A0A087XUZ5_POEFO Loading...

Mitoferrin-1

Mitochondrial iron transporter that specifically mediates iron uptake in developing erythroid cells, thereby playing an essential role in heme biosynthesis.

AlphaFold DB , UniProt , Accession A0A087XUZ5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 338 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	30.3	Very low	233 Å²	233	127.3 Å²	127.3	100%	1.148	66%	0.658	S	S	*	*				0	7.8	0	-150.2	166.5	81	0	0	112
2	E	27.1	Very low	30	Very low	162 Å²	162	126.4 Å²	126.4	76%	0.757	65%	0.654	S	S	*	*			trans	-92.5	-20.2	-174.2	-76.7	159.8	119.9	0	0	115.2	S4 S5	E2-S4 PolarHBondContact O-N 3.47Å; E2-S4 VanDerWaalsContact O-N 3.13Å; E2-S5 PolarHBondContact O-N 3.32Å; E2-S5 VanDerWaalsContact O-N 3.16Å
3	L	29.3	Very low	30.1	Very low	159 Å²	159	126.8 Å²	126.8	83%	0.832	65%	0.651	S	S	*	*	H	α-helix	trans	-67.5	-13.6	179.8	-91.6	113.8	0	0	0	115.5
4	S	30.1	Very low	30.1	Very low	95 Å²	95	128.7 Å²	128.7	66%	0.664	66%	0.658	S	S	*	*	H	α-helix	trans	-87.9	-19.6	176.7	-167.2	0	0	0	0	112.6	E2	E2-S4 PolarHBondContact O-N 3.47Å; E2-S4 VanDerWaalsContact O-N 3.13Å
5	S	28.1	Very low	29.9	Very low	71 Å²	71	126 Å²	126	50%	0.497	66%	0.656	S	S	.	*	H	α-helix	trans	-78.8	-43.2	-179.1	-160	0	0	0	0	110.5	E2 R7 A8 V9	E2-S5 PolarHBondContact O-N 3.32Å; E2-S5 VanDerWaalsContact O-N 3.16Å; S5-R7 VanDerWaalsContact C-N 3.33Å; S5-R7 PolarHBondContact O-N 3.16Å; S5-A8 PolarHBondContact O-N 2.97Å; S5-V9 VanDerWaalsContact O-CG2 3.3Å; S5-V9 WeakPolarHBondContact O-CG2 3.22Å; S5-V9 PolarHBondContact O-N 3.02Å
6	D	31	Very low	29.7	Very low	116 Å²	116	128.3 Å²	128.3	62%	0.62	66%	0.662	S	S	*	*	H	α-helix	trans	-65.1	-33.1	-179.4	-69.2	-23.7	0	0	0	113.5	A8 A10	D6-A8 VanDerWaalsContact C-N 3.33Å; D6-A10 VanDerWaalsContact O-CB 3.23Å; D6-A10 WeakPolarHBondContact O-CB 3.41Å; D6-A10 PolarHBondContact O-N 3.21Å
7	R	33.2	Very low	29.7	Very low	198 Å²	198	127.5 Å²	127.5	75%	0.747	66%	0.658	S	S	*	*	H	α-helix	trans	-71.6	-27.1	173.9	-82.4	-177.4	167.6	-174.5	-3	113.2	S5 R11	S5-R7 VanDerWaalsContact C-N 3.33Å; S5-R7 PolarHBondContact O-N 3.16Å; R7-R11 WeakPolarHBondContact O-CB 3.35Å; R7-R11 VanDerWaalsContact O-CG 3.28Å; R7-R11 WeakPolarHBondContact O-CG 3.46Å; R7-R11 PolarHBondContact O-N 2.64Å
8	A	29.5	Very low	29.4	Very low	48 Å²	48	129.3 Å²	129.3	40%	0.397	66%	0.663	S	S	.	*	H	α-helix	trans	-81.8	-39.7	176.2	0	0	0	0	0	110.8	S5 D6 R11 L12	S5-A8 PolarHBondContact O-N 2.97Å; D6-A8 VanDerWaalsContact C-N 3.33Å; A8-R11 PolarHBondContact O-N 2.91Å; A8-L12 WeakPolarHBondContact O-CB 3.46Å; A8-L12 WeakPolarHBondContact O-CD1 3.35Å; A8-L12 WeakPolarHBondContact O-CG 3.42Å; A8-L12 PolarHBondContact O-N 3.41Å
