-N 3.07Å
369	Y	88.1	Confident	84.5	Confident	33 Å²	33	66.8 Å²	66.8	13%	0.129	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-36.5	-170.2	-64	-84.4	0	0	0	113.6	H324 F355 V360 F365 Y371 S372 I373	H324-Y369 AromaticContact NE2-CE1 3.99Å; H324-Y369 AromaticContact NE2-CZ 3.8Å; H324-Y369 PolarHBondContact NE2-OH 3.47Å; F355-Y369 HydrophobicContact CD2-CD1 4.23Å; F355-Y369 HydrophobicContact CD2-CD2 4.41Å; F355-Y369 HydrophobicContact CD2-CE1 4.35Å; F355-Y369 HydrophobicContact CD2-CG 4.23Å; F355-Y369 AromaticContact CE2-CD1 3.62Å; F355-Y369 HydrophobicContact CE2-CD1 3.62Å; F355-Y369 AromaticContact CE2-CE1 3.69Å; F355-Y369 HydrophobicContact CE2-CE1 3.69Å; F355-Y369 HydrophobicContact CE2-CG 4.07Å; V360-Y369 HydrophobicContact CG1-CD2 4.37Å; V360-Y369 HydrophobicContact CG1-CE2 4.08Å; F365-Y369 HydrophobicContact CD2-CD2 4.49Å; F365-Y369 HydrophobicContact CD2-CG 4.44Å; F365-Y369 WeakPolarHBondContact O-CA 3.2Å; F365-Y369 WeakPolarHBondContact O-CB 3.31Å; F365-Y369 PolarHBondContact O-N 2.94Å; Y369-Y371 VanDerWaalsContact C-N 3.29Å; Y369-Y371 PolarHBondContact O-N 3.38Å; Y369-S372 PolarHBondContact O-N 3.04Å; Y369-S372 VanDerWaalsContact O-N 3.17Å; Y369-I373 WeakPolarHBondContact O-CG1 3.16Å; Y369-I373 PolarHBondContact O-N 2.72Å
370	A	87.3	Confident	83	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-39.7	-178.6	0	0	0	0	0	112.3	L348 F365 D366 I373 R374	L348-A370 HydrophobicContact CD2-CB 3.91Å; F365-A370 HydrophobicContact CE1-CB 4.23Å; F365-A370 PolarHBondContact O-N 2.94Å; D366-A370 WeakPolarHBondContact O-CB 3.41Å; A370-I373 PolarHBondContact O-N 3.26Å; A370-R374 WeakPolarHBondContact O-CG 3.23Å; A370-R374 PolarHBondContact O-N 2.62Å
371	Y	84.4	Confident	81.3	Confident	128 Å²	128	61.3 Å²	61.3	50%	0.502	32%	0.316	S	S	.	.	H	α-helix	trans	-57.9	-50.7	173.8	178.6	-97.7	0	0	0	111.9	Y369 I373 R374 H375 E380	Y369-Y371 VanDerWaalsContact C-N 3.29Å; Y369-Y371 PolarHBondContact O-N 3.38Å; Y371-I373 VanDerWaalsContact C-N 3.25Å; Y371-I373 PolarHBondContact O-N 2.84Å; Y371-R374 PolarHBondContact O-N 3.03Å; Y371-H375 WeakPolarHBondContact O-CB 3.42Å; Y371-H375 PolarHBondContact O-N 2.72Å; Y371-E380 WeakPolarHBondContact CD2-OE2 3.47Å; Y371-E380 HydrophobicContact CE2-CB 4.26Å; Y371-E380 WeakPolarHBondContact CE2-OE2 3.16Å
372	S	84.3	Confident	79.2	Confident	27 Å²	27	67.1 Å²	67.1	19%	0.189	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-37.9	178.4	178	0	0	0	0	112.1	Y369 H375 M376	Y369-S372 PolarHBondContact O-N 3.04Å; Y369-S372 VanDerWaalsContact O-N 3.17Å; S372-H375 PolarHBondContact O-N 3.5Å; S372-M376 WeakPolarHBondContact O-CG 3.28Å; S372-M376 PolarHBondContact O-N 2.97Å; S372-M376 VanDerWaalsContact O-N 3.07Å
373	I	86.8	Confident	77.5	Confident	8 Å²	8	75.7 Å²	75.7	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-68.5	-46	176.6	-63.7	162.6	0	0	0	111.3	L344 A347 L348 W351 F365 Y369 A370 Y371 H375 M376 F377	L344-I373 HydrophobicContact CD1-CG2 4.06Å; A347-I373 HydrophobicContact CB-CG2 4.23Å; L348-I373 HydrophobicContact CD2-CB 3.97Å; L348-I373 HydrophobicContact CD2-CD1 4.21Å; L348-I373 HydrophobicContact CD2-CG2 3.87Å; L348-I373 HydrophobicContact CG-CG2 4.16Å; W351-I373 HydrophobicContact CB-CD1 3.63Å; W351-I373 HydrophobicContact CG-CD1 3.73Å; F365-I373 HydrophobicContact CE2-CD1 4.19Å; F365-I373 HydrophobicContact CZ-CD1 3.71Å; Y369-I373 WeakPolarHBondContact O-CG1 3.16Å; Y369-I373 PolarHBondContact O-N 2.72Å; A370-I373 PolarHBondContact O-N 3.26Å; Y371-I373 VanDerWaalsContact C-N 3.25Å; Y371-I373 PolarHBondContact O-N 2.84Å; I373-H375 VanDerWaalsContact C-N 3.25Å; I373-H375 PolarHBondContact O-N 3.43Å; I373-M376 HydrophobicContact CB-CE 4.21Å; I373-M376 HydrophobicContact CG1-CE 3.84Å; I373-M376 WeakPolarHBondContact O-CB 3.36Å; I373-M376 PolarHBondContact O-N 2.81Å; I373-F377 HydrophobicContact CG2-CD2 4.43Å; I373-F377 HydrophobicContact CG2-CE2 4.46Å; I373-F377 WeakPolarHBondContact O-CD2 3.23Å; I373-F377 PolarHBondContact O-N 3.09Å
374	R	86	Confident	75.8	Confident	77 Å²	77	72.5 Å²	72.5	29%	0.291	35%	0.352	S	S	.	.	H	α-helix	trans	-60.9	-37	175.7	-69.8	-179.7	-164.7	110	3.4	112.2	L344 L348 A370 Y371 F377 G378 K379 E380	L344-R374 HydrophobicContact CD1-CG 4.15Å; L344-R374 HydrophobicContact CD2-CG 4.32Å; L348-R374 HydrophobicContact CD1-CG 4.48Å; A370-R374 WeakPolarHBondContact O-CG 3.23Å; A370-R374 PolarHBondContact O-N 2.62Å; Y371-R374 PolarHBondContact O-N 3.03Å; R374-F377 CarbonylContact O-C 3.56Å; R374-F377 PolarHBondContact O-N 3.33Å; R374-G378 PolarHBondContact O-N 3.04Å; R374-K379 PolarHBondContact O-N 3.36Å; R374-K379 VanDerWaalsContact O-N 3.16Å; R374-E380 HydrophobicContact CB-CG 4.14Å; R374-E380 WeakPolarHBondContact CB-OE2 3.39Å; R374-E380 WeakPolarHBondContact CD-OE1 3.32Å
375	H	79.5	Confident	74.5	Confident	46 Å²	46	70.8 Å²	70.8	21%	0.213	35%	0.348	C	S	.	.	H	α-helix	trans	-64.1	-42.5	175.3	-168.2	-114.2	0	0	0	112.3	Y371 S372 I373 F377 G378 E380 Y386	Y371-H375 WeakPolarHBondContact O-CB 3.42Å; Y371-H375 PolarHBondContact O-N 2.72Å; S372-H375 PolarHBondContact O-N 3.5Å; I373-H375 VanDerWaalsContact C-N 3.25Å; I373-H375 PolarHBondContact O-N 3.43Å; H375-F377 PolarHBondContact O-N 3.4Å; H375-G378 PolarHBondContact O-N 2.73Å; H375-E380 PolarHBondContact CD2-O 3.36Å; H375-Y386 AromaticContact CE1-CE2 3.32Å; H375-Y386 WeakPolarHBondContact CE1-CE2 3.46Å; H375-Y386 AromaticContact CE1-CZ 3.69Å; H375-Y386 PolarHBondContact CE1-OH 3.2Å; H375-Y386 AromaticContact ND1-CE2 3.42Å; H375-Y386 WeakPolarHBondContact ND1-CE2 3.4Å
376	M	80.6	Confident	73.5	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.015	36%	0.364	C	S	.	.	H	α-helix	trans	-58.2	-30.2	173.8	-74.6	-171.4	-75.9	0	0	113.4	M331 L335 K338 S372 I373	M331-M376 HydrophobicContact CE-CG 3.95Å; M331-M376 HydrophobicContact CE-SD 4.31Å; M331-M376 HydrophobicContact SD-CG 3.66Å; M331-M376 HydrophobicContact SD-SD 3.56Å; L335-M376 HydrophobicContact CD2-CB 3.97Å; L335-M376 HydrophobicContact CD2-CG 4.22Å; L335-M376 HydrophobicContact CD2-SD 4.49Å; L335-M376 HydrophobicContact CG-SD 4.35Å; K338-M376 PolarHBondContact NZ-O 3.29Å; S372-M376 WeakPolarHBondContact O-CG 3.28Å; S372-M376 PolarHBondContact O-N 2.97Å; S372-M376 VanDerWaalsContact O-N 3.07Å; I373-M376 HydrophobicContact CB-CE 4.21Å; I373-M376 HydrophobicContact CG1-CE 3.84Å; I373-M376 WeakPolarHBondContact O-CB 3.36Å; I373-M376 PolarHBondContact O-N 2.81Å
377	F	80.1	Confident	73.1	Confident	32 Å²	32	74.9 Å²	74.9	14%	0.14	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.3	177.8	-79.8	-100.5	0	0	0	113.8	K338 L342 L344 A347 I373 R374 H375 K379	K338-F377 HydrophobicContact CB-CE1 3.83Å; K338-F377 HydrophobicContact CB-CE2 4.18Å; K338-F377 HydrophobicContact CB-CZ 3.61Å; K338-F377 HydrophobicContact CD-CD1 4.07Å; K338-F377 HydrophobicContact CD-CE1 4.14Å; K338-F377 HydrophobicContact CD-CG 4.29Å; K338-F377 HydrophobicContact CD-CZ 4.43Å; K338-F377 HydrophobicContact CG-CD1 4.01Å; K338-F377 HydrophobicContact CG-CE1 3.63Å; K338-F377 HydrophobicContact CG-CZ 3.96Å; L342-F377 VanDerWaalsContact O-CE1 3.25Å; L342-F377 WeakPolarHBondContact O-CE1 3.02Å; L344-F377 HydrophobicContact CB-CB 4.37Å; L344-F377 HydrophobicContact CB-CD1 3.95Å; L344-F377 HydrophobicContact CB-CE1 4.38Å; L344-F377 HydrophobicContact CB-CG 4.09Å; L344-F377 HydrophobicContact CD1-CB 4.01Å; L344-F377 HydrophobicContact CD1-CD2 3.91Å; L344-F377 HydrophobicContact CD1-CG 3.93Å; L344-F377 HydrophobicContact CD2-CB 4.47Å; A347-F377 HydrophobicContact CB-CE2 3.72Å; A347-F377 HydrophobicContact CB-CZ 3.75Å; I373-F377 HydrophobicContact CG2-CD2 4.43Å; I373-F377 HydrophobicContact CG2-CE2 4.46Å; I373-F377 WeakPolarHBondContact O-CD2 3.23Å; I373-F377 PolarHBondContact O-N 3.09Å; R374-F377 CarbonylContact O-C 3.56Å; R374-F377 PolarHBondContact O-N 3.33Å; H375-F377 PolarHBondContact O-N 3.4Å; F377-K379 VanDerWaalsContact C-N 3.3Å; F377-K379 PolarHBondContact O-N 3.03Å
378	G	73.1	Confident	73.2	Confident	17 Å²	17	66.8 Å²	66.8	18%	0.175	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	17.9	174.6	0	0	0	0	0	114.9	R374 H375	R374-G378 PolarHBondContact O-N 3.04Å; H375-G378 PolarHBondContact O-N 2.73Å
379	K	61.7	Low	73.5	Confident	161 Å²	161	65.7 Å²	65.7	70%	0.7	32%	0.316	S	S	*	.	S	Bend	trans	-91.8	-5.3	-178.1	-71.7	-70.2	-173.9	174.2	0	114.5	L344 R374 F377	L344-K379 HydrophobicContact CD2-CB 4.2Å; L344-K379 HydrophobicContact CD2-CG 3.84Å; R374-K379 PolarHBondContact O-N 3.36Å; R374-K379 VanDerWaalsContact O-N 3.16Å; F377-K379 VanDerWaalsContact C-N 3.3Å; F377-K379 PolarHBondContact O-N 3.03Å
380	E	54.2	Low	73.5	Confident	57 Å²	57	65 Å²	65	27%	0.266	32%	0.316	S	S	.	.	S	Bend	trans	-140.4	154.9	178.7	-68.5	176.5	167.9	0	0	110.9	Y371 R374 H375	Y371-E380 WeakPolarHBondContact CD2-OE2 3.47Å; Y371-E380 HydrophobicContact CE2-CB 4.26Å; Y371-E380 WeakPolarHBondContact CE2-OE2 3.16Å; R374-E380 HydrophobicContact CB-CG 4.14Å; R374-E380 WeakPolarHBondContact CB-OE2 3.39Å; R374-E380 WeakPolarHBondContact CD-OE1 3.32Å; H375-E380 PolarHBondContact CD2-O 3.36Å
381	G	54	Low	73.7	Confident	55 Å²	55	65.7 Å²	65.7	57%	0.567	32%	0.321	S	S	*	.	S	Bend	trans	79.8	-151.5	179.8	0	0	0	0	0	115.4	R383	G381-R383 PolarHBondContact O-N 3.1Å
382	K	45.6	Very low	73.8	Confident	211 Å²	211	62.6 Å²	62.6	92%	0.917	31%	0.312	S	S	*	.	S	Bend	trans	-63	9.5	178.7	-76.4	-171	179	-179.1	0	114.7	A384	K382-A384 PolarHBondContact O-N 3.11Å
383	R	52.8	Low	73.8	Confident	213 Å²	213	65.1 Å²	65.1	80%	0.804	32%	0.319	S	S	*	.			trans	54.3	35.4	-172.7	-58.5	-179.5	177.1	169.1	-0.3	113	G381 D385	G381-R383 PolarHBondContact O-N 3.1Å; R383-D385 PolarHBondContact O-N 3.28Å; R383-D385 VanDerWaalsContact O-N 3.1Å
384	A	53.1	Low	74	Confident	46 Å²	46	65 Å²	65	38%	0.38	32%	0.319	S	S	.	.			trans	-71.4	105	173.7	0	0	0	0	0	108.7	K382 Y386	K382-A384 PolarHBondContact O-N 3.11Å; A384-Y386 HydrophobicContact CB-CE2 4.37Å; A384-Y386 WeakPolarHBondContact O-CD2 3.17Å; A384-Y386 PolarHBondContact O-N 3.45Å
385	D	61.3	Low	74.2	Confident	74 Å²	74	61.9 Å²	61.9	40%	0.396	31%	0.308	S	S	.	.			trans	-72.7	92.9	176.8	-170	14.4	0	0	0	109.5	K338 R383 T387	K338-D385 IonicContact NZ-OD1 2.62Å; K338-D385 PolarHBondContact NZ-OD1 3.48Å; R383-D385 PolarHBondContact O-N 3.28Å; R383-D385 VanDerWaalsContact O-N 3.1Å; D385-T387 PolarHBondContact O-N 3.19Å
386	Y	71	Confident	74.5	Confident	85 Å²	85	65.1 Å²	65.1	33%	0.333	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-61.8	122.7	-179.2	-74.8	-84.7	0	0	0	110.4	M331 K338 H375 A384	M331-Y386 HydrophobicContact CE-CD1 4.38Å; K338-Y386 PolarHBondContact NZ-O 3.07Å; H375-Y386 AromaticContact CE1-CE2 3.32Å; H375-Y386 WeakPolarHBondContact CE1-CE2 3.46Å; H375-Y386 AromaticContact CE1-CZ 3.69Å; H375-Y386 PolarHBondContact CE1-OH 3.2Å; H375-Y386 AromaticContact ND1-CE2 3.42Å; H375-Y386 WeakPolarHBondContact ND1-CE2 3.4Å; A384-Y386 HydrophobicContact CB-CE2 4.37Å; A384-Y386 WeakPolarHBondContact O-CD2 3.17Å; A384-Y386 PolarHBondContact O-N 3.45Å
387	T	80.6	Confident	74.7	Confident	65 Å²	65	67.6 Å²	67.6	40%	0.399	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-80.9	139.5	179.9	58.7	0	0	0	0	110.8	D385	D385-T387 PolarHBondContact O-N 3.19Å