9	V	29.4	Very low	29.3	Very low	63 Å²	63	127.9 Å²	127.9	38%	0.382	66%	0.657	S	S	.	*	H	α-helix	trans	-65.3	-44.8	174.9	176.1	0	0	0	0	110.8	S5 R11 L12 E13	S5-V9 VanDerWaalsContact O-CG2 3.3Å; S5-V9 WeakPolarHBondContact O-CG2 3.22Å; S5-V9 PolarHBondContact O-N 3.02Å; V9-R11 VanDerWaalsContact C-N 3.28Å; V9-R11 PolarHBondContact O-N 3.23Å; V9-L12 PolarHBondContact O-N 3.33Å; V9-L12 VanDerWaalsContact O-N 3.07Å; V9-E13 HydrophobicContact CG1-CG 4.4Å; V9-E13 WeakPolarHBondContact O-CG 3.29Å; V9-E13 PolarHBondContact O-N 3.04Å
10	A	31.3	Very low	29.4	Very low	51 Å²	51	131.8 Å²	131.8	42%	0.421	67%	0.672	S	S	.	*	H	α-helix	trans	-64.9	-28.8	175.6	0	0	0	0	0	113.8	D6 M14	D6-A10 VanDerWaalsContact O-CB 3.23Å; D6-A10 WeakPolarHBondContact O-CB 3.41Å; D6-A10 PolarHBondContact O-N 3.21Å; A10-M14 PolarHBondContact O-N 3.41Å
11	R	30.9	Very low	29.3	Very low	204 Å²	204	132.5 Å²	132.5	77%	0.77	68%	0.678	S	S	*	*	H	α-helix	trans	-76.2	-30.5	173.1	-80.6	179.2	-178.9	-169.7	-0.2	112.6	R7 A8 V9	R7-R11 WeakPolarHBondContact O-CB 3.35Å; R7-R11 VanDerWaalsContact O-CG 3.28Å; R7-R11 WeakPolarHBondContact O-CG 3.46Å; R7-R11 PolarHBondContact O-N 2.64Å; A8-R11 PolarHBondContact O-N 2.91Å; V9-R11 VanDerWaalsContact C-N 3.28Å; V9-R11 PolarHBondContact O-N 3.23Å
12	L	27.4	Very low	28.9	Very low	117 Å²	117	124 Å²	124	61%	0.613	65%	0.649	S	S	*	*	H	α-helix	trans	-77.6	-39.6	176.2	-76.1	162.8	0	0	0	111.1	A8 V9 M14 S15	A8-L12 WeakPolarHBondContact O-CB 3.46Å; A8-L12 WeakPolarHBondContact O-CD1 3.35Å; A8-L12 WeakPolarHBondContact O-CG 3.42Å; A8-L12 PolarHBondContact O-N 3.41Å; V9-L12 PolarHBondContact O-N 3.33Å; V9-L12 VanDerWaalsContact O-N 3.07Å; L12-M14 PolarHBondContact O-N 2.97Å; L12-S15 PolarHBondContact O-N 3.26Å; L12-S15 VanDerWaalsContact O-N 3.1Å; L12-S15 PolarHBondContact O-OG 3.27Å
13	E	31.2	Very low	28.8	Very low	131 Å²	131	123.1 Å²	123.1	61%	0.612	65%	0.645	S	S	*	*	H	α-helix	trans	-65.1	-37.2	175.8	-73.4	-179.3	144.3	0	0	112.3	V9 S15 Q16	V9-E13 HydrophobicContact CG1-CG 4.4Å; V9-E13 WeakPolarHBondContact O-CG 3.29Å; V9-E13 PolarHBondContact O-N 3.04Å; E13-S15 PolarHBondContact O-N 3.28Å; E13-Q16 PolarHBondContact O-N 3.03Å
14	M	29.4	Very low	28.4	Very low	154 Å²	154	120 Å²	120	76%	0.759	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-16.9	173.3	-85.3	-175.4	66.9	0	0	114.4	A10 L12	A10-M14 PolarHBondContact O-N 3.41Å; L12-M14 PolarHBondContact O-N 2.97Å