388	P	88.8	Confident	75	Confident	7 Å²	7	71.4 Å²	71.4	5%	0.045	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-49.4	143.4	169.1	-28.2	37.4	0	0	0	112.3	L335 S390 H467	L335-P388 WeakPolarHBondContact O-CG 3.47Å; P388-S390 PolarHBondContact O-N 3.21Å; P388-H467 PolarHBondContact O-NE2 2.92Å
389	Y	90.1	Very high	75.8	Confident	35 Å²	35	74.9 Å²	74.9	14%	0.137	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-76.3	126.4	-174.2	-68.8	-0.1	0	0	0	111.1	M331 Q332 L335 K393 V394 H467 P468	M331-Y389 HydrophobicContact CB-CE2 4.5Å; Q332-Y389 HydrophobicContact CB-CD2 4.07Å; Q332-Y389 HydrophobicContact CB-CE2 4.27Å; Q332-Y389 HydrophobicContact CG-CD2 4.28Å; L335-Y389 HydrophobicContact CD1-CD1 3.83Å; L335-Y389 HydrophobicContact CD1-CE1 3.42Å; L335-Y389 VanDerWaalsContact CD1-CE1 3.42Å; Y389-K393 HydrophobicContact CD1-CD 3.66Å; Y389-K393 HydrophobicContact CD1-CG 4.48Å; Y389-K393 HydrophobicContact CD2-CD 4.37Å; Y389-K393 HydrophobicContact CD2-CG 4.38Å; Y389-K393 HydrophobicContact CE1-CD 4.06Å; Y389-K393 VanDerWaalsContact CE1-CE 3.46Å; Y389-K393 HydrophobicContact CG-CD 3.83Å; Y389-K393 HydrophobicContact CG-CG 4.17Å; Y389-V394 HydrophobicContact CD2-CG2 4.34Å; Y389-H467 PolarHBondContact O-CE1 3.26Å; Y389-H467 PolarHBondContact O-NE2 3.31Å; Y389-P468 VanDerWaalsContact O-CD 3.23Å; Y389-P468 WeakPolarHBondContact O-CD 3.46Å
390	S	88.4	Confident	77.3	Confident	18 Å²	18	69 Å²	69	13%	0.126	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-64.8	159.5	169	68	0	0	0	0	112.2	Y281 P388 M392 K393 V394 H467	Y281-S390 VanDerWaalsContact CD2-CB 3.44Å; P388-S390 PolarHBondContact O-N 3.21Å; S390-M392 PolarHBondContact O-N 2.64Å; S390-K393 PolarHBondContact O-N 3.1Å; S390-K393 VanDerWaalsContact O-N 3.11Å; S390-K393 PolarHBondContact OG-N 2.68Å; S390-V394 WeakPolarHBondContact O-CG2 3.4Å; S390-V394 PolarHBondContact O-N 2.91Å; S390-H467 VanDerWaalsContact CA-CD2 3.46Å; S390-H467 WeakPolarHBondContact CA-CD2 3.28Å
391	C	90.6	Very high	79.2	Confident	15 Å²	15	70.3 Å²	70.3	10%	0.101	38%	0.379	C	S	.	.	H	α-helix	trans	-56.3	-40.3	175.2	-71.1	0	0	0	0	111	K393 V394 I395 Q445 S466 H467	C391-K393 PolarHBondContact O-N 3.36Å; C391-V394 CarbonylContact O-C 3.51Å; C391-V394 PolarHBondContact O-N 2.84Å; C391-I395 HydrophobicContact CB-CD1 4.31Å; C391-I395 WeakPolarHBondContact O-CB 3.27Å; C391-I395 WeakPolarHBondContact O-CD1 3.44Å; C391-I395 WeakPolarHBondContact O-CG1 3.37Å; C391-I395 PolarHBondContact O-N 2.97Å; C391-Q445 HydrophobicContact CB-CG 3.97Å; C391-S466 WeakPolarHBondContact CB-O 3.42Å; C391-S466 PolarHBondContact N-O 3.18Å; C391-S466 PolarHBondContact SG-O 3Å; C391-S466 VanDerWaalsContact SG-O 3.38Å; C391-H467 VanDerWaalsContact SG-CA 3.59Å; C391-H467 PolarHBondContact SG-N 2.99Å
392	M	86.4	Confident	80.9	Confident	62 Å²	62	76.5 Å²	76.5	31%	0.305	39%	0.393	S	S	.	.	H	α-helix	trans	-60.5	-43.8	177.6	-71.3	-59.3	-71.7	0	0	112.2	S390 I395 L396	S390-M392 PolarHBondContact O-N 2.64Å; M392-I395 PolarHBondContact O-N 3.37Å; M392-L396 HydrophobicContact CE-CD1 3.46Å; M392-L396 VanDerWaalsContact CE-CD1 3.46Å; M392-L396 HydrophobicContact CE-CG 4.29Å; M392-L396 WeakPolarHBondContact O-CB 3.49Å; M392-L396 PolarHBondContact O-N 3.23Å
393	K	85.7	Confident	82.9	Confident	80 Å²	80	68.2 Å²	68.2	35%	0.348	37%	0.367	S	S	.	.	H	α-helix	trans	-62.3	-44.3	175	-174.7	166.7	-178.2	172.5	0	111.4	Y389 S390 C391 I395 S397	Y389-K393 HydrophobicContact CD1-CD 3.66Å; Y389-K393 HydrophobicContact CD1-CG 4.48Å; Y389-K393 HydrophobicContact CD2-CD 4.37Å; Y389-K393 HydrophobicContact CD2-CG 4.38Å; Y389-K393 HydrophobicContact CE1-CD 4.06Å; Y389-K393 VanDerWaalsContact CE1-CE 3.46Å; Y389-K393 HydrophobicContact CG-CD 3.83Å; Y389-K393 HydrophobicContact CG-CG 4.17Å; S390-K393 PolarHBondContact O-N 3.1Å; S390-K393 VanDerWaalsContact O-N 3.11Å; S390-K393 PolarHBondContact OG-N 2.68Å; C391-K393 PolarHBondContact O-N 3.36Å; K393-I395 VanDerWaalsContact C-N 3.26Å; K393-I395 PolarHBondContact O-N 2.94Å; K393-S397 WeakPolarHBondContact O-CA 3.43Å; K393-S397 WeakPolarHBondContact O-CB 3.39Å; K393-S397 PolarHBondContact O-N 2.64Å; K393-S397 PolarHBondContact O-OG 2.95Å
394	V	91.4	Very high	84.9	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.03	34%	0.338	C	S	.	.	H	α-helix	trans	-65.9	-26.7	177.7	176.2	0	0	0	0	112.9	Q332 Y389 S390 C391 C408 H412	Q332-V394 HydrophobicContact CG-CG2 4.22Å; Y389-V394 HydrophobicContact CD2-CG2 4.34Å; S390-V394 WeakPolarHBondContact O-CG2 3.4Å; S390-V394 PolarHBondContact O-N 2.91Å; C391-V394 CarbonylContact O-C 3.51Å; C391-V394 PolarHBondContact O-N 2.84Å; V394-C408 HydrophobicContact CG1-CB 4.04Å; V394-C408 PolarHBondContact O-N 3.06Å; V394-H412 PolarHBondContact O-CE1 3.33Å
395	I	90	Very high	86.9	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.062	33%	0.334	C	S	.	.	H	α-helix	trans	-87.8	-39.9	-179.5	-70.7	163.2	0	0	0	112	C391 M392 K393 C408 R411 H412 Y444 Q445	C391-I395 HydrophobicContact CB-CD1 4.31Å; C391-I395 WeakPolarHBondContact O-CB 3.27Å; C391-I395 WeakPolarHBondContact O-CD1 3.44Å; C391-I395 WeakPolarHBondContact O-CG1 3.37Å; C391-I395 PolarHBondContact O-N 2.97Å; M392-I395 PolarHBondContact O-N 3.37Å; K393-I395 VanDerWaalsContact C-N 3.26Å; K393-I395 PolarHBondContact O-N 2.94Å; I395-C408 HydrophobicContact CG1-CB 3.58Å; I395-R411 HydrophobicContact CG2-CB 4.36Å; I395-R411 HydrophobicContact CG2-CG 4.15Å; I395-H412 PolarHBondContact O-NE2 2.97Å; I395-Y444 HydrophobicContact CG2-CD2 3.96Å; I395-Y444 HydrophobicContact CG2-CE2 4.48Å; I395-Q445 HydrophobicContact CD1-CG 3.96Å
396	L	85.5	Confident	88.5	Confident	114 Å²	114	58.5 Å²	58.5	60%	0.597	32%	0.319	S	S	*	.	H	α-helix	trans	-105.4	-20.6	-169.1	-61.1	-178.4	0	0	0	114.2	M392	M392-L396 HydrophobicContact CE-CD1 3.46Å; M392-L396 VanDerWaalsContact CE-CD1 3.46Å; M392-L396 HydrophobicContact CE-CG 4.29Å; M392-L396 WeakPolarHBondContact O-CB 3.49Å; M392-L396 PolarHBondContact O-N 3.23Å
397	S	83.6	Confident	89.7	Confident	55 Å²	55	54.5 Å²	54.5	39%	0.385	30%	0.304	S	S	.	.	S	Bend	trans	-106.9	142.3	-176.6	-49.5	0	0	0	0	111.5	K393	K393-S397 WeakPolarHBondContact O-CA 3.43Å; K393-S397 WeakPolarHBondContact O-CB 3.39Å; K393-S397 PolarHBondContact O-N 2.64Å; K393-S397 PolarHBondContact O-OG 2.95Å
398	N	86.6	Confident	90.5	Very high	113 Å²	113	52 Å²	52	60%	0.604	29%	0.289	S	S	*	.	S	Bend	trans	48.4	67.9	173.3	-63	-17.2	0	0	0	113.8	H406	N398-H406 PolarHBondContact O-CD2 3.3Å; N398-H406 PolarHBondContact O-NE2 3.16Å
399	P	90.1	Very high	90.9	Very high	90 Å²	90	51.8 Å²	51.8	58%	0.584	29%	0.287	S	S	*	.			trans	-56.9	140.8	177.7	25.9	-34.4	0	0	0	111
400	P	94.1	Very high	91.3	Very high	37 Å²	37	50.3 Å²	50.3	24%	0.24	28%	0.282	C	S	.	.			trans	-69.7	142.5	-179.1	29.5	-35.3	0	0	0	111.6	D404 H406 H412	P400-D404 HydrophobicContact CB-CB 3.71Å; P400-H406 WeakPolarHBondContact CB-O 3.36Å; P400-H406 WeakPolarHBondContact CG-O 3.35Å; P400-H412 HydrophobicContact CG-CB 3.7Å
401	S	93.2	Very high	91.6	Very high	84 Å²	84	54.8 Å²	54.8	59%	0.587	30%	0.296	S	S	*	.			trans	-101.2	-178.7	171.5	-63.6	0	0	0	0	111.5	G403 D404	S401-G403 PolarHBondContact O-N 3.11Å; S401-D404 WeakPolarHBondContact CB-OD2 3.25Å; S401-D404 PolarHBondContact N-OD2 3.16Å; S401-D404 WeakPolarHBondContact O-CB 3.25Å; S401-D404 PolarHBondContact O-N 3.4Å
402	Q	89.6	Confident	91.9	Very high	186 Å²	186	56.8 Å²	56.8	87%	0.869	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	129.4	174.6	-68.7	-174.8	0.2	0	0	111	D404	Q402-D404 VanDerWaalsContact C-N 3.29Å
403	G	88.1	Confident	92.3	Very high	37 Å²	37	55 Å²	55	38%	0.381	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-3.6	-174.9	0	0	0	0	0	114.8	S401 Y405	S401-G403 PolarHBondContact O-N 3.11Å; G403-Y405 WeakPolarHBondContact O-CE2 3.29Å
404	D	94.1	Very high	92.7	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.182	31%	0.305	C	S	.	.			trans	-89.6	140.5	168.8	-69.3	-44.5	0	0	0	111.4	R326 P400 S401 Q402 H406	R326-D404 WeakPolarHBondContact CB-OD1 3.37Å; R326-D404 WeakPolarHBondContact CD-OD1 3.46Å; P400-D404 HydrophobicContact CB-CB 3.71Å; S401-D404 WeakPolarHBondContact CB-OD2 3.25Å; S401-D404 PolarHBondContact N-OD2 3.16Å; S401-D404 WeakPolarHBondContact O-CB 3.25Å; S401-D404 PolarHBondContact O-N 3.4Å; Q402-D404 VanDerWaalsContact C-N 3.29Å; D404-H406 IonicContact OD1-CE1 3.01Å; D404-H406 IonicContact OD1-ND1 2.96Å; D404-H406 IonicContact OD2-CE1 2.78Å
405	Y	95.3	Very high	92.8	Very high	78 Å²	78	59.1 Å²	59.1	31%	0.306	33%	0.327	S	S	.	.			trans	-113.3	1.3	178.5	-65.4	-85.4	0	0	0	113.2	Q314 A318 Q322 G403	Q314-Y405 HydrophobicContact CG-CD1 4.48Å; Q314-Y405 PolarHBondContact NE2-O 3.28Å; A318-Y405 HydrophobicContact CB-CD1 3.63Å; A318-Y405 HydrophobicContact CB-CD2 3.71Å; A318-Y405 HydrophobicContact CB-CE1 4.2Å; A318-Y405 HydrophobicContact CB-CE2 4.29Å; A318-Y405 HydrophobicContact CB-CG 3.37Å; Q322-Y405 PolarHBondContact NE2-OH 3.16Å; G403-Y405 WeakPolarHBondContact O-CE2 3.29Å
406	H	96.1	Very high	93	Very high	16 Å²	16	62.8 Å²	62.8	7%	0.074	34%	0.344	C	S	.	.			trans	-81.1	-180	178.7	71.1	-91.9	0	0	0	112.7	L315 Q332 N398 P400 D404	L315-H406 HydrophobicContact CD2-CB 4.16Å; Q332-H406 HydrophobicContact CB-CB 4.44Å; N398-H406 PolarHBondContact O-CD2 3.3Å; N398-H406 PolarHBondContact O-NE2 3.16Å; P400-H406 WeakPolarHBondContact CB-O 3.36Å; P400-H406 WeakPolarHBondContact CG-O 3.35Å; D404-H406 IonicContact OD1-CE1 3.01Å; D404-H406 IonicContact OD1-ND1 2.96Å; D404-H406 IonicContact OD2-CE1 2.78Å
407	G	96.3	Very high	93.5	Very high	2 Å²	2	61 Å²	61	2%	0.021	34%	0.335	C	S	.	.	S	Bend	trans	89	-177.4	-175.9	0	0	0	0	0	113.6	C311 Q332	C311-G407 WeakPolarHBondContact CB-O 3.31Å; Q332-G407 PolarHBondContact NE2-O 3.45Å
408	C	97.4	Very high	94.1	Very high	12 Å²	12	58.5 Å²	58.5	8%	0.081	32%	0.317	C	S	.	.			trans	-91.3	119.4	178	179.6	0	0	0	0	110.8	V394 I395 F410 R411 H412	V394-C408 HydrophobicContact CG1-CB 4.04Å; V394-C408 PolarHBondContact O-N 3.06Å; I395-C408 HydrophobicContact CG1-CB 3.58Å; C408-F410 VanDerWaalsContact C-N 3.26Å; C408-F410 PolarHBondContact O-N 3.41Å; C408-R411 HydrophobicContact CB-CB 4.11Å; C408-R411 PolarHBondContact O-N 2.93Å; C408-H412 PolarHBondContact N-ND1 2.95Å; C408-H412 VanDerWaalsContact N-ND1 3.17Å; C408-H412 PolarHBondContact O-N 3.41Å; C408-H412 PolarHBondContact O-ND1 3.28Å
409	P	97	Very high	94.6	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.013	30%	0.301	C	S	.	.	H	α-helix	trans	-59.2	-36.1	178.6	-27.5	36	0	0	0	113.3	L310 C311 R411 S413 L418	L310-P409 HydrophobicContact CB-CG 4.23Å; L310-P409 HydrophobicContact CD2-CB 3.84Å; L310-P409 HydrophobicContact CD2-CG 4.31Å; L310-P409 HydrophobicContact CG-CB 4.06Å; L310-P409 HydrophobicContact CG-CG 3.98Å; C311-P409 VanDerWaalsContact CA-CD 3.47Å; C311-P409 HydrophobicContact CB-CG 4.32Å; P409-R411 PolarHBondContact O-N 2.89Å; P409-S413 WeakPolarHBondContact O-CB 3.28Å; P409-S413 PolarHBondContact O-N 3.5Å; P409-S413 VanDerWaalsContact O-N 3.08Å; P409-S413 PolarHBondContact O-OG 3.05Å; P409-L418 HydrophobicContact CB-CD1 4.34Å
410	F	97.5	Very high	94.9	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-20.5	177.4	-58.1	-74.3	0	0	0	113.4	L310 C408 L418 I435 V439 Y444 A447 C448 Y451	L310-F410 HydrophobicContact CB-CE2 3.9Å; L310-F410 HydrophobicContact CB-CZ 4.11Å; L310-F410 HydrophobicContact CD2-CE1 3.99Å; L310-F410 HydrophobicContact CD2-CE2 3.99Å; L310-F410 HydrophobicContact CD2-CZ 3.6Å; C408-F410 VanDerWaalsContact C-N 3.26Å; C408-F410 PolarHBondContact O-N 3.41Å; F410-L418 HydrophobicContact CD1-CD1 4.47Å; F410-L418 HydrophobicContact CD1-CD2 4.18Å; F410-I435 HydrophobicContact CD1-CG2 3.94Å; F410-I435 HydrophobicContact CE1-CG2 3.67Å; F410-V439 HydrophobicContact CB-CG2 4.03Å; F410-V439 HydrophobicContact CD1-CG2 4.08Å; F410-V439 VanDerWaalsContact O-CG1 3.31Å; F410-V439 WeakPolarHBondContact O-CG1 3.49Å; F410-Y444 HydrophobicContact CB-CD1 4.21Å; F410-Y444 WeakPolarHBondContact O-CD1 3.46Å; F410-Y444 VanDerWaalsContact O-CE1 3.23Å; F410-Y444 WeakPolarHBondContact O-CE1 3.12Å; F410-A447 HydrophobicContact CB-CB 4.35Å; F410-A447 HydrophobicContact CD1-CB 3.76Å; F410-A447 HydrophobicContact CE1-CB 4.29Å; F410-A447 HydrophobicContact CG-CB 4.08Å; F410-C448 HydrophobicContact CD2-CB 3.75Å; F410-C448 VanDerWaalsContact CE2-CA 3.48Å; F410-C448 HydrophobicContact CE2-CB 3.41Å; F410-C448 VanDerWaalsContact CE2-CB 3.41Å; F410-C448 HydrophobicContact CZ-CB 4.15Å; F410-Y451 HydrophobicContact CZ-CG 4.18Å
411	R	96.1	Very high	94.9	Very high	113 Å²	113	57.2 Å²	57.2	43%	0.426	30%	0.295	S	S	.	.	H	α-helix	trans	-100.8	-45	177.2	171.1	64	-174.8	165.1	1.4	112.8	I395 C408 P409 Y444	I395-R411 HydrophobicContact CG2-CB 4.36Å; I395-R411 HydrophobicContact CG2-CG 4.15Å; C408-R411 HydrophobicContact CB-CB 4.11Å; C408-R411 PolarHBondContact O-N 2.93Å; P409-R411 PolarHBondContact O-N 2.89Å; R411-Y444 HydrophobicContact CB-CD1 4.12Å; R411-Y444 HydrophobicContact CB-CD2 4.15Å; R411-Y444 HydrophobicContact CB-CE1 4.22Å; R411-Y444 HydrophobicContact CB-CE2 4.26Å; R411-Y444 HydrophobicContact CB-CG 4.07Å; R411-Y444 WeakPolarHBondContact CD-OH 3.44Å; R411-Y444 HydrophobicContact CG-CE2 4.27Å; R411-Y444 PolarHBondContact NH1-OH 2.94Å
412	H	96	Very high	95	Very high	57 Å²	57	53.2 Å²	53.2	26%	0.264	27%	0.267	S	S	.	.	H	α-helix	trans	-104.7	-15.3	-164.3	-57.1	132.7	0	0	0	114.2	V394 I395 P400 C408	V394-H412 PolarHBondContact O-CE1 3.33Å; I395-H412 PolarHBondContact O-NE2 2.97Å; P400-H412 HydrophobicContact CG-CB 3.7Å; C408-H412 PolarHBondContact N-ND1 2.95Å; C408-H412 VanDerWaalsContact N-ND1 3.17Å; C408-H412 PolarHBondContact O-N 3.41Å; C408-H412 PolarHBondContact O-ND1 3.28Å
413	S	94.1	Very high	95.3	Very high	23 Å²	23	48.8 Å²	48.8	16%	0.161	25%	0.246	C	C	.	.	S	Bend	trans	-79.6	145.6	174.3	-60.9	0	0	0	0	110.4	P409	P409-S413 WeakPolarHBondContact O-CB 3.28Å; P409-S413 PolarHBondContact O-N 3.5Å; P409-S413 VanDerWaalsContact O-N 3.08Å; P409-S413 PolarHBondContact O-OG 3.05Å
414	D	93.9	Very high	95.6	Very high	96 Å²	96	50.8 Å²	50.8	51%	0.513	25%	0.254	S	S	.	.			trans	-56.1	139.3	165.6	174	-92.9	0	0	0	110.4	E416 L417 L418	D414-E416 VanDerWaalsContact C-N 3.33Å; D414-E416 PolarHBondContact O-N 3.33Å; D414-E416 WeakPolarHBondContact OD1-CB 3.49Å; D414-E416 PolarHBondContact OD1-N 3.43Å; D414-L417 HydrophobicContact CB-CB 4.14Å; D414-L417 PolarHBondContact O-N 2.93Å; D414-L417 PolarHBondContact OD1-N 3.31Å; D414-L418 WeakPolarHBondContact O-CB 3.3Å; D414-L418 PolarHBondContact O-N 3.09Å
415	P	94.1	Very high	95.5	Very high	77 Å²	77	51.4 Å²	51.4	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-57.2	-37.4	-177.6	-28.3	36.3	0	0	0	115	L418 K419	P415-L418 PolarHBondContact O-N 3.43Å; P415-K419 WeakPolarHBondContact O-CB 3.49Å; P415-K419 PolarHBondContact O-N 2.93Å
416	E	95.4	Very high	95.4	Very high	89 Å²	89	57.2 Å²	57.2	42%	0.416	28%	0.281	S	S	.	.	H	α-helix	trans	-75.2	-38.9	-179.6	-167	61.2	-150.3	0	0	110.5	D414 L418 K419 Q420	D414-E416 VanDerWaalsContact C-N 3.33Å; D414-E416 PolarHBondContact O-N 3.33Å; D414-E416 WeakPolarHBondContact OD1-CB 3.49Å; D414-E416 PolarHBondContact OD1-N 3.43Å; E416-L418 VanDerWaalsContact C-N 3.34Å; E416-L418 PolarHBondContact O-N 2.89Å; E416-K419 WeakPolarHBondContact O-CB 3.35Å; E416-K419 PolarHBondContact O-N 3.3Å; E416-K419 IonicContact OE1-NZ 3.57Å; E416-K419 PolarHBondContact OE1-NZ 2.93Å; E416-K419 IonicContact OE2-NZ 2.82Å; E416-K419 PolarHBondContact OE2-NZ 3.45Å; E416-Q420 WeakPolarHBondContact O-CG 3.3Å; E416-Q420 PolarHBondContact O-N 3.47Å
417	L	94.9	Very high	95.3	Very high	77 Å²	77	57 Å²	57	40%	0.403	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-41.7	172	-178.9	62.1	0	0	0	111.7	D414 Q420 K421	D414-L417 HydrophobicContact CB-CB 4.14Å; D414-L417 PolarHBondContact O-N 2.93Å; D414-L417 PolarHBondContact OD1-N 3.31Å; L417-Q420 PolarHBondContact O-N 2.83Å; L417-K421 HydrophobicContact CG-CD 4.47Å; L417-K421 WeakPolarHBondContact O-CG 3.42Å; L417-K421 PolarHBondContact O-N 3Å
418	L	96.4	Very high	95.3	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-44.6	176.6	178.6	60	0	0	0	111	L310 P409 F410 D414 P415 E416 K421 L422 L436 V439	L310-L418 HydrophobicContact CD2-CD1 3.8Å; P409-L418 HydrophobicContact CB-CD1 4.34Å; F410-L418 HydrophobicContact CD1-CD1 4.47Å; F410-L418 HydrophobicContact CD1-CD2 4.18Å; D414-L418 WeakPolarHBondContact O-CB 3.3Å; D414-L418 PolarHBondContact O-N 3.09Å; P415-L418 PolarHBondContact O-N 3.43Å; E416-L418 VanDerWaalsContact C-N 3.34Å; E416-L418 PolarHBondContact O-N 2.89Å; L418-K421 PolarHBondContact O-N 3.5Å; L418-L422 HydrophobicContact CD1-CD1 4.21Å; L418-L422 HydrophobicContact CD1-CG 4.21Å; L418-L422 HydrophobicContact CG-CD1 4Å; L418-L422 HydrophobicContact CG-CG 4.45Å; L418-L422 VanDerWaalsContact O-CG 3.27Å; L418-L422 WeakPolarHBondContact O-CG 3.38Å; L418-L422 PolarHBondContact O-N 2.99Å; L418-L436 HydrophobicContact CD2-CD2 4.05Å; L418-L436 HydrophobicContact CG-CD2 4.41Å; L418-V439 HydrophobicContact CD2-CG2 4.14Å
419	K	96.8	Very high	95.2	Very high	63 Å²	63	63.7 Å²	63.7	27%	0.274	33%	0.325	S	S	.	.	H	α-helix	trans	-57.8	-49.1	175.7	179.7	-174.9	163.7	-154.5	0	111.9	P415 E416 K421 L422 Q423 V432 L436	P415-K419 WeakPolarHBondContact O-CB 3.49Å; P415-K419 PolarHBondContact O-N 2.93Å; E416-K419 WeakPolarHBondContact O-CB 3.35Å; E416-K419 PolarHBondContact O-N 3.3Å; E416-K419 IonicContact OE1-NZ 3.57Å; E416-K419 PolarHBondContact OE1-NZ 2.93Å; E416-K419 IonicContact OE2-NZ 2.82Å; E416-K419 PolarHBondContact OE2-NZ 3.45Å; K419-K421 VanDerWaalsContact C-N 3.34Å; K419-K421 PolarHBondContact O-N 2.92Å; K419-L422 PolarHBondContact O-N 3.37Å; K419-Q423 VanDerWaalsContact O-CG 3.32Å; K419-Q423 WeakPolarHBondContact O-CG 3.44Å; K419-Q423 PolarHBondContact O-N 3.35Å; K419-V432 HydrophobicContact CB-CG1 4.27Å; K419-V432 HydrophobicContact CG-CG1 3.8Å; K419-L436 HydrophobicContact CB-CD1 4.13Å; K419-L436 HydrophobicContact CD-CD1 4.4Å; K419-L436 HydrophobicContact CG-CD1 4.32Å
420	Q	95.9	Very high	95.1	Very high	105 Å²	105	67.1 Å²	67.1	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-59.4	-44.1	176.9	-70.9	174.4	3.9	0	0	111.7	E416 L417 Q423 S424	E416-Q420 WeakPolarHBondContact O-CG 3.3Å; E416-Q420 PolarHBondContact O-N 3.47Å; L417-Q420 PolarHBondContact O-N 2.83Å; Q420-Q423 PolarHBondContact O-N 2.97Å; Q420-S424 PolarHBondContact O-N 3.05Å
421	K	94.4	Very high	95	Very high	46 Å²	46	67 Å²	67	20%	0.2	35%	0.349	C	S	.	.	H	α-helix	trans	-60	-48.4	175.3	-75.9	176.6	177.6	175.3	0	111.8	L417 L418 K419 Q423 S424 Y425	L417-K421 HydrophobicContact CG-CD 4.47Å; L417-K421 WeakPolarHBondContact O-CG 3.42Å; L417-K421 PolarHBondContact O-N 3Å; L418-K421 PolarHBondContact O-N 3.5Å; K419-K421 VanDerWaalsContact C-N 3.34Å; K419-K421 PolarHBondContact O-N 2.92Å; K421-Q423 VanDerWaalsContact C-N 3.32Å; K421-Q423 PolarHBondContact O-N 2.88Å; K421-S424 WeakPolarHBondContact O-CB 3.4Å; K421-S424 PolarHBondContact O-N 3.25Å; K421-S424 VanDerWaalsContact O-N 3.16Å; K421-S424 PolarHBondContact O-OG 3.17Å; K421-Y425 HydrophobicContact CB-CE2 4.38Å; K421-Y425 VanDerWaalsContact O-CD2 3.28Å; K421-Y425 WeakPolarHBondContact O-CD2 3.49Å; K421-Y425 PolarHBondContact O-N 3.49Å; K421-Y425 VanDerWaalsContact O-N 3.11Å
422	L	96.4	Very high	95.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-40.1	179.4	-67.7	168.3	0	0	0	112.1	L310 L418 K419 Y425 K426 V427 V432 I435 Y451	L310-L422 HydrophobicContact CD2-CD2 4.13Å; L418-L422 HydrophobicContact CD1-CD1 4.21Å; L418-L422 HydrophobicContact CD1-CG 4.21Å; L418-L422 HydrophobicContact CG-CD1 4Å; L418-L422 HydrophobicContact CG-CG 4.45Å; L418-L422 VanDerWaalsContact O-CG 3.27Å; L418-L422 WeakPolarHBondContact O-CG 3.38Å; L418-L422 PolarHBondContact O-N 2.99Å; K419-L422 PolarHBondContact O-N 3.37Å; L422-Y425 CarbonylContact O-C 3.59Å; L422-Y425 PolarHBondContact O-N 3.33Å; L422-Y425 VanDerWaalsContact O-N 3.16Å; L422-K426 PolarHBondContact O-N 3.02Å; L422-V427 HydrophobicContact CB-CB 4.37Å; L422-V427 HydrophobicContact CB-CG2 4.39Å; L422-V427 HydrophobicContact CD2-CG2 4.38Å; L422-V427 WeakPolarHBondContact O-CB 3.48Å; L422-V427 WeakPolarHBondContact O-CG2 3.38Å; L422-V427 PolarHBondContact O-N 2.96Å; L422-V427 VanDerWaalsContact O-N 3.16Å; L422-V432 HydrophobicContact CB-CG1 4.44Å; L422-V432 HydrophobicContact CB-CG2 3.83Å; L422-V432 HydrophobicContact CD1-CG1 4.18Å; L422-I435 HydrophobicContact CD1-CB 4.34Å; L422-I435 HydrophobicContact CD1-CD1 4.22Å; L422-I435 HydrophobicContact CD1-CG2 3.78Å; L422-I435 HydrophobicContact CD2-CD1 4.21Å; L422-Y451 HydrophobicContact CD2-CD2 3.61Å; L422-Y451 HydrophobicContact CD2-CE2 3.95Å
423	Q	95.3	Very high	95.1	Very high	92 Å²	92	62.7 Å²	62.7	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-42.1	174.1	-71.9	173.9	-24.8	0	0	111.9	K419 Q420 K421 Y425 K426 V432	K419-Q423 VanDerWaalsContact O-CG 3.32Å; K419-Q423 WeakPolarHBondContact O-CG 3.44Å; K419-Q423 PolarHBondContact O-N 3.35Å; Q420-Q423 PolarHBondContact O-N 2.97Å; K421-Q423 VanDerWaalsContact C-N 3.32Å; K421-Q423 PolarHBondContact O-N 2.88Å; Q423-Y425 PolarHBondContact O-N 2.94Å; Q423-K426 PolarHBondContact O-N 3.05Å; Q423-V432 HydrophobicContact CG-CG2 4.36Å
424	S	93.7	Very high	95.2	Very high	79 Å²	79	65.3 Å²	65.3	55%	0.552	35%	0.352	S	S	*	.	H	α-helix	trans	-61.1	-28.2	175.2	81.6	0	0	0	0	112.7	Q420 K421 K426	Q420-S424 PolarHBondContact O-N 3.05Å; K421-S424 WeakPolarHBondContact O-CB 3.4Å; K421-S424 PolarHBondContact O-N 3.25Å; K421-S424 VanDerWaalsContact O-N 3.16Å; K421-S424 PolarHBondContact O-OG 3.17Å; S424-K426 PolarHBondContact O-N 3.28Å
425	Y	92.1	Very high	95.3	Very high	48 Å²	48	60.8 Å²	60.8	19%	0.188	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	15.8	175.3	-57.1	-29.9	0	0	0	113.4	L310 R313 K421 L422 Q423 V427	L310-Y425 HydrophobicContact CD1-CD2 3.62Å; L310-Y425 HydrophobicContact CD1-CE2 3.3Å; R313-Y425 VanDerWaalsContact CZ-CD1 3.41Å; K421-Y425 HydrophobicContact CB-CE2 4.38Å; K421-Y425 VanDerWaalsContact O-CD2 3.28Å; K421-Y425 WeakPolarHBondContact O-CD2 3.49Å; K421-Y425 PolarHBondContact O-N 3.49Å; K421-Y425 VanDerWaalsContact O-N 3.11Å; L422-Y425 CarbonylContact O-C 3.59Å; L422-Y425 PolarHBondContact O-N 3.33Å; L422-Y425 VanDerWaalsContact O-N 3.16Å; Q423-Y425 PolarHBondContact O-N 2.94Å; Y425-V427 PolarHBondContact O-N 3.48Å