15	S	28.1	Very low	28.1	Very low	88 Å²	88	122.7 Å²	122.7	62%	0.615	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-7.2	177.3	69	0	0	0	0	114	L12 E13	L12-S15 PolarHBondContact O-N 3.26Å; L12-S15 VanDerWaalsContact O-N 3.1Å; L12-S15 PolarHBondContact O-OG 3.27Å; E13-S15 PolarHBondContact O-N 3.28Å
16	Q	25.6	Very low	27.9	Very low	162 Å²	162	126.1 Å²	126.1	76%	0.757	65%	0.647	S	S	*	*			trans	-117.6	12.9	-174.3	-69.6	-138.6	-53.1	0	0	115.2	E13 Q18	E13-Q16 PolarHBondContact O-N 3.03Å; Q16-Q18 PolarHBondContact O-N 2.94Å
17	I	30.4	Very low	27.6	Very low	116 Å²	116	127 Å²	127	60%	0.595	65%	0.647	S	S	*	*			trans	-77.7	93.1	175.9	-55.3	175.3	0	0	0	108.5	F25	I17-F25 WeakPolarHBondContact O-CE2 3.23Å
18	Q	24.4	Very low	27.2	Very low	159 Å²	159	123 Å²	123	74%	0.743	65%	0.645	S	S	*	*			trans	-78.7	141	165.4	-97.4	163.5	-30	0	0	109.9	Q16	Q16-Q18 PolarHBondContact O-N 2.94Å
19	N	27.2	Very low	26.9	Very low	104 Å²	104	123.4 Å²	123.4	56%	0.556	64%	0.644	S	S	*	*			trans	-70.1	156.3	164.3	-75.2	-22.6	0	0	0	109.9	D21 G22	N19-D21 PolarHBondContact O-N 3.46Å; N19-G22 PolarHBondContact O-N 3.02Å
20	E	31.4	Very low	26.9	Very low	205 Å²	205	123 Å²	123	96%	0.958	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-9.7	178.6	-74	-175.4	127.1	0	0	114.8
21	D	27.4	Very low	26.7	Very low	147 Å²	147	122.1 Å²	122.1	79%	0.786	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	5.2	-177.6	-62.7	-40.9	0	0	0	115.5	N19 E23	N19-D21 PolarHBondContact O-N 3.46Å; D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.87Å; D21-E23 VanDerWaalsContact O-N 3.1Å
22	G	25.5	Very low	26.6	Very low	53 Å²	53	116.6 Å²	116.6	55%	0.546	62%	0.622	S	S	.	*			trans	68.5	8.9	167.3	0	0	0	0	0	118	N19	N19-G22 PolarHBondContact O-N 3.02Å
23	E	23.1	Very low	27	Very low	145 Å²	145	116.8 Å²	116.8	68%	0.678	62%	0.615	S	S	*	*			trans	-89.7	142.5	176.3	-73.7	-70.5	140.8	0	0	112.6	D21	D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.87Å; D21-E23 VanDerWaalsContact O-N 3.1Å
24	P	21.9	Very low	27.3	Very low	93 Å²	93	116.5 Å²	116.5	60%	0.604	61%	0.614	S	S	*	*			trans	-65.8	142.5	178.3	26.3	-31.8	0	0	0	111.8	N26	P24-N26 PolarHBondContact O-N 2.99Å
25	F	24.4	Very low	27.6	Very low	152 Å²	152	112 Å²	112	67%	0.667	60%	0.598	S	S	*	*			trans	-56.5	101.3	176	-91.6	-98.3	0	0	0	110.7	I17	I17-F25 WeakPolarHBondContact O-CE2 3.23Å
26	N	22.3	Very low	28.4	Very low	142 Å²	142	110 Å²	110	76%	0.759	58%	0.58	S	S	*	*			trans	-67.1	135.9	172.2	-86.8	-39.7	0	0	0	110.6	P24 V28	P24-N26 PolarHBondContact O-N 2.99Å; N26-V28 PolarHBondContact O-N 3.25Å