426	K	92.8	Very high	95.5	Very high	199 Å²	199	59.1 Å²	59.1	87%	0.865	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	25.4	174.9	-53.6	-178.9	178.1	-178.6	0	113.9	L422 Q423 S424	L422-K426 PolarHBondContact O-N 3.02Å; Q423-K426 PolarHBondContact O-N 3.05Å; S424-K426 PolarHBondContact O-N 3.28Å
427	V	94.9	Very high	95.5	Very high	11 Å²	11	61.9 Å²	61.9	7%	0.067	33%	0.327	C	S	.	.			trans	-72.3	132.1	169.5	-175.3	0	0	0	0	108.6	L422 Y425 V432 I435 Y451 L454 T455	L422-V427 HydrophobicContact CB-CB 4.37Å; L422-V427 HydrophobicContact CB-CG2 4.39Å; L422-V427 HydrophobicContact CD2-CG2 4.38Å; L422-V427 WeakPolarHBondContact O-CB 3.48Å; L422-V427 WeakPolarHBondContact O-CG2 3.38Å; L422-V427 PolarHBondContact O-N 2.96Å; L422-V427 VanDerWaalsContact O-N 3.16Å; Y425-V427 PolarHBondContact O-N 3.48Å; V427-V432 HydrophobicContact CB-CG2 3.91Å; V427-V432 HydrophobicContact CG1-CG2 3.78Å; V427-I435 HydrophobicContact CG1-CD1 4.29Å; V427-Y451 HydrophobicContact CG2-CD2 4.05Å; V427-Y451 HydrophobicContact CG2-CE2 4Å; V427-L454 HydrophobicContact CG1-CB 4.42Å; V427-L454 HydrophobicContact CG1-CD1 3.79Å; V427-T455 HydrophobicContact CG2-CG2 4.44Å
428	S	95.6	Very high	95.5	Very high	59 Å²	59	59.6 Å²	59.6	41%	0.413	32%	0.316	S	S	.	.			trans	-61.3	149.2	-178.8	69.9	0	0	0	0	111.7	S430 G431 V432	S428-S430 PolarHBondContact O-N 3.35Å; S428-G431 WeakPolarHBondContact O-CA 3.49Å; S428-G431 PolarHBondContact O-N 3.46Å; S428-G431 PolarHBondContact OG-N 2.86Å; S428-V432 WeakPolarHBondContact O-CG2 3.5Å; S428-V432 PolarHBondContact O-N 2.99Å
429	P	95.4	Very high	95.4	Very high	96 Å²	96	60.6 Å²	60.6	62%	0.623	32%	0.322	S	S	*	.	H	α-helix	trans	-55.8	-36.1	-180	-27.5	35.1	0	0	0	114.1	S433	P429-S433 PolarHBondContact O-N 3.45Å; P429-S433 VanDerWaalsContact O-N 3.11Å; P429-S433 PolarHBondContact O-OG 3.18Å
430	S	96	Very high	95.2	Very high	75 Å²	75	66.5 Å²	66.5	52%	0.524	35%	0.347	S	S	.	.	H	α-helix	trans	-65	-46.5	173.1	177.2	0	0	0	0	111.5	S428 V432 S433 Q434	S428-S430 PolarHBondContact O-N 3.35Å; S430-V432 VanDerWaalsContact C-N 3.34Å; S430-V432 PolarHBondContact O-N 3.07Å; S430-S433 WeakPolarHBondContact O-CB 3.49Å; S430-S433 PolarHBondContact O-N 2.94Å; S430-S433 VanDerWaalsContact O-N 3.15Å; S430-Q434 WeakPolarHBondContact O-CG 3.27Å; S430-Q434 PolarHBondContact O-N 2.95Å; S430-Q434 PolarHBondContact OG-NE2 3.08Å
431	G	95.2	Very high	94.9	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-39.3	176.4	0	0	0	0	0	113.2	S428 S433 Q434 I435	S428-G431 WeakPolarHBondContact O-CA 3.49Å; S428-G431 PolarHBondContact O-N 3.46Å; S428-G431 PolarHBondContact OG-N 2.86Å; G431-S433 VanDerWaalsContact C-N 3.32Å; G431-S433 PolarHBondContact O-N 3.5Å; G431-Q434 PolarHBondContact O-N 3.11Å; G431-I435 WeakPolarHBondContact O-CG1 3.39Å; G431-I435 PolarHBondContact O-N 3.2Å
432	V	97	Very high	94.6	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-61.1	-43.1	174	177.5	0	0	0	0	111	K419 L422 Q423 V427 S428 S430 Q434 I435 L436	K419-V432 HydrophobicContact CB-CG1 4.27Å; K419-V432 HydrophobicContact CG-CG1 3.8Å; L422-V432 HydrophobicContact CB-CG1 4.44Å; L422-V432 HydrophobicContact CB-CG2 3.83Å; L422-V432 HydrophobicContact CD1-CG1 4.18Å; Q423-V432 HydrophobicContact CG-CG2 4.36Å; V427-V432 HydrophobicContact CB-CG2 3.91Å; V427-V432 HydrophobicContact CG1-CG2 3.78Å; S428-V432 WeakPolarHBondContact O-CG2 3.5Å; S428-V432 PolarHBondContact O-N 2.99Å; S430-V432 VanDerWaalsContact C-N 3.34Å; S430-V432 PolarHBondContact O-N 3.07Å; V432-Q434 PolarHBondContact O-N 3.29Å; V432-I435 PolarHBondContact O-N 2.94Å; V432-L436 HydrophobicContact CG1-CD1 4.02Å; V432-L436 HydrophobicContact CG1-CG 4.33Å; V432-L436 WeakPolarHBondContact O-CG 3.34Å; V432-L436 PolarHBondContact O-N 3.2Å
433	S	96.6	Very high	94.3	Very high	76 Å²	76	69.5 Å²	69.5	53%	0.531	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-43.8	178.1	-56.1	0	0	0	0	111.8	P429 S430 G431 L436 E437	P429-S433 PolarHBondContact O-N 3.45Å; P429-S433 VanDerWaalsContact O-N 3.11Å; P429-S433 PolarHBondContact O-OG 3.18Å; S430-S433 WeakPolarHBondContact O-CB 3.49Å; S430-S433 PolarHBondContact O-N 2.94Å; S430-S433 VanDerWaalsContact O-N 3.15Å; G431-S433 VanDerWaalsContact C-N 3.32Å; G431-S433 PolarHBondContact O-N 3.5Å; S433-L436 PolarHBondContact O-N 3.39Å; S433-E437 PolarHBondContact O-N 3.28Å
434	Q	95.5	Very high	94.3	Very high	78 Å²	78	66.4 Å²	66.4	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-43.2	175.8	-66.6	172.4	36	0	0	112.2	S430 G431 V432 L436 E437 L438 K450	S430-Q434 WeakPolarHBondContact O-CG 3.27Å; S430-Q434 PolarHBondContact O-N 2.95Å; S430-Q434 PolarHBondContact OG-NE2 3.08Å; G431-Q434 PolarHBondContact O-N 3.11Å; V432-Q434 PolarHBondContact O-N 3.29Å; Q434-L436 PolarHBondContact O-N 3.29Å; Q434-E437 PolarHBondContact O-N 2.89Å; Q434-L438 PolarHBondContact O-N 3.17Å; Q434-K450 VanDerWaalsContact OE1-CE 3.25Å
435	I	97.3	Very high	94.2	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-45	176	-71.9	169.7	0	0	0	110.8	F410 L422 V427 G431 V432 E437 L438 V439 A447 K450 L454	F410-I435 HydrophobicContact CD1-CG2 3.94Å; F410-I435 HydrophobicContact CE1-CG2 3.67Å; L422-I435 HydrophobicContact CD1-CB 4.34Å; L422-I435 HydrophobicContact CD1-CD1 4.22Å; L422-I435 HydrophobicContact CD1-CG2 3.78Å; L422-I435 HydrophobicContact CD2-CD1 4.21Å; V427-I435 HydrophobicContact CG1-CD1 4.29Å; G431-I435 WeakPolarHBondContact O-CG1 3.39Å; G431-I435 PolarHBondContact O-N 3.2Å; V432-I435 PolarHBondContact O-N 2.94Å; I435-E437 VanDerWaalsContact C-N 3.32Å; I435-E437 PolarHBondContact O-N 3.35Å; I435-L438 WeakPolarHBondContact O-CB 3.37Å; I435-L438 PolarHBondContact O-N 2.95Å; I435-V439 WeakPolarHBondContact O-CG2 3Å; I435-V439 PolarHBondContact O-N 3.19Å; I435-A447 HydrophobicContact CG2-CB 4.22Å; I435-K450 HydrophobicContact CG1-CB 4.04Å; I435-K450 HydrophobicContact CG1-CG 3.93Å; I435-L454 HydrophobicContact CD1-CD1 3.92Å; I435-L454 HydrophobicContact CG1-CD1 4.36Å
436	L	97	Very high	94.2	Very high	42 Å²	42	63.5 Å²	63.5	22%	0.22	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-32.1	-179.1	-69.6	176.9	0	0	0	112.5	L418 K419 V432 S433 Q434 V439 K440	L418-L436 HydrophobicContact CD2-CD2 4.05Å; L418-L436 HydrophobicContact CG-CD2 4.41Å; K419-L436 HydrophobicContact CB-CD1 4.13Å; K419-L436 HydrophobicContact CD-CD1 4.4Å; K419-L436 HydrophobicContact CG-CD1 4.32Å; V432-L436 HydrophobicContact CG1-CD1 4.02Å; V432-L436 HydrophobicContact CG1-CG 4.33Å; V432-L436 WeakPolarHBondContact O-CG 3.34Å; V432-L436 PolarHBondContact O-N 3.2Å; S433-L436 PolarHBondContact O-N 3.39Å; Q434-L436 PolarHBondContact O-N 3.29Å; L436-V439 PolarHBondContact O-N 2.93Å; L436-K440 WeakPolarHBondContact O-CB 3.37Å; L436-K440 PolarHBondContact O-N 3.22Å
437	E	95.9	Very high	94.3	Very high	147 Å²	147	54 Å²	54	69%	0.687	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-44.2	172.3	-173.7	171.4	-165.4	0	0	111.7	S433 Q434 I435 V439 K440 G441	S433-E437 PolarHBondContact O-N 3.28Å; Q434-E437 PolarHBondContact O-N 2.89Å; I435-E437 VanDerWaalsContact C-N 3.32Å; I435-E437 PolarHBondContact O-N 3.35Å; E437-V439 VanDerWaalsContact C-N 3.34Å; E437-V439 PolarHBondContact O-N 2.99Å; E437-K440 WeakPolarHBondContact O-CB 3.39Å; E437-K440 PolarHBondContact O-N 2.72Å; E437-G441 PolarHBondContact O-N 3.16Å
438	L	94.8	Very high	94.4	Very high	30 Å²	30	54 Å²	54	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-40.8	173.8	-67.4	169.3	0	0	0	111.9	V87 Q434 I435 G441 M442 H443 L446 A447 K450	V87-L438 HydrophobicContact CG1-CD2 3.63Å; Q434-L438 PolarHBondContact O-N 3.17Å; I435-L438 WeakPolarHBondContact O-CB 3.37Å; I435-L438 PolarHBondContact O-N 2.95Å; L438-G441 CarbonylContact O-C 3.55Å; L438-G441 PolarHBondContact O-N 3.26Å; L438-M442 PolarHBondContact O-N 3.33Å; L438-H443 HydrophobicContact CB-CB 4.43Å; L438-H443 HydrophobicContact CD2-CB 4.34Å; L438-H443 PolarHBondContact O-N 3.23Å; L438-L446 HydrophobicContact CD1-CB 4.38Å; L438-L446 HydrophobicContact CD2-CB 4.33Å; L438-A447 HydrophobicContact CB-CB 3.91Å; L438-K450 HydrophobicContact CD1-CB 3.9Å; L438-K450 HydrophobicContact CD1-CG 4.35Å
439	V	95.1	Very high	94.4	Very high	22 Å²	22	52.2 Å²	52.2	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-42.7	174.8	168.2	0	0	0	0	111.5	F410 L418 I435 L436 E437 G441 M442 Y444 A447	F410-V439 HydrophobicContact CB-CG2 4.03Å; F410-V439 HydrophobicContact CD1-CG2 4.08Å; F410-V439 VanDerWaalsContact O-CG1 3.31Å; F410-V439 WeakPolarHBondContact O-CG1 3.49Å; L418-V439 HydrophobicContact CD2-CG2 4.14Å; I435-V439 WeakPolarHBondContact O-CG2 3Å; I435-V439 PolarHBondContact O-N 3.19Å; L436-V439 PolarHBondContact O-N 2.93Å; E437-V439 VanDerWaalsContact C-N 3.34Å; E437-V439 PolarHBondContact O-N 2.99Å; V439-G441 VanDerWaalsContact C-N 3.29Å; V439-G441 PolarHBondContact O-N 3.32Å; V439-M442 WeakPolarHBondContact O-CA 3.05Å; V439-M442 PolarHBondContact O-N 3.27Å; V439-Y444 HydrophobicContact CG1-CE1 4.25Å; V439-A447 HydrophobicContact CG2-CB 3.88Å
440	K	93.3	Very high	94.4	Very high	187 Å²	187	49.9 Å²	49.9	81%	0.813	26%	0.262	S	S	*	.	H	α-helix	trans	-62.6	-36.6	175.9	-174.8	-179.5	178.6	-177.9	0	111.8	L436 E437 M442	L436-K440 WeakPolarHBondContact O-CB 3.37Å; L436-K440 PolarHBondContact O-N 3.22Å; E437-K440 WeakPolarHBondContact O-CB 3.39Å; E437-K440 PolarHBondContact O-N 2.72Å; K440-M442 PolarHBondContact O-N 3.37Å
441	G	88.6	Confident	94.4	Very high	38 Å²	38	46.5 Å²	46.5	39%	0.392	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	2.6	170.9	0	0	0	0	0	114.8	E437 L438 V439 H443	E437-G441 PolarHBondContact O-N 3.16Å; L438-G441 CarbonylContact O-C 3.55Å; L438-G441 PolarHBondContact O-N 3.26Å; V439-G441 VanDerWaalsContact C-N 3.29Å; V439-G441 PolarHBondContact O-N 3.32Å; G441-H443 PolarHBondContact O-CD2 2.81Å; G441-H443 PolarHBondContact O-N 2.99Å; G441-H443 PolarHBondContact O-NE2 3.05Å
442	M	88.8	Confident	94.5	Very high	119 Å²	119	46.6 Å²	46.6	59%	0.586	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	19.1	-175.2	-51.6	179.7	62	0	0	114.6	L438 V439 K440 Y444	L438-M442 PolarHBondContact O-N 3.33Å; V439-M442 WeakPolarHBondContact O-CA 3.05Å; V439-M442 PolarHBondContact O-N 3.27Å; K440-M442 PolarHBondContact O-N 3.37Å; M442-Y444 VanDerWaalsContact C-N 3.29Å; M442-Y444 HydrophobicContact CB-CE2 3.97Å; M442-Y444 WeakPolarHBondContact O-CD2 3.37Å; M442-Y444 WeakPolarHBondContact O-CE2 3.48Å; M442-Y444 PolarHBondContact O-N 3.31Å; M442-Y444 VanDerWaalsContact O-N 3.11Å
443	H	89.8	Confident	94.3	Very high	57 Å²	57	47.3 Å²	47.3	26%	0.264	24%	0.241	S	C	.	.			trans	-88.2	59.8	178.5	-59.6	-61.5	0	0	0	111.6	L438 G441 Q445 L446 A447	L438-H443 HydrophobicContact CB-CB 4.43Å; L438-H443 HydrophobicContact CD2-CB 4.34Å; L438-H443 PolarHBondContact O-N 3.23Å; G441-H443 PolarHBondContact O-CD2 2.81Å; G441-H443 PolarHBondContact O-N 2.99Å; G441-H443 PolarHBondContact O-NE2 3.05Å; H443-Q445 VanDerWaalsContact C-N 3.35Å; H443-Q445 PolarHBondContact O-N 3.39Å; H443-L446 HydrophobicContact CB-CB 4.12Å; H443-L446 HydrophobicContact CB-CD1 4.08Å; H443-L446 HydrophobicContact CB-CG 4.4Å; H443-L446 PolarHBondContact O-N 3.42Å; H443-A447 PolarHBondContact O-N 3.04Å
444	Y	94.3	Very high	94.2	Very high	26 Å²	26	46.1 Å²	46.1	10%	0.102	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-35.6	-169.5	-52	-57.5	0	0	0	114.8	I395 F410 R411 V439 M442 A447 C448	I395-Y444 HydrophobicContact CG2-CD2 3.96Å; I395-Y444 HydrophobicContact CG2-CE2 4.48Å; F410-Y444 HydrophobicContact CB-CD1 4.21Å; F410-Y444 WeakPolarHBondContact O-CD1 3.46Å; F410-Y444 VanDerWaalsContact O-CE1 3.23Å; F410-Y444 WeakPolarHBondContact O-CE1 3.12Å; R411-Y444 HydrophobicContact CB-CD1 4.12Å; R411-Y444 HydrophobicContact CB-CD2 4.15Å; R411-Y444 HydrophobicContact CB-CE1 4.22Å; R411-Y444 HydrophobicContact CB-CE2 4.26Å; R411-Y444 HydrophobicContact CB-CG 4.07Å; R411-Y444 WeakPolarHBondContact CD-OH 3.44Å; R411-Y444 HydrophobicContact CG-CE2 4.27Å; R411-Y444 PolarHBondContact NH1-OH 2.94Å; V439-Y444 HydrophobicContact CG1-CE1 4.25Å; M442-Y444 VanDerWaalsContact C-N 3.29Å; M442-Y444 HydrophobicContact CB-CE2 3.97Å; M442-Y444 WeakPolarHBondContact O-CD2 3.37Å; M442-Y444 WeakPolarHBondContact O-CE2 3.48Å; M442-Y444 PolarHBondContact O-N 3.31Å; M442-Y444 VanDerWaalsContact O-N 3.11Å; Y444-A447 PolarHBondContact O-N 2.78Å; Y444-C448 PolarHBondContact O-N 3.14Å; Y444-C448 VanDerWaalsContact O-N 3.08Å
445	Q	91.9	Very high	94.1	Very high	53 Å²	53	44.9 Å²	44.9	25%	0.248	23%	0.226	C	C	.	.	H	α-helix	trans	-71.1	-40.9	177.6	-67.4	169.4	-68.7	0	0	111.1	C391 I395 H443 A447 C448 Q449 L465	C391-Q445 HydrophobicContact CB-CG 3.97Å; I395-Q445 HydrophobicContact CD1-CG 3.96Å; H443-Q445 VanDerWaalsContact C-N 3.35Å; H443-Q445 PolarHBondContact O-N 3.39Å; Q445-A447 VanDerWaalsContact C-N 3.32Å; Q445-C448 CarbonylContact O-C 3.59Å; Q445-C448 WeakPolarHBondContact O-CB 3.5Å; Q445-C448 PolarHBondContact O-N 3.35Å; Q445-C448 VanDerWaalsContact O-N 3.17Å; Q445-Q449 PolarHBondContact O-N 3.37Å; Q445-L465 PolarHBondContact NE2-O 2.83Å
446	L	92.1	Very high	93.9	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-65.3	-36.9	173.9	-63.6	-179.7	0	0	0	111.3	N84 V87 L438 H443 C448 Q449 K450	N84-L446 HydrophobicContact CB-CD2 4.24Å; V87-L446 HydrophobicContact CB-CD1 3.78Å; V87-L446 HydrophobicContact CG1-CD1 3.71Å; V87-L446 HydrophobicContact CG2-CD1 4.27Å; L438-L446 HydrophobicContact CD1-CB 4.38Å; L438-L446 HydrophobicContact CD2-CB 4.33Å; H443-L446 HydrophobicContact CB-CB 4.12Å; H443-L446 HydrophobicContact CB-CD1 4.08Å; H443-L446 HydrophobicContact CB-CG 4.4Å; H443-L446 PolarHBondContact O-N 3.42Å; L446-C448 VanDerWaalsContact C-N 3.3Å; L446-C448 PolarHBondContact O-N 3.32Å; L446-Q449 CarbonylContact O-C 3.09Å; L446-Q449 WeakPolarHBondContact O-CB 3.4Å; L446-Q449 PolarHBondContact O-N 2.88Å; L446-Q449 VanDerWaalsContact O-N 3.16Å; L446-K450 WeakPolarHBondContact O-CB 3.44Å; L446-K450 PolarHBondContact O-N 3.01Å
447	A	96.3	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-41.8	171.9	0	0	0	0	0	111.7	F410 I435 L438 V439 H443 Y444 Q445 K450 Y451	F410-A447 HydrophobicContact CB-CB 4.35Å; F410-A447 HydrophobicContact CD1-CB 3.76Å; F410-A447 HydrophobicContact CE1-CB 4.29Å; F410-A447 HydrophobicContact CG-CB 4.08Å; I435-A447 HydrophobicContact CG2-CB 4.22Å; L438-A447 HydrophobicContact CB-CB 3.91Å; V439-A447 HydrophobicContact CG2-CB 3.88Å; H443-A447 PolarHBondContact O-N 3.04Å; Y444-A447 PolarHBondContact O-N 2.78Å; Q445-A447 VanDerWaalsContact C-N 3.32Å; A447-K450 PolarHBondContact O-N 3.17Å; A447-Y451 PolarHBondContact O-N 2.77Å
448	C	96.9	Very high	93.4	Very high	11 Å²	11	45.9 Å²	45.9	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-68.1	-33.1	174.5	-170.2	0	0	0	0	113	F410 Y444 Q445 L446 Y451 F452 L465	F410-C448 HydrophobicContact CD2-CB 3.75Å; F410-C448 VanDerWaalsContact CE2-CA 3.48Å; F410-C448 HydrophobicContact CE2-CB 3.41Å; F410-C448 VanDerWaalsContact CE2-CB 3.41Å; F410-C448 HydrophobicContact CZ-CB 4.15Å; Y444-C448 PolarHBondContact O-N 3.14Å; Y444-C448 VanDerWaalsContact O-N 3.08Å; Q445-C448 CarbonylContact O-C 3.59Å; Q445-C448 WeakPolarHBondContact O-CB 3.5Å; Q445-C448 PolarHBondContact O-N 3.35Å; Q445-C448 VanDerWaalsContact O-N 3.17Å; L446-C448 VanDerWaalsContact C-N 3.3Å; L446-C448 PolarHBondContact O-N 3.32Å; C448-Y451 WeakPolarHBondContact O-CB 3.35Å; C448-Y451 PolarHBondContact O-N 3.5Å; C448-F452 PolarHBondContact O-N 3.45Å; C448-L465 HydrophobicContact CB-CD2 3.68Å; C448-L465 WeakPolarHBondContact SG-CD2 3.17Å
449	Q	94.8	Very high	92.7	Very high	21 Å²	21	53.4 Å²	53.4	10%	0.098	27%	0.272	C	S	.	.	H	α-helix	trans	-70.4	-41.1	174.3	-173.4	165.8	-15.5	0	0	111.5	Q445 L446 Y451 F452 E453 T461 F463 L465	Q445-Q449 PolarHBondContact O-N 3.37Å; L446-Q449 CarbonylContact O-C 3.09Å; L446-Q449 WeakPolarHBondContact O-CB 3.4Å; L446-Q449 PolarHBondContact O-N 2.88Å; L446-Q449 VanDerWaalsContact O-N 3.16Å; Q449-Y451 VanDerWaalsContact C-N 3.3Å; Q449-Y451 PolarHBondContact O-N 3.3Å; Q449-F452 WeakPolarHBondContact O-CA 3.49Å; Q449-F452 VanDerWaalsContact O-CB 3.23Å; Q449-F452 WeakPolarHBondContact O-CB 3.35Å; Q449-F452 PolarHBondContact O-N 3.1Å; Q449-E453 WeakPolarHBondContact O-CG 3.37Å; Q449-E453 PolarHBondContact O-N 3.43Å; Q449-T461 HydrophobicContact CG-CG2 4.45Å; Q449-T461 VanDerWaalsContact CG-OG1 3.27Å; Q449-T461 WeakPolarHBondContact CG-OG1 3.32Å; Q449-T461 PolarHBondContact NE2-OG1 2.77Å; Q449-F463 PolarHBondContact NE2-O 2.92Å; Q449-L465 HydrophobicContact CB-CB 4.33Å
450	K	95.4	Very high	91.9	Very high	48 Å²	48	55.9 Å²	55.9	21%	0.209	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-40.6	171.1	-166.7	75.6	-144.5	159.2	0	111.7	Q434 I435 L438 L446 A447 F452 E453 L454	Q434-K450 VanDerWaalsContact OE1-CE 3.25Å; I435-K450 HydrophobicContact CG1-CB 4.04Å; I435-K450 HydrophobicContact CG1-CG 3.93Å; L438-K450 HydrophobicContact CD1-CB 3.9Å; L438-K450 HydrophobicContact CD1-CG 4.35Å; L446-K450 WeakPolarHBondContact O-CB 3.44Å; L446-K450 PolarHBondContact O-N 3.01Å; A447-K450 PolarHBondContact O-N 3.17Å; K450-F452 VanDerWaalsContact C-N 3.35Å; K450-E453 WeakPolarHBondContact CD-OE2 3.47Å; K450-E453 WeakPolarHBondContact CE-OE2 3.4Å; K450-E453 IonicContact NZ-OE2 3.95Å; K450-E453 PolarHBondContact NZ-OE2 2.96Å; K450-E453 PolarHBondContact O-N 3.01Å; K450-L454 HydrophobicContact CG-CD1 4.12Å; K450-L454 WeakPolarHBondContact O-CD1 3.44Å; K450-L454 VanDerWaalsContact O-CG 3.25Å; K450-L454 WeakPolarHBondContact O-CG 3.5Å; K450-L454 PolarHBondContact O-N 2.87Å
451	Y	96.4	Very high	91.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-44.5	171.5	173.2	-100	0	0	0	111.5	L310 R313 F410 L422 V427 A447 C448 Q449 E453 L454 T455 Y471	L310-Y451 HydrophobicContact CB-CE1 4.5Å; L310-Y451 HydrophobicContact CD1-CE2 4.44Å; R313-Y451 PolarHBondContact NH1-OH 3.33Å; F410-Y451 HydrophobicContact CZ-CG 4.18Å; L422-Y451 HydrophobicContact CD2-CD2 3.61Å; L422-Y451 HydrophobicContact CD2-CE2 3.95Å; V427-Y451 HydrophobicContact CG2-CD2 4.05Å; V427-Y451 HydrophobicContact CG2-CE2 4Å; A447-Y451 PolarHBondContact O-N 2.77Å; C448-Y451 WeakPolarHBondContact O-CB 3.35Å; C448-Y451 PolarHBondContact O-N 3.5Å; Q449-Y451 VanDerWaalsContact C-N 3.3Å; Q449-Y451 PolarHBondContact O-N 3.3Å; Y451-E453 PolarHBondContact O-N 3.41Å; Y451-L454 PolarHBondContact O-N 3.44Å; Y451-T455 HydrophobicContact CD2-CG2 3.94Å; Y451-T455 HydrophobicContact CE1-CG2 4.14Å; Y451-T455 HydrophobicContact CE2-CG2 3.5Å; Y451-T455 VanDerWaalsContact CE2-CG2 3.5Å; Y451-T455 HydrophobicContact CG-CG2 4.43Å; Y451-T455 WeakPolarHBondContact O-CG2 3.46Å; Y451-T455 PolarHBondContact O-N 2.69Å; Y451-T455 PolarHBondContact O-OG1 3.4Å; Y451-T455 VanDerWaalsContact O-OG1 3.09Å; Y451-Y471 HydrophobicContact CD1-CE2 4.32Å; Y451-Y471 WeakPolarHBondContact CD1-OH 3.4Å; Y451-Y471 VanDerWaalsContact CE1-OH 3.29Å; Y451-Y471 WeakPolarHBondContact CE1-OH 3.4Å
452	F	96	Very high	90.6	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-50.2	174.8	-177.5	-83.1	0	0	0	111.7	C448 Q449 K450 L454 T455 H456 V458 T461 F463 Y471 E474 V478	C448-F452 PolarHBondContact O-N 3.45Å; Q449-F452 WeakPolarHBondContact O-CA 3.49Å; Q449-F452 VanDerWaalsContact O-CB 3.23Å; Q449-F452 WeakPolarHBondContact O-CB 3.35Å; Q449-F452 PolarHBondContact O-N 3.1Å; K450-F452 VanDerWaalsContact C-N 3.35Å; F452-L454 VanDerWaalsContact C-N 3.34Å; F452-L454 PolarHBondContact O-N 3.43Å; F452-T455 PolarHBondContact O-N 3.46Å; F452-T455 PolarHBondContact O-OG1 3.11Å; F452-H456 AromaticContact CD1-ND1 3.87Å; F452-H456 AromaticContact CD2-CE1 3.5Å; F452-H456 AromaticContact CD2-ND1 3.59Å; F452-H456 HydrophobicContact CE1-CB 4.33Å; F452-H456 AromaticContact CE2-CE1 3.52Å; F452-H456 AromaticContact CE2-ND1 3.74Å; F452-H456 AromaticContact CE2-NE2 3.95Å; F452-H456 AromaticContact CG-ND1 3.65Å; F452-H456 AromaticContact CZ-ND1 3.94Å; F452-H456 WeakPolarHBondContact O-CB 3.37Å; F452-H456 PolarHBondContact O-N 3.39Å; F452-H456 PolarHBondContact O-ND1 3.38Å; F452-V458 HydrophobicContact CD1-CG2 4.12Å; F452-V458 HydrophobicContact CE1-CG2 4.04Å; F452-T461 HydrophobicContact CD1-CG2 3.51Å; F452-T461 HydrophobicContact CE1-CG2 3.8Å; F452-F463 HydrophobicContact CD1-CZ 4.43Å; F452-F463 HydrophobicContact CD2-CZ 4.41Å; F452-F463 HydrophobicContact CE1-CE1 4.15Å; F452-F463 HydrophobicContact CE1-CZ 4.35Å; F452-F463 HydrophobicContact CE2-CZ 4.32Å; F452-F463 HydrophobicContact CG-CZ 4.47Å; F452-F463 HydrophobicContact CZ-CE1 4.24Å; F452-F463 HydrophobicContact CZ-CZ 4.3Å; F452-Y471 HydrophobicContact CB-CD2 4.28Å; F452-Y471 HydrophobicContact CB-CE2 3.6Å; F452-Y471 HydrophobicContact CD2-CD1 4.14Å; F452-Y471 AromaticContact CD2-CD2 3.81Å; F452-Y471 HydrophobicContact CD2-CD2 3.81Å; F452-Y471 AromaticContact CD2-CE1 3.86Å; F452-Y471 HydrophobicContact CD2-CE1 3.86Å; F452-Y471 AromaticContact CD2-CE2 3.55Å; F452-Y471 HydrophobicContact CD2-CE2 3.55Å; F452-Y471 HydrophobicContact CD2-CG 4.1Å; F452-Y471 AromaticContact CD2-CZ 3.54Å; F452-Y471 HydrophobicContact CE2-CE1 4.41Å; F452-Y471 HydrophobicContact CG-CE2 4.06Å; F452-E474 HydrophobicContact CE2-CB 4.27Å; F452-E474 HydrophobicContact CZ-CB 4.13Å; F452-V478 HydrophobicContact CE1-CG2 4.32Å; F452-V478 HydrophobicContact CZ-CG2 4.08Å
453	E	94.4	Very high	90.2	Very high	20 Å²	20	47 Å²	47	9%	0.093	25%	0.248	C	C	.	.	H	α-helix	trans	-55	-49.9	179.3	-73.7	164.2	-167.4	0	0	111.6	Q449 K450 Y451 T455 H456 N457 V458 T461	Q449-E453 WeakPolarHBondContact O-CG 3.37Å; Q449-E453 PolarHBondContact O-N 3.43Å; K450-E453 WeakPolarHBondContact CD-OE2 3.47Å; K450-E453 WeakPolarHBondContact CE-OE2 3.4Å; K450-E453 IonicContact NZ-OE2 3.95Å; K450-E453 PolarHBondContact NZ-OE2 2.96Å; K450-E453 PolarHBondContact O-N 3.01Å; Y451-E453 PolarHBondContact O-N 3.41Å; E453-T455 PolarHBondContact O-N 3.12Å; E453-H456 PolarHBondContact O-N 3.5Å; E453-N457 WeakPolarHBondContact O-CA 3.42Å; E453-N457 PolarHBondContact O-N 3.38Å; E453-V458 WeakPolarHBondContact CA-O 3.2Å; E453-V458 HydrophobicContact CB-CG2 4.37Å; E453-V458 VanDerWaalsContact CB-O 3.31Å; E453-V458 WeakPolarHBondContact CB-O 3.18Å; E453-V458 HydrophobicContact CG-CG2 4.24Å; E453-V458 PolarHBondContact O-N 2.82Å; E453-T461 HydrophobicContact CG-CG2 3.85Å; E453-T461 PolarHBondContact OE1-OG1 3.13Å; E453-T461 VanDerWaalsContact OE1-OG1 3.11Å