27	E	24.9	Very low	29.1	Very low	135 Å²	135	105 Å²	105	63%	0.631	56%	0.561	S	S	*	*			trans	-47.9	123.3	-177	-66.8	172.9	144.7	0	0	112.7	S29	E27-S29 PolarHBondContact O-N 3.49Å
28	V	25.1	Very low	29.7	Very low	115 Å²	115	105.7 Å²	105.7	70%	0.697	57%	0.573	S	S	*	*			trans	-84.4	114.7	175.7	-178.9	0	0	0	0	108.5	N26 D32	N26-V28 PolarHBondContact O-N 3.25Å; V28-D32 HydrophobicContact CG1-CB 3.74Å
29	S	22.6	Very low	30.7	Very low	55 Å²	55	103.8 Å²	103.8	39%	0.385	56%	0.564	S	S	.	*			trans	-64	142.7	177.7	-178.3	0	0	0	0	111.8	E27 G31 D32	E27-S29 PolarHBondContact O-N 3.49Å; S29-G31 PolarHBondContact O-N 3.18Å; S29-D32 PolarHBondContact O-N 3.43Å
30	D	29.5	Very low	32.1	Very low	56 Å²	56	101.4 Å²	101.4	30%	0.299	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-52	-10.5	179.9	-73.8	-73	0	0	0	115.1	Y216	D30-Y216 PolarHBondContact OD1-OH 3.42Å
31	G	27.8	Very low	33.4	Very low	31 Å²	31	95 Å²	95	32%	0.32	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-74.2	-15	172.7	0	0	0	0	0	116	S29	S29-G31 PolarHBondContact O-N 3.18Å
32	D	29.4	Very low	35	Very low	89 Å²	89	91.2 Å²	91.2	48%	0.476	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-95.1	1.3	-180	-72.9	-26.3	0	0	0	113.3	V28 S29 E34 S35	V28-D32 HydrophobicContact CG1-CB 3.74Å; S29-D32 PolarHBondContact O-N 3.43Å; D32-E34 VanDerWaalsContact C-N 3.31Å; D32-E34 PolarHBondContact O-N 3.42Å; D32-S35 PolarHBondContact O-N 2.83Å; D32-S35 VanDerWaalsContact O-N 3.17Å; D32-S35 PolarHBondContact O-OG 3.33Å
33	Y	36.3	Very low	36.6	Very low	121 Å²	121	92.9 Å²	92.9	48%	0.475	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.9	-176.5	-174.5	-105.1	0	0	0	114.1
34	E	35.7	Very low	38.6	Very low	124 Å²	124	88.8 Å²	88.8	58%	0.579	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10	177.7	-75.5	-174.9	156.3	0	0	113.8	D32	D32-E34 VanDerWaalsContact C-N 3.31Å; D32-E34 PolarHBondContact O-N 3.42Å
35	S	37.3	Very low	40.5	Very low	61 Å²	61	86.2 Å²	86.2	43%	0.427	48%	0.478	S	S	.	.			trans	-107.8	105	179.5	41	0	0	0	0	110.6	D32	D32-S35 PolarHBondContact O-N 2.83Å; D32-S35 VanDerWaalsContact O-N 3.17Å; D32-S35 PolarHBondContact O-OG 3.33Å
36	L	43.8	Very low	42.5	Very low	46 Å²	46	81.2 Å²	81.2	24%	0.241	46%	0.457	C	S	.	.			trans	-53	157	156	-79.6	167.8	0	0	0	109.9	H45 L324	L36-H45 WeakPolarHBondContact CB-CE1 3.41Å; L36-H45 WeakPolarHBondContact CB-ND1 3.18Å; L36-L324 HydrophobicContact CD1-CD1 3.75Å; L36-L324 HydrophobicContact CD2-CD1 3.8Å; L36-L324 HydrophobicContact CG-CD1 4.44Å
37	P	39.9	Very low	44.5	Very low	55 Å²	55	78.5 Å²	78.5	36%	0.357	45%	0.446	S	S	.	.			trans	-47	137.7	-169.1	5.4	-22.4	0	0	0	114.5	H39 V40 H45	P37-H39 WeakPolarHBondContact CB-CE1 3.35Å; P37-H39 VanDerWaalsContact CB-NE2 3.32Å; P37-H39 WeakPolarHBondContact CB-NE2 3.4Å; P37-H39 PolarHBondContact O-N 3.08Å; P37-V40 HydrophobicContact CG-CG2 4.49Å; P37-V40 PolarHBondContact O-N 3.35Å; P37-H45 PolarHBondContact O-CE1 3.49Å; P37-H45 VanDerWaalsContact O-CE1 3.28Å; P37-H45 PolarHBondContact O-NE2 3.47Å
38	P	44.5	Very low	46.4	Very low	132 Å²	132	72.9 Å²	72.9	86%	0.857	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	1.2	-169.6	25.9	-35.4	0	0	0	115.5
39	H	45.1	Very low	48.3	Very low	118 Å²	118	68.2 Å²	68.2	55%	0.546	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	6.1	-173	40.1	-92	0	0	0	113.9	P37 K328	P37-H39 WeakPolarHBondContact CB-CE1 3.35Å; P37-H39 VanDerWaalsContact CB-NE2 3.32Å; P37-H39 WeakPolarHBondContact CB-NE2 3.4Å; P37-H39 PolarHBondContact O-N 3.08Å; H39-K328 PolarHBondContact CD2-NZ 2.9Å; H39-K328 PolarHBondContact NE2-NZ 3.25Å
40	V	55.7	Low	50.4	Low	54 Å²	54	66.4 Å²	66.4	33%	0.327	39%	0.386	S	S	.	.	S	Bend	trans	-102.1	145.3	173.2	-164.9	0	0	0	0	109.6	P37 V42 T44 H45	P37-V40 HydrophobicContact CG-CG2 4.49Å; P37-V40 PolarHBondContact O-N 3.35Å; V40-V42 PolarHBondContact O-N 2.93Å; V40-T44 HydrophobicContact CG1-CG2 3.65Å; V40-H45 WeakPolarHBondContact CB-NE2 3.36Å; V40-H45 PolarHBondContact O-CD2 3.32Å; V40-H45 VanDerWaalsContact O-CD2 3.28Å; V40-H45 PolarHBondContact O-NE2 3.35Å; V40-H45 VanDerWaalsContact O-NE2 3.1Å
41	S	58.4	Low	52.2	Low	70 Å²	70	67.5 Å²	67.5	49%	0.49	39%	0.394	S	S	.	.			trans	-54.8	135.3	176.8	-178.7	0	0	0	0	111.1	T43 T44 H45	S41-T43 PolarHBondContact O-N 2.92Å; S41-T43 VanDerWaalsContact O-N 3.1Å; S41-T43 PolarHBondContact OG-OG1 2.78Å; S41-T44 WeakPolarHBondContact O-CA 3.44Å; S41-T44 WeakPolarHBondContact O-CB 3.33Å; S41-T44 PolarHBondContact O-N 2.9Å; S41-H45 PolarHBondContact O-CD2 3.36Å; S41-H45 PolarHBondContact O-N 2.99Å
42	V	61	Low	54	Low	69 Å²	69	67.1 Å²	67.1	42%	0.418	39%	0.388	S	S	.	.	H	α-helix	trans	-48.8	-40	177.6	178.5	0	0	0	0	111.7	V40 T44 H45 M46 E123	V40-V42 PolarHBondContact O-N 2.93Å; V42-T44 VanDerWaalsContact C-N 3.34Å; V42-T44 PolarHBondContact O-N 3.06Å; V42-H45 WeakPolarHBondContact O-CB 3.45Å; V42-H45 PolarHBondContact O-N 3.44Å; V42-M46 HydrophobicContact CG1-CG 4.36Å; V42-M46 HydrophobicContact CG1-SD 4.06Å; V42-M46 WeakPolarHBondContact O-CG 3.5Å; V42-M46 PolarHBondContact O-N 3.42Å; V42-E123 HydrophobicContact CG1-CG 4.24Å