454	L	94.6	Very high	89.8	Confident	51 Å²	51	47 Å²	47	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-68.4	-35.1	-177.7	-67.4	167.6	0	0	0	113	V427 I435 K450 Y451 F452 N457	V427-L454 HydrophobicContact CG1-CB 4.42Å; V427-L454 HydrophobicContact CG1-CD1 3.79Å; I435-L454 HydrophobicContact CD1-CD1 3.92Å; I435-L454 HydrophobicContact CG1-CD1 4.36Å; K450-L454 HydrophobicContact CG-CD1 4.12Å; K450-L454 WeakPolarHBondContact O-CD1 3.44Å; K450-L454 VanDerWaalsContact O-CG 3.25Å; K450-L454 WeakPolarHBondContact O-CG 3.5Å; K450-L454 PolarHBondContact O-N 2.87Å; Y451-L454 PolarHBondContact O-N 3.44Å; F452-L454 VanDerWaalsContact C-N 3.34Å; F452-L454 PolarHBondContact O-N 3.43Å; L454-N457 PolarHBondContact O-OD1 3.35Å
455	T	93.2	Very high	89.6	Confident	52 Å²	52	45.9 Å²	45.9	32%	0.319	25%	0.25	S	C	.	.	H	α-helix	trans	-84.7	-20.9	-179.7	59.8	0	0	0	0	113.9	V427 Y451 F452 E453	V427-T455 HydrophobicContact CG2-CG2 4.44Å; Y451-T455 HydrophobicContact CD2-CG2 3.94Å; Y451-T455 HydrophobicContact CE1-CG2 4.14Å; Y451-T455 HydrophobicContact CE2-CG2 3.5Å; Y451-T455 VanDerWaalsContact CE2-CG2 3.5Å; Y451-T455 HydrophobicContact CG-CG2 4.43Å; Y451-T455 WeakPolarHBondContact O-CG2 3.46Å; Y451-T455 PolarHBondContact O-N 2.69Å; Y451-T455 PolarHBondContact O-OG1 3.4Å; Y451-T455 VanDerWaalsContact O-OG1 3.09Å; F452-T455 PolarHBondContact O-N 3.46Å; F452-T455 PolarHBondContact O-OG1 3.11Å; E453-T455 PolarHBondContact O-N 3.12Å
456	H	93.1	Very high	89.3	Confident	21 Å²	21	44.2 Å²	44.2	10%	0.097	24%	0.244	C	C	.	.	H	α-helix	trans	-101.5	0.2	177.7	-64.7	85.5	0	0	0	113	K306 F452 E453 V458 S475 V478	K306-H456 PolarHBondContact O-NE2 3.49Å; F452-H456 AromaticContact CD1-ND1 3.87Å; F452-H456 AromaticContact CD2-CE1 3.5Å; F452-H456 AromaticContact CD2-ND1 3.59Å; F452-H456 HydrophobicContact CE1-CB 4.33Å; F452-H456 AromaticContact CE2-CE1 3.52Å; F452-H456 AromaticContact CE2-ND1 3.74Å; F452-H456 AromaticContact CE2-NE2 3.95Å; F452-H456 AromaticContact CG-ND1 3.65Å; F452-H456 AromaticContact CZ-ND1 3.94Å; F452-H456 WeakPolarHBondContact O-CB 3.37Å; F452-H456 PolarHBondContact O-N 3.39Å; F452-H456 PolarHBondContact O-ND1 3.38Å; E453-H456 PolarHBondContact O-N 3.5Å; H456-V458 VanDerWaalsContact C-N 3.25Å; H456-V458 HydrophobicContact CB-CG1 4.33Å; H456-V458 HydrophobicContact CB-CG2 4.27Å; H456-V458 PolarHBondContact O-N 3.4Å; H456-S475 VanDerWaalsContact NE2-CB 3.3Å; H456-S475 WeakPolarHBondContact NE2-CB 3.21Å; H456-S475 PolarHBondContact NE2-OG 3.27Å; H456-V478 HydrophobicContact CB-CG1 4.2Å
457	N	90.7	Very high	89.3	Confident	150 Å²	150	43.8 Å²	43.8	80%	0.802	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	44	-175	-62.3	-4	0	0	0	112.4	E453 L454	E453-N457 WeakPolarHBondContact O-CA 3.42Å; E453-N457 PolarHBondContact O-N 3.38Å; L454-N457 PolarHBondContact O-OD1 3.35Å
458	V	90.3	Very high	89.2	Confident	38 Å²	38	43.9 Å²	43.9	23%	0.23	24%	0.242	C	C	.	.			trans	-110	133.6	173.2	-62	0	0	0	0	109	F452 E453 H456 D460 T461 V478	F452-V458 HydrophobicContact CD1-CG2 4.12Å; F452-V458 HydrophobicContact CE1-CG2 4.04Å; E453-V458 WeakPolarHBondContact CA-O 3.2Å; E453-V458 HydrophobicContact CB-CG2 4.37Å; E453-V458 VanDerWaalsContact CB-O 3.31Å; E453-V458 WeakPolarHBondContact CB-O 3.18Å; E453-V458 HydrophobicContact CG-CG2 4.24Å; E453-V458 PolarHBondContact O-N 2.82Å; H456-V458 VanDerWaalsContact C-N 3.25Å; H456-V458 HydrophobicContact CB-CG1 4.33Å; H456-V458 HydrophobicContact CB-CG2 4.27Å; H456-V458 PolarHBondContact O-N 3.4Å; V458-D460 VanDerWaalsContact C-N 3.33Å; V458-T461 HydrophobicContact CG2-CG2 4.23Å; V458-V478 HydrophobicContact CG1-CG1 4.04Å
459	E	80.9	Confident	89	Confident	189 Å²	189	43.4 Å²	43.4	88%	0.883	24%	0.239	S	C	*	.	S	Bend	trans	-71.9	-32.3	-177.9	-66.6	-174.4	165.7	0	0	112.1
460	D	77.9	Confident	88.9	Confident	74 Å²	74	43.8 Å²	43.8	40%	0.396	24%	0.241	S	C	.	.			trans	-151.4	144.6	-174.2	-162	-3.9	0	0	0	111	Y89 K99 V458	Y89-D460 PolarHBondContact OH-OD1 2.98Å; Y89-D460 PolarHBondContact OH-OD2 2.97Å; K99-D460 WeakPolarHBondContact CE-OD2 3.3Å; K99-D460 IonicContact NZ-OD1 2.81Å; K99-D460 PolarHBondContact NZ-OD1 3.4Å; K99-D460 IonicContact NZ-OD2 3.69Å; K99-D460 PolarHBondContact NZ-OD2 2.97Å; V458-D460 VanDerWaalsContact C-N 3.33Å
461	T	79.8	Confident	88.9	Confident	10 Å²	10	41.6 Å²	41.6	6%	0.061	23%	0.231	C	C	.	.			trans	-105.9	131	-178.9	38.4	0	0	0	0	109.8	Q449 F452 E453 V458 F463	Q449-T461 HydrophobicContact CG-CG2 4.45Å; Q449-T461 VanDerWaalsContact CG-OG1 3.27Å; Q449-T461 WeakPolarHBondContact CG-OG1 3.32Å; Q449-T461 PolarHBondContact NE2-OG1 2.77Å; F452-T461 HydrophobicContact CD1-CG2 3.51Å; F452-T461 HydrophobicContact CE1-CG2 3.8Å; E453-T461 HydrophobicContact CG-CG2 3.85Å; E453-T461 PolarHBondContact OE1-OG1 3.13Å; E453-T461 VanDerWaalsContact OE1-OG1 3.11Å; V458-T461 HydrophobicContact CG2-CG2 4.23Å; T461-F463 HydrophobicContact CG2-CD1 4.44Å; T461-F463 HydrophobicContact CG2-CE1 3.78Å; T461-F463 HydrophobicContact CG2-CZ 4.25Å; T461-F463 PolarHBondContact O-N 2.7Å
462	S	74.6	Confident	88.7	Confident	123 Å²	123	41.5 Å²	41.5	86%	0.86	23%	0.231	S	C	*	.	S	Bend	trans	-77.8	1.5	-179.9	57.5	0	0	0	0	113.9
463	F	80.5	Confident	88.5	Confident	25 Å²	25	42.9 Å²	42.9	11%	0.11	24%	0.239	C	C	.	.	S	Bend	trans	-128	150.9	-175.1	69.2	-86	0	0	0	111.4	Q449 F452 T461 L465 Q470 E474	Q449-F463 PolarHBondContact NE2-O 2.92Å; F452-F463 HydrophobicContact CD1-CZ 4.43Å; F452-F463 HydrophobicContact CD2-CZ 4.41Å; F452-F463 HydrophobicContact CE1-CE1 4.15Å; F452-F463 HydrophobicContact CE1-CZ 4.35Å; F452-F463 HydrophobicContact CE2-CZ 4.32Å; F452-F463 HydrophobicContact CG-CZ 4.47Å; F452-F463 HydrophobicContact CZ-CE1 4.24Å; F452-F463 HydrophobicContact CZ-CZ 4.3Å; T461-F463 HydrophobicContact CG2-CD1 4.44Å; T461-F463 HydrophobicContact CG2-CE1 3.78Å; T461-F463 HydrophobicContact CG2-CZ 4.25Å; T461-F463 PolarHBondContact O-N 2.7Å; F463-L465 HydrophobicContact CD2-CB 4.39Å; F463-L465 HydrophobicContact CE2-CB 3.93Å; F463-L465 HydrophobicContact CE2-CD1 4.02Å; F463-Q470 HydrophobicContact CD2-CG 4.39Å; F463-E474 HydrophobicContact CD1-CB 4.07Å; F463-E474 HydrophobicContact CD1-CG 3.65Å; F463-E474 HydrophobicContact CD2-CG 4.15Å; F463-E474 HydrophobicContact CE1-CB 3.52Å; F463-E474 HydrophobicContact CE1-CG 3.61Å; F463-E474 HydrophobicContact CE2-CB 4.4Å; F463-E474 HydrophobicContact CE2-CG 4.11Å; F463-E474 HydrophobicContact CG-CG 3.94Å; F463-E474 HydrophobicContact CZ-CB 3.71Å; F463-E474 HydrophobicContact CZ-CG 3.85Å
464	S	82.1	Confident	88.4	Confident	56 Å²	56	43.5 Å²	43.5	39%	0.392	24%	0.242	S	C	.	.			trans	-90.4	116	167.8	177.9	0	0	0	0	109.1	N84 S466 Q470	N84-S464 PolarHBondContact ND2-OG 3.25Å; S464-S466 PolarHBondContact O-N 2.94Å; S464-Q470 PolarHBondContact O-NE2 3.35Å; S464-Q470 PolarHBondContact O-OE1 3.42Å
465	L	88.6	Confident	88.4	Confident	3 Å²	3	41 Å²	41	2%	0.016	23%	0.229	C	C	.	.			trans	-68	123.6	-177.4	179.4	63.5	0	0	0	111.2	Q445 C448 Q449 F463 H467 Q470 Y471	Q445-L465 PolarHBondContact NE2-O 2.83Å; C448-L465 HydrophobicContact CB-CD2 3.68Å; C448-L465 WeakPolarHBondContact SG-CD2 3.17Å; Q449-L465 HydrophobicContact CB-CB 4.33Å; F463-L465 HydrophobicContact CD2-CB 4.39Å; F463-L465 HydrophobicContact CE2-CB 3.93Å; F463-L465 HydrophobicContact CE2-CD1 4.02Å; L465-H467 WeakPolarHBondContact CD1-O 3.46Å; L465-Q470 HydrophobicContact CD1-CB 4.49Å; L465-Y471 HydrophobicContact CD1-CD2 4.39Å; L465-Y471 HydrophobicContact CD2-CD2 3.99Å
466	S	86.9	Confident	88.3	Confident	18 Å²	18	42.1 Å²	42.1	13%	0.126	23%	0.231	C	C	.	.			trans	-131.2	-17.2	-178.5	62.5	0	0	0	0	113.4	Y281 C391 S464 Q470	Y281-S466 WeakPolarHBondContact CD2-O 3.44Å; Y281-S466 WeakPolarHBondContact CE2-O 3.38Å; Y281-S466 WeakPolarHBondContact CE2-OG 3.34Å; Y281-S466 PolarHBondContact OH-OG 3.26Å; C391-S466 WeakPolarHBondContact CB-O 3.42Å; C391-S466 PolarHBondContact N-O 3.18Å; C391-S466 PolarHBondContact SG-O 3Å; C391-S466 VanDerWaalsContact SG-O 3.38Å; S464-S466 PolarHBondContact O-N 2.94Å; S466-Q470 PolarHBondContact OG-OE1 3.42Å
467	H	91.1	Very high	88.1	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.019	25%	0.246	C	C	.	.			trans	-145.7	143.6	-174	-160.6	-73.4	0	0	0	113.2	Y281 Y286 P388 Y389 S390 C391 L465 N469 Q470 Y471	Y281-H467 AromaticContact CE1-CD2 3.94Å; Y281-H467 HydrophobicContact CE2-CB 3.67Å; Y281-H467 AromaticContact CE2-CD2 3.99Å; Y281-H467 AromaticContact CZ-CD2 3.59Å; Y281-H467 AromaticContact CZ-CG 3.97Å; Y281-H467 WeakPolarHBondContact OH-CB 3.48Å; Y286-H467 HydrophobicContact CD2-CB 4.23Å; Y286-H467 AromaticContact CD2-CD2 3.6Å; Y286-H467 AromaticContact CD2-CE1 3.72Å; Y286-H467 AromaticContact CD2-CG 3.55Å; Y286-H467 AromaticContact CD2-ND1 3.57Å; Y286-H467 AromaticContact CD2-NE2 3.75Å; Y286-H467 HydrophobicContact CE2-CB 3.79Å; Y286-H467 AromaticContact CE2-CG 3.62Å; Y286-H467 AromaticContact CE2-ND1 3.83Å; P388-H467 PolarHBondContact O-NE2 2.92Å; Y389-H467 PolarHBondContact O-CE1 3.26Å; Y389-H467 PolarHBondContact O-NE2 3.31Å; S390-H467 VanDerWaalsContact CA-CD2 3.46Å; S390-H467 WeakPolarHBondContact CA-CD2 3.28Å; C391-H467 VanDerWaalsContact SG-CA 3.59Å; C391-H467 PolarHBondContact SG-N 2.99Å; L465-H467 WeakPolarHBondContact CD1-O 3.46Å; H467-N469 PolarHBondContact CE1-OD1 3.41Å; H467-N469 WeakPolarHBondContact ND1-CB 3.47Å; H467-N469 PolarHBondContact ND1-N 2.91Å; H467-N469 PolarHBondContact ND1-OD1 3.26Å; H467-N469 PolarHBondContact O-N 3.31Å; H467-Q470 HydrophobicContact CB-CB 4Å; H467-Q470 VanDerWaalsContact O-CB 3.28Å; H467-Q470 WeakPolarHBondContact O-CB 3.38Å; H467-Q470 PolarHBondContact O-N 2.81Å; H467-Q470 VanDerWaalsContact O-N 3.1Å; H467-Y471 PolarHBondContact O-N 3.38Å; H467-Y471 VanDerWaalsContact O-N 3.11Å
468	P	94.9	Very high	88.1	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.013	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-44.8	174.7	-27.8	37.1	0	0	0	114.1	P309 M312 F336 Y389 Q470 Y471 F472	P309-P468 HydrophobicContact CG-CB 3.88Å; M312-P468 HydrophobicContact CE-CB 3.54Å; M312-P468 HydrophobicContact CE-CG 3.49Å; M312-P468 VanDerWaalsContact CE-CG 3.49Å; M312-P468 HydrophobicContact CG-CB 4.16Å; F336-P468 HydrophobicContact CD2-CB 3.82Å; F336-P468 HydrophobicContact CE2-CB 4.09Å; Y389-P468 VanDerWaalsContact O-CD 3.23Å; Y389-P468 WeakPolarHBondContact O-CD 3.46Å; P468-Q470 VanDerWaalsContact C-N 3.29Å; P468-Q470 PolarHBondContact O-N 3.06Å; P468-Y471 VanDerWaalsContact O-CB 3.3Å; P468-Y471 WeakPolarHBondContact O-CB 3.42Å; P468-Y471 PolarHBondContact O-N 3.42Å; P468-F472 PolarHBondContact O-N 3.33Å; P468-F472 VanDerWaalsContact O-N 3.08Å
469	N	93.1	Very high	88	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-32.4	173.3	-63.8	81.3	0	0	0	113.7	Y286 F336 G339 I340 H467 F472 T473	Y286-N469 HydrophobicContact CD1-CB 3.27Å; Y286-N469 HydrophobicContact CD2-CB 4.14Å; Y286-N469 HydrophobicContact CE1-CB 3.41Å; Y286-N469 VanDerWaalsContact CE1-CB 3.41Å; Y286-N469 HydrophobicContact CE2-CB 4.27Å; Y286-N469 HydrophobicContact CG-CB 3.69Å; F336-N469 WeakPolarHBondContact CD2-OD1 3.41Å; F336-N469 PolarHBondContact O-ND2 3.35Å; G339-N469 VanDerWaalsContact CA-ND2 3.34Å; G339-N469 WeakPolarHBondContact CA-ND2 3.33Å; G339-N469 PolarHBondContact O-ND2 3.47Å; I340-N469 VanDerWaalsContact CG2-ND2 3.27Å; I340-N469 WeakPolarHBondContact CG2-ND2 3.19Å; I340-N469 PolarHBondContact N-ND2 3.42Å; I340-N469 VanDerWaalsContact N-ND2 3.18Å; H467-N469 PolarHBondContact CE1-OD1 3.41Å; H467-N469 WeakPolarHBondContact ND1-CB 3.47Å; H467-N469 PolarHBondContact ND1-N 2.91Å; H467-N469 PolarHBondContact ND1-OD1 3.26Å; H467-N469 PolarHBondContact O-N 3.31Å; N469-F472 WeakPolarHBondContact O-CB 3.42Å; N469-F472 PolarHBondContact O-N 3.47Å; N469-T473 PolarHBondContact O-N 3.34Å; N469-T473 PolarHBondContact O-OG1 2.93Å; N469-T473 VanDerWaalsContact O-OG1 3.11Å
470	Q	92	Very high	87.9	Confident	29 Å²	29	37.4 Å²	37.4	14%	0.136	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-47.5	171.9	-171.3	-171.9	10.6	0	0	111	Y286 F463 S464 L465 S466 H467 P468 F472 T473 E474	Y286-Q470 HydrophobicContact CE2-CB 4.32Å; Y286-Q470 WeakPolarHBondContact OH-CA 3.14Å; Y286-Q470 WeakPolarHBondContact OH-CB 3.33Å; Y286-Q470 PolarHBondContact OH-N 3.02Å; F463-Q470 HydrophobicContact CD2-CG 4.39Å; S464-Q470 PolarHBondContact O-NE2 3.35Å; S464-Q470 PolarHBondContact O-OE1 3.42Å; L465-Q470 HydrophobicContact CD1-CB 4.49Å; S466-Q470 PolarHBondContact OG-OE1 3.42Å; H467-Q470 HydrophobicContact CB-CB 4Å; H467-Q470 VanDerWaalsContact O-CB 3.28Å; H467-Q470 WeakPolarHBondContact O-CB 3.38Å; H467-Q470 PolarHBondContact O-N 2.81Å; H467-Q470 VanDerWaalsContact O-N 3.1Å; P468-Q470 VanDerWaalsContact C-N 3.29Å; P468-Q470 PolarHBondContact O-N 3.06Å; Q470-F472 PolarHBondContact O-N 3.3Å; Q470-T473 PolarHBondContact O-N 3.05Å; Q470-E474 HydrophobicContact CG-CG 4.37Å; Q470-E474 WeakPolarHBondContact O-CG 3.07Å; Q470-E474 PolarHBondContact O-N 3.27Å
471	Y	94.8	Very high	87.2	Confident	2 Å²	2	37 Å²	37	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-52.3	-46.7	174.3	-175.9	-72.1	0	0	0	110.9	S307 P309 Y451 F452 L465 H467 P468 E474 S475	S307-Y471 WeakPolarHBondContact O-CD1 3.17Å; S307-Y471 WeakPolarHBondContact O-CE1 3.46Å; P309-Y471 HydrophobicContact CB-CD1 3.86Å; P309-Y471 HydrophobicContact CB-CD2 3.78Å; P309-Y471 HydrophobicContact CB-CE1 4.22Å; P309-Y471 HydrophobicContact CB-CE2 4.08Å; P309-Y471 HydrophobicContact CB-CG 3.66Å; P309-Y471 HydrophobicContact CG-CD1 4.2Å; P309-Y471 HydrophobicContact CG-CG 4.14Å; Y451-Y471 HydrophobicContact CD1-CE2 4.32Å; Y451-Y471 WeakPolarHBondContact CD1-OH 3.4Å; Y451-Y471 VanDerWaalsContact CE1-OH 3.29Å; Y451-Y471 WeakPolarHBondContact CE1-OH 3.4Å; F452-Y471 HydrophobicContact CB-CD2 4.28Å; F452-Y471 HydrophobicContact CB-CE2 3.6Å; F452-Y471 HydrophobicContact CD2-CD1 4.14Å; F452-Y471 AromaticContact CD2-CD2 3.81Å; F452-Y471 HydrophobicContact CD2-CD2 3.81Å; F452-Y471 AromaticContact CD2-CE1 3.86Å; F452-Y471 HydrophobicContact CD2-CE1 3.86Å; F452-Y471 AromaticContact CD2-CE2 3.55Å; F452-Y471 HydrophobicContact CD2-CE2 3.55Å; F452-Y471 HydrophobicContact CD2-CG 4.1Å; F452-Y471 AromaticContact CD2-CZ 3.54Å; F452-Y471 HydrophobicContact CE2-CE1 4.41Å; F452-Y471 HydrophobicContact CG-CE2 4.06Å; L465-Y471 HydrophobicContact CD1-CD2 4.39Å; L465-Y471 HydrophobicContact CD2-CD2 3.99Å; H467-Y471 PolarHBondContact O-N 3.38Å; H467-Y471 VanDerWaalsContact O-N 3.11Å; P468-Y471 VanDerWaalsContact O-CB 3.3Å; P468-Y471 WeakPolarHBondContact O-CB 3.42Å; P468-Y471 PolarHBondContact O-N 3.42Å; Y471-E474 PolarHBondContact O-N 2.99Å; Y471-S475 VanDerWaalsContact O-CB 3.3Å; Y471-S475 WeakPolarHBondContact O-CB 3.25Å; Y471-S475 PolarHBondContact O-N 3.33Å
472	F	94.3	Very high	86	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-50.5	179.5	176.1	-97.6	0	0	0	112	V292 I295 L303 F308 F336 I340 P468 N469 Q470 E474 S475 Q476	V292-F472 HydrophobicContact CG1-CE1 4.07Å; I295-F472 HydrophobicContact CD1-CE1 3.79Å; I295-F472 HydrophobicContact CD1-CE2 4.43Å; I295-F472 HydrophobicContact CD1-CZ 3.45Å; I295-F472 VanDerWaalsContact CD1-CZ 3.45Å; L303-F472 HydrophobicContact CB-CE2 4.32Å; L303-F472 HydrophobicContact CD1-CE2 4.16Å; L303-F472 HydrophobicContact CD1-CZ 4.16Å; L303-F472 HydrophobicContact CD2-CE2 4.11Å; L303-F472 HydrophobicContact CD2-CZ 4.41Å; L303-F472 HydrophobicContact CG-CE2 4.43Å; F308-F472 AromaticContact CD1-CD2 3.88Å; F308-F472 HydrophobicContact CD1-CD2 3.88Å; F308-F472 HydrophobicContact CD1-CE2 4.25Å; F308-F472 AromaticContact CE1-CD2 3.94Å; F308-F472 HydrophobicContact CE1-CD2 3.94Å; F308-F472 AromaticContact CE1-CE2 3.94Å; F308-F472 HydrophobicContact CE1-CE2 3.94Å; F336-F472 HydrophobicContact CE2-CB 4.14Å; F336-F472 HydrophobicContact CZ-CB 4.12Å; F336-F472 HydrophobicContact CZ-CG 4.46Å; I340-F472 HydrophobicContact CB-CD1 3.84Å; I340-F472 HydrophobicContact CB-CE1 3.78Å; I340-F472 HydrophobicContact CB-CG 4.43Å; I340-F472 HydrophobicContact CB-CZ 4.33Å; I340-F472 HydrophobicContact CG2-CB 4.04Å; I340-F472 HydrophobicContact CG2-CD1 3.36Å; I340-F472 HydrophobicContact CG2-CD2 4.25Å; I340-F472 HydrophobicContact CG2-CE1 3.85Å; I340-F472 HydrophobicContact CG2-CG 3.6Å; I340-F472 HydrophobicContact CG2-CZ 4.46Å; P468-F472 PolarHBondContact O-N 3.33Å; P468-F472 VanDerWaalsContact O-N 3.08Å; N469-F472 WeakPolarHBondContact O-CB 3.42Å; N469-F472 PolarHBondContact O-N 3.47Å; Q470-F472 PolarHBondContact O-N 3.3Å; F472-E474 VanDerWaalsContact C-N 3.34Å; F472-E474 PolarHBondContact O-N 3.17Å; F472-S475 WeakPolarHBondContact O-CB 3.23Å; F472-S475 PolarHBondContact O-N 3.07Å; F472-Q476 HydrophobicContact CD1-CG 4.25Å; F472-Q476 HydrophobicContact CD2-CG 4.38Å; F472-Q476 HydrophobicContact CE1-CG 3.76Å; F472-Q476 HydrophobicContact CE2-CG 3.91Å; F472-Q476 HydrophobicContact CZ-CG 3.57Å; F472-Q476 WeakPolarHBondContact O-CG 3.47Å; F472-Q476 PolarHBondContact O-N 2.88Å
473	T	91.5	Very high	84.1	Confident	30 Å²	30	41.9 Å²	41.9	18%	0.184	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-45.3	179	-58.3	0	0	0	0	111.8	N469 Q470 Q476 K477	N469-T473 PolarHBondContact O-N 3.34Å; N469-T473 PolarHBondContact O-OG1 2.93Å; N469-T473 VanDerWaalsContact O-OG1 3.11Å; Q470-T473 PolarHBondContact O-N 3.05Å; T473-Q476 PolarHBondContact O-N 3.37Å; T473-K477 WeakPolarHBondContact O-CG 3.49Å; T473-K477 PolarHBondContact O-N 3.44Å
474	E	91.9	Very high	82.1	Confident	33 Å²	33	47.6 Å²	47.6	15%	0.154	29%	0.287	C	S	.	.	H	α-helix	trans	-67.9	-37.3	178.8	-63.4	-55.2	136.8	0	0	111.9	F452 F463 Q470 Y471 F472 Q476 K477 V478	F452-E474 HydrophobicContact CE2-CB 4.27Å; F452-E474 HydrophobicContact CZ-CB 4.13Å; F463-E474 HydrophobicContact CD1-CB 4.07Å; F463-E474 HydrophobicContact CD1-CG 3.65Å; F463-E474 HydrophobicContact CD2-CG 4.15Å; F463-E474 HydrophobicContact CE1-CB 3.52Å; F463-E474 HydrophobicContact CE1-CG 3.61Å; F463-E474 HydrophobicContact CE2-CB 4.4Å; F463-E474 HydrophobicContact CE2-CG 4.11Å; F463-E474 HydrophobicContact CG-CG 3.94Å; F463-E474 HydrophobicContact CZ-CB 3.71Å; F463-E474 HydrophobicContact CZ-CG 3.85Å; Q470-E474 HydrophobicContact CG-CG 4.37Å; Q470-E474 WeakPolarHBondContact O-CG 3.07Å; Q470-E474 PolarHBondContact O-N 3.27Å; Y471-E474 PolarHBondContact O-N 2.99Å; F472-E474 VanDerWaalsContact C-N 3.34Å; F472-E474 PolarHBondContact O-N 3.17Å; E474-Q476 PolarHBondContact O-N 3.39Å; E474-K477 PolarHBondContact O-N 3.3Å; E474-K477 IonicContact OE1-NZ 3.78Å; E474-K477 PolarHBondContact OE1-NZ 2.62Å; E474-K477 IonicContact OE2-NZ 3.68Å; E474-V478 WeakPolarHBondContact O-CG2 3.49Å; E474-V478 PolarHBondContact O-N 3.42Å
475	S	93.7	Very high	79.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-46.5	172.7	174.3	0	0	0	0	111.4	K306 S307 H456 Y471 F472 K477 V478 L479	K306-S475 PolarHBondContact O-OG 3.48Å; S307-S475 WeakPolarHBondContact CA-OG 3.25Å; S307-S475 WeakPolarHBondContact CB-OG 3.3Å; S307-S475 PolarHBondContact OG-OG 3.16Å; H456-S475 VanDerWaalsContact NE2-CB 3.3Å; H456-S475 WeakPolarHBondContact NE2-CB 3.21Å; H456-S475 PolarHBondContact NE2-OG 3.27Å; Y471-S475 VanDerWaalsContact O-CB 3.3Å; Y471-S475 WeakPolarHBondContact O-CB 3.25Å; Y471-S475 PolarHBondContact O-N 3.33Å; F472-S475 WeakPolarHBondContact O-CB 3.23Å; F472-S475 PolarHBondContact O-N 3.07Å; S475-K477 VanDerWaalsContact C-N 3.31Å; S475-K477 PolarHBondContact O-N 2.68Å; S475-V478 PolarHBondContact O-N 2.9Å; S475-L479 WeakPolarHBondContact O-CB 3.31Å; S475-L479 WeakPolarHBondContact O-CG 3.1Å; S475-L479 PolarHBondContact O-N 3.47Å
476	Q	91.4	Very high	77.2	Confident	75 Å²	75	59.8 Å²	59.8	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-37.3	178.3	-70	-67.3	-74.6	0	0	112	L303 S307 F472 T473 E474 G480	L303-Q476 VanDerWaalsContact CD2-NE2 3.31Å; S307-Q476 PolarHBondContact OG-NE2 3.06Å; F472-Q476 HydrophobicContact CD1-CG 4.25Å; F472-Q476 HydrophobicContact CD2-CG 4.38Å; F472-Q476 HydrophobicContact CE1-CG 3.76Å; F472-Q476 HydrophobicContact CE2-CG 3.91Å; F472-Q476 HydrophobicContact CZ-CG 3.57Å; F472-Q476 WeakPolarHBondContact O-CG 3.47Å; F472-Q476 PolarHBondContact O-N 2.88Å; T473-Q476 PolarHBondContact O-N 3.37Å; E474-Q476 PolarHBondContact O-N 3.39Å; Q476-G480 WeakPolarHBondContact O-CA 3.12Å; Q476-G480 PolarHBondContact O-N 2.79Å
477	K	89.8	Confident	74.8	Confident	97 Å²	97	70 Å²	70	42%	0.422	38%	0.379	S	S	.	.	H	α-helix	trans	-62.9	-44.1	174.5	-73.1	172.4	-178.5	171.8	0	112.4	T473 E474 S475 G482	T473-K477 WeakPolarHBondContact O-CG 3.49Å; T473-K477 PolarHBondContact O-N 3.44Å; E474-K477 PolarHBondContact O-N 3.3Å; E474-K477 IonicContact OE1-NZ 3.78Å; E474-K477 PolarHBondContact OE1-NZ 2.62Å; E474-K477 IonicContact OE2-NZ 3.68Å; S475-K477 VanDerWaalsContact C-N 3.31Å; S475-K477 PolarHBondContact O-N 2.68Å; K477-G482 PolarHBondContact O-N 2.93Å; K477-G482 VanDerWaalsContact O-N 3.09Å
478	V	90.8	Very high	71.6	Confident	60 Å²	60	79 Å²	79	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-65.6	-47.7	178.9	174.2	0	0	0	0	110.6	F452 H456 V458 E474 S475 G480 G481	F452-V478 HydrophobicContact CE1-CG2 4.32Å; F452-V478 HydrophobicContact CZ-CG2 4.08Å; H456-V478 HydrophobicContact CB-CG1 4.2Å; V458-V478 HydrophobicContact CG1-CG1 4.04Å; E474-V478 WeakPolarHBondContact O-CG2 3.49Å; E474-V478 PolarHBondContact O-N 3.42Å; S475-V478 PolarHBondContact O-N 2.9Å; V478-G480 PolarHBondContact O-N 3.37Å; V478-G481 PolarHBondContact O-N 3.49Å
479	L	86.8	Confident	68.5	Low	94 Å²	94	84.6 Å²	84.6	49%	0.492	46%	0.456	S	S	.	.	H	α-helix	trans	-72.4	-27.8	-178.6	-64.2	175.3	0	0	0	113.3	K306 S307 S475 G481	K306-L479 HydrophobicContact CB-CD1 4.05Å; S307-L479 WeakPolarHBondContact OG-CD1 3.34Å; S475-L479 WeakPolarHBondContact O-CB 3.31Å; S475-L479 WeakPolarHBondContact O-CG 3.1Å; S475-L479 PolarHBondContact O-N 3.47Å; L479-G481 VanDerWaalsContact C-N 3.25Å; L479-G481 PolarHBondContact O-N 2.97Å
480	G	79.6	Confident	65.3	Low	47 Å²	47	91.8 Å²	91.8	49%	0.485	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.9	176.2	0	0	0	0	0	114.8	Q476 V478 G482	Q476-G480 WeakPolarHBondContact O-CA 3.12Å; Q476-G480 PolarHBondContact O-N 2.79Å; V478-G480 PolarHBondContact O-N 3.37Å; G480-G482 VanDerWaalsContact C-N 3.34Å; G480-G482 PolarHBondContact O-N 3.33Å
481	G	62.6	Low	62.3	Low	65 Å²	65	96.5 Å²	96.5	67%	0.67	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	28.9	178.9	0	0	0	0	0	114.1	V478 L479 K483	V478-G481 PolarHBondContact O-N 3.49Å; L479-G481 VanDerWaalsContact C-N 3.25Å; L479-G481 PolarHBondContact O-N 2.97Å; G481-K483 PolarHBondContact O-N 2.78Å; G481-K483 VanDerWaalsContact O-N 3.16Å