43	T	60	Low	55.8	Low	87 Å²	87	63.1 Å²	63.1	53%	0.534	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-36.1	176.3	35.9	0	0	0	0	114	S41 M46 T47	S41-T43 PolarHBondContact O-N 2.92Å; S41-T43 VanDerWaalsContact O-N 3.1Å; S41-T43 PolarHBondContact OG-OG1 2.78Å; T43-M46 PolarHBondContact O-N 3.03Å; T43-T47 WeakPolarHBondContact O-CG2 3.4Å; T43-T47 PolarHBondContact O-N 2.91Å; T43-T47 PolarHBondContact O-OG1 3.08Å; T43-T47 VanDerWaalsContact O-OG1 3.1Å
44	T	64.1	Low	57.4	Low	59 Å²	59	58.7 Å²	58.7	36%	0.362	35%	0.354	S	S	.	.	H	α-helix	trans	-70.9	-37	175.6	-54.2	0	0	0	0	111	V40 S41 V42 T47 A48	V40-T44 HydrophobicContact CG1-CG2 3.65Å; S41-T44 WeakPolarHBondContact O-CA 3.44Å; S41-T44 WeakPolarHBondContact O-CB 3.33Å; S41-T44 PolarHBondContact O-N 2.9Å; V42-T44 VanDerWaalsContact C-N 3.34Å; V42-T44 PolarHBondContact O-N 3.06Å; T44-T47 PolarHBondContact O-OG1 3.31Å; T44-A48 WeakPolarHBondContact O-CB 3.47Å; T44-A48 PolarHBondContact O-N 3.44Å
45	H	63.6	Low	59.1	Low	40 Å²	40	56.4 Å²	56.4	19%	0.185	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-44	172.7	-66.9	-60.9	0	0	0	111.9	L36 P37 V40 S41 V42 G49	L36-H45 WeakPolarHBondContact CB-CE1 3.41Å; L36-H45 WeakPolarHBondContact CB-ND1 3.18Å; P37-H45 PolarHBondContact O-CE1 3.49Å; P37-H45 VanDerWaalsContact O-CE1 3.28Å; P37-H45 PolarHBondContact O-NE2 3.47Å; V40-H45 WeakPolarHBondContact CB-NE2 3.36Å; V40-H45 PolarHBondContact O-CD2 3.32Å; V40-H45 VanDerWaalsContact O-CD2 3.28Å; V40-H45 PolarHBondContact O-NE2 3.35Å; V40-H45 VanDerWaalsContact O-NE2 3.1Å; S41-H45 PolarHBondContact O-CD2 3.36Å; S41-H45 PolarHBondContact O-N 2.99Å; V42-H45 WeakPolarHBondContact O-CB 3.45Å; V42-H45 PolarHBondContact O-N 3.44Å; H45-G49 PolarHBondContact O-N 3.29Å
46	M	64.4	Low	60.7	Low	46 Å²	46	56.9 Å²	56.9	23%	0.227	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-45.1	178.3	-68.5	176.3	72.8	0	0	112.3	V42 T43 A50 F119 A120	V42-M46 HydrophobicContact CG1-CG 4.36Å; V42-M46 HydrophobicContact CG1-SD 4.06Å; V42-M46 WeakPolarHBondContact O-CG 3.5Å; V42-M46 PolarHBondContact O-N 3.42Å; T43-M46 PolarHBondContact O-N 3.03Å; M46-A50 WeakPolarHBondContact O-CB 3.28Å; M46-A50 PolarHBondContact O-N 3.37Å; M46-F119 HydrophobicContact CB-CB 4.38Å; M46-F119 HydrophobicContact CE-CB 4.12Å; M46-F119 HydrophobicContact CG-CB 3.78Å; M46-F119 HydrophobicContact CG-CG 4.46Å; M46-A120 HydrophobicContact CE-CB