482	G	54.3	Low	59.2	Low	65 Å²	65	104 Å²	104	67%	0.67	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.6	6.6	177.7	0	0	0	0	0	115.7	K477 G480 D484	K477-G482 PolarHBondContact O-N 2.93Å; K477-G482 VanDerWaalsContact O-N 3.09Å; G480-G482 VanDerWaalsContact C-N 3.34Å; G480-G482 PolarHBondContact O-N 3.33Å; G482-D484 PolarHBondContact O-N 2.98Å
483	K	35.4	Very low	55.9	Low	171 Å²	171	112.4 Å²	112.4	74%	0.743	60%	0.604	S	S	*	*			trans	-80.8	112.7	168.5	-72	-178.7	-178.9	172.6	0	108.2	G481 V485	G481-K483 PolarHBondContact O-N 2.78Å; G481-K483 VanDerWaalsContact O-N 3.16Å; K483-V485 PolarHBondContact O-N 3.48Å
484	D	37.8	Very low	52.7	Low	145 Å²	145	122.6 Å²	122.6	78%	0.775	64%	0.639	S	S	*	*			trans	-45.7	127.4	157	-76.5	-43.4	0	0	0	107.8	G482 K486	G482-D484 PolarHBondContact O-N 2.98Å; D484-K486 PolarHBondContact O-N 3.3Å
485	V	36.7	Very low	49.6	Very low	125 Å²	125	127 Å²	127	76%	0.758	67%	0.67	S	S	*	*			trans	-46.8	115.5	177.3	176.2	0	0	0	0	107.7	K483 R487	K483-V485 PolarHBondContact O-N 3.48Å; V485-R487 PolarHBondContact O-N 3.06Å; V485-R487 VanDerWaalsContact O-N 3.14Å
486	K	30.9	Very low	46.4	Very low	190 Å²	190	136.1 Å²	136.1	83%	0.826	71%	0.713	S	S	*	*			trans	-48.9	121.5	-174.4	-94.9	-179.6	169.7	-175.6	0	110	D484 E488	D484-K486 PolarHBondContact O-N 3.3Å; K486-E488 PolarHBondContact O-N 2.82Å
487	R	37.1	Very low	43.2	Very low	234 Å²	234	141.9 Å²	141.9	88%	0.883	74%	0.74	S	S	*	*			trans	-62.2	110	166.7	-69.7	173.9	176.1	172.4	-1.3	108.9	V485	V485-R487 PolarHBondContact O-N 3.06Å; V485-R487 VanDerWaalsContact O-N 3.14Å
488	E	25.3	Very low	40.1	Very low	192 Å²	192	142.9 Å²	142.9	90%	0.897	76%	0.759	S	S	*	*			trans	-90.4	99.4	155.1	-80	-178.2	166.1	0	0	107.3	K486 D490	K486-E488 PolarHBondContact O-N 2.82Å; E488-D490 PolarHBondContact O-N 3.09Å
489	T	27.8	Very low	37	Very low	120 Å²	120	145.7 Å²	145.7	74%	0.736	78%	0.781	S	S	*	*			trans	-73.7	101.7	163.1	38.9	0	0	0	0	107.6	T491	T489-T491 PolarHBondContact O-N 2.85Å
490	D	27.6	Very low	34	Very low	151 Å²	151	146.1 Å²	146.1	81%	0.807	80%	0.799	S	S	*	*			trans	-63.2	119.6	167.3	-124.8	-18.8	0	0	0	108.6	E488 L492	E488-D490 PolarHBondContact O-N 3.09Å; D490-L492 PolarHBondContact O-N 3.16Å
491	T	27.4	Very low	31.5	Very low	129 Å²	129	148.5 Å²	148.5	79%	0.791	81%	0.813	S	S	*	*			trans	-81.1	85.3	-176.9	-46.3	0	0	0	0	107.4	T489 Q493	T489-T491 PolarHBondContact O-N 2.85Å; T491-Q493 PolarHBondContact O-N 3.45Å
492	L	29.7	Very low	29.8	Very low	160 Å²	160	157.2 Å²	157.2	84%	0.838	83%	0.826	S	S	*	*			trans	-83.4	112.1	171.1	-79.6	166.9	0	0	0	109.9	D490	D490-L492 PolarHBondContact O-N 3.16Å
493	Q	26.8	Very low	28.3	Very low	178 Å²	178	157.4 Å²	157.4	83%	0.832	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-52.2	134.6	175	-67.5	168.4	-16	0	0	111.3	T491 P495	T491-Q493 PolarHBondContact O-N 3.45Å; Q493-P495 WeakPolarHBondContact O-CD 3.49Å
494	R	24.2	Very low	27.9	Very low	243 Å²	243	157 Å²	157	92%	0.917	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-48.7	132.9	164.4	-89.1	171.9	149.7	-179.2	-7.4	111.1
495	P	26.7	Very low	27.3	Very low	126 Å²	126	156.3 Å²	156.3	82%	0.818	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-92.1	132	150.5	-3.6	23.4	0	0	0	109.7	Q493	Q493-P495 WeakPolarHBondContact O-CD 3.49Å
496	Q	26.2	Very low	26.8	Very low	191 Å²	191	155.2 Å²	155.2	89%	0.893	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-58.7	146.9	175	-73	169.3	-59.1	0	0	112.6
497	E	23.5	Very low	26.5	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-59.8	130.9	163.9	-67.7	169.7	150.7	0	0	110.9
498	S	24.5	Very low	26	Very low	118 Å²	118	152 Å²	152	83%	0.825	85%	0.845	S	S	*	*			trans	-148.5	139.2	146.6	73.5	0	0	0	0	110.4
499	S	25.7	Very low	26.1	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	84%	0.843	S	S	*	*			trans	-73.8	139.8	-174.3	51.6	0	0	0	0	114.2
500	A	24.9	Very low	26.2	Very low	104 Å²	104	151.3 Å²	151.3	86%	0.86	84%	0.843	S	S	*	*			trans	-171	127.1	136	0	0	0	0	0	111.6
501	A	27	Very low	26.3	Very low	96 Å²	96	149.1 Å²	149.1	79%	0.793	85%	0.846	S	S	*	*			trans	-85.6	140.5	168.6	0	0	0	0	0	111
502	R	26	Very low	26.5	Very low	249 Å²	249	149.5 Å²	149.5	94%	0.94	85%	0.848	S	S	*	*			trans	-178.8	128.9	141.7	-102	167.1	-177	-168.5	1	109.8
503	G	23.5	Very low	26.7	Very low	69 Å²	69	147.2 Å²	147.2	71%	0.711	84%	0.836	S	S	*	*			trans	-86.3	178.3	-177.3	0	0	0	0	0	114.5
504	L	26.8	Very low	27	Very low	161 Å²	161	146.3 Å²	146.3	84%	0.843	83%	0.832	S	S	*	*			trans	-178.2	121.4	147	-97	152.6	0	0	0	111.9
505	T	24.5	Very low	27.5	Very low	131 Å²	131	139 Å²	139	80%	0.804	82%	0.818	S	S	*	*			trans	51.7	139.8	137	50.4	0	0	0	0	124.8
506	A	27.6	Very low	27.8	Very low	102 Å²	102	140.2 Å²	140.2	84%	0.843	81%	0.813	S	S	*	*			trans	-76.9	160.9	179.7	0	0	0	0	0	115.8
507	A	23.6	Very low	28.3	Very low	112 Å²	112	137 Å²	137	93%	0.926	80%	0.798	S	S	*	*			trans	-145.7	141.7	151.2	0	0	0	0	0	109.9
508	R	25.9	Very low	28.8	Very low	244 Å²	244	133 Å²	133	92%	0.921	78%	0.783	S	S	*	*			trans	-127.8	145.4	-171.9	-154	-174.1	-172.3	-173.3	0.5	107.4
509	E	27.1	Very low	29.2	Very low	184 Å²	184	130.8 Å²	130.8	86%	0.86	77%	0.771	S	S	*	*			trans	153.2	161.5	145.9	-90	-178.8	-170.7	0	0	112.8
510	P	31.9	Very low	29.7	Very low	115 Å²	115	131.4 Å²	131.4	75%	0.747	76%	0.761	S	S	*	*			cis	-126.8	171.9	-34.6	33.1	-14.7	0	0	0	113.2
511	A	28.3	Very low	30.4	Very low	104 Å²	104	130.1 Å²	130.1	86%	0.86	74%	0.738	S	S	*	*			trans	-83.9	145.6	-176	0	0	0	0	0	113.6
512	V	32.8	Very low	30.9	Very low	138 Å²	138	129.4 Å²	129.4	84%	0.836	72%	0.724	S	S	*	*			trans	-111.7	137.1	174.7	-177.9	0	0	0	0	109.6	E514	V512-E514 PolarHBondContact O-N 3.11Å
513	D	32.9	Very low	31.3	Very low	111 Å²	111	125 Å²	125	59%	0.594	71%	0.712	S	S	*	*			trans	-59.9	115.5	-171.3	-173.9	5.4	0	0	0	114.3	S515	D513-S515 VanDerWaalsContact C-N 3.34Å; D513-S515 PolarHBondContact O-N 3.45Å; D513-S515 PolarHBondContact OD1-N 3.34Å
514	E	34	Very low	31.9	Very low	160 Å²	160	126.5 Å²	126.5	75%	0.748	70%	0.704	S	S	*	*	H	α-helix	trans	-77.2	-10.4	-174.1	-75.6	-180	148	0	0	114.4	V512 L518	V512-E514 PolarHBondContact O-N 3.11Å; E514-L518 WeakPolarHBondContact O-CD1 3.48Å
515	S	33.9	Very low	32.3	Very low	89 Å²	89	123.7 Å²	123.7	62%	0.622	69%	0.689	S	S	*	*	H	α-helix	trans	-77.8	-35.8	-171.4	-170	0	0	0	0	113.4	D513	D513-S515 VanDerWaalsContact C-N 3.34Å; D513-S515 PolarHBondContact O-N 3.45Å; D513-S515 PolarHBondContact OD1-N 3.34Å
516	Q	33.3	Very low	32.7	Very low	151 Å²	151	123.9 Å²	123.9	71%	0.706	68%	0.681	S	S	*	*	H	α-helix	trans	-76.1	-29.4	-179.2	-70	-177.5	-11.7	0	0	112.6
517	H	36.2	Very low	33.1	Very low	124 Å²	124	123 Å²	123	57%	0.574	67%	0.665	S	S	*	*	H	α-helix	trans	-72.2	-31.7	179.9	-165	-96.9	0	0	0	112.6	I521	H517-I521 WeakPolarHBondContact ND1-CD1 3.09Å; H517-I521 WeakPolarHBondContact O-CD1 3.37Å; H517-I521 WeakPolarHBondContact O-CG1 3.34Å; H517-I521 PolarHBondContact O-N 3.4Å
518	L	34.3	Very low	33.9	Very low	114 Å²	114	123.6 Å²	123.6	60%	0.597	65%	0.653	S	S	*	*	H	α-helix	trans	-70.6	-33.8	176.6	-102	99.9	0	0	0	113.6	E514 E520 I521 T522	E514-L518 WeakPolarHBondContact O-CD1 3.48Å; L518-E520 VanDerWaalsContact C-N 3.32Å; L518-I521 PolarHBondContact O-N 3.19Å; L518-T522 PolarHBondContact O-N 3.42Å; L518-T522 PolarHBondContact O-OG1 3.29Å
519	A	33.3	Very low	34.3	Very low	70 Å²	70	120.7 Å²	120.7	58%	0.579	65%	0.647	S	S	*	*	H	α-helix	trans	-68.2	-35	178.7	0	0	0	0	0	111.7
520	E	36	Very low	34.4	Very low	131 Å²	131	119.9 Å²	119.9	61%	0.612	64%	0.643	S	S	*	*	H	α-helix	trans	-75.6	-33.2	178.3	-149.9	165.5	-159.8	0	0	112.3	L518 T522 N524	L518-E520 VanDerWaalsContact C-N 3.32Å; E520-T522 PolarHBondContact O-N 3.45Å; E520-N524 PolarHBondContact O-N 2.61Å; E520-N524 PolarHBondContact O-ND2 2.84Å
521	I	39.8	Very low	34.7	Very low	77 Å²	77	121.9 Å²	121.9	40%	0.395	65%	0.648	S	S	.	*	H	α-helix	trans	-62.6	-40	173.1	-72.6	165	0	0	0	112	H517 L518 L525	H517-I521 WeakPolarHBondContact ND1-CD1 3.09Å; H517-I521 WeakPolarHBondContact O-CD1 3.37Å; H517-I521 WeakPolarHBondContact O-CG1 3.34Å; H517-I521 PolarHBondContact O-N 3.4Å; L518-I521 PolarHBondContact O-N 3.19Å; I521-L525 HydrophobicContact CG2-CD1 4.12Å; I521-L525 PolarHBondContact O-N 3.49Å
522	T	38.2	Very low	35	Very low	81 Å²	81	124.8 Å²	124.8	50%	0.497	67%	0.672	S	S	.	*	H	α-helix	trans	-72	-35.7	-175.4	-44.2	0	0	0	0	111.4	L518 E520 L525 E526	L518-T522 PolarHBondContact O-N 3.42Å; L518-T522 PolarHBondContact O-OG1 3.29Å; E520-T522 PolarHBondContact O-N 3.45Å; T522-L525 PolarHBondContact O-N 2.96Å; T522-E526 PolarHBondContact O-N 3.14Å
523	K	32.7	Very low	35.1	Very low	156 Å²	156	124.1 Å²	124.1	68%	0.678	66%	0.663	S	S	*	*	H	α-helix	trans	-71.6	-33.1	-179.9	-162	176.3	-178.9	-179.1	0	113.2	T527	K523-T527 PolarHBondContact O-OG1 3.16Å
524	N	36.7	Very low	35.2	Very low	101 Å²	101	124.8 Å²	124.8	54%	0.54	67%	0.667	S	S	.	*	H	α-helix	trans	-75.5	-25.9	177.9	-71.1	-30.9	0	0	0	113.1	E520 T527	E520-N524 PolarHBondContact O-N 2.61Å; E520-N524 PolarHBondContact O-ND2 2.84Å; N524-T527 PolarHBondContact O-OG1 3.27Å
525	L	35.8	Very low	35.3	Very low	102 Å²	102	122.8 Å²	122.8	53%	0.534	66%	0.662	S	S	.	*	H	α-helix	trans	-76.5	-28.9	175.6	-82	160.7	0	0	0	113	I521 T522 F529	I521-L525 HydrophobicContact CG2-CD1 4.12Å; I521-L525 PolarHBondContact O-N 3.49Å; T522-L525 PolarHBondContact O-N 2.96Å; L525-F529 WeakPolarHBondContact O-CD2 3.45Å
526	E	32.5	Very low	35.4	Very low	136 Å²	136	124.8 Å²	124.8	64%	0.636	67%	0.665	S	S	*	*	H	α-helix	trans	-75.4	-30.2	177	-75.8	-179	159.8	0	0	112.6	T522 D528 F529	T522-E526 PolarHBondContact O-N 3.14Å; E526-D528 VanDerWaalsContact C-N 3.31Å; E526-D528 PolarHBondContact O-N 3.24Å; E526-F529 PolarHBondContact O-N 3.23Å
527	T	35.7	Very low	35.5	Very low	82 Å²	82	123.2 Å²	123.2	50%	0.503	66%	0.662	S	S	.	*	H	α-helix	trans	-69.8	-25.4	175.4	40.7	0	0	0	0	113.5	K523 N524 F529 Q530	K523-T527 PolarHBondContact O-OG1 3.16Å; N524-T527 PolarHBondContact O-OG1 3.27Å; T527-F529 PolarHBondContact O-N 3.05Å; T527-Q530 PolarHBondContact O-N 3.41Å
528	D	41.6	Very low	35.5	Very low	126 Å²	126	123.1 Å²	123.1	67%	0.674	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-11	177.9	-82.4	-15	0	0	0	113.7	E526	E526-D528 VanDerWaalsContact C-N 3.31Å; E526-D528 PolarHBondContact O-N 3.24Å
529	F	33.9	Very low	35.6	Very low	182 Å²	182	123.8 Å²	123.8	80%	0.798	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-5	178.4	-82.9	-81.1	0	0	0	114.5	L525 E526 T527	L525-F529 WeakPolarHBondContact O-CD2 3.45Å; E526-F529 PolarHBondContact O-N 3.23Å; T527-F529 PolarHBondContact O-N 3.05Å
530	Q	28.7	Very low	35.7	Very low	168 Å²	168	127.9 Å²	127.9	79%	0.785	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-11.4	-175.8	-76.9	-175.8	-15.7	0	0	115.3	T527	T527-Q530 PolarHBondContact O-N 3.41Å
531	D	39.3	Very low	35.7	Very low	157 Å²	157	127.7 Å²	127.7	84%	0.84	69%	0.686	S	S	*	*			trans	-130.3	68.5	176.1	-77.3	-33	0	0	0	112.1
532	A	33.9	Very low	35.4	Very low	164 Å²	164	132.3 Å²	132.3	100%	1.355	71%	0.713	S	S	*	*			trans	-169.6	0	158.9	0	0	0	0	0	113.7

Retrieved 532 of 532 residues in 718.8 ms (Link to these results)

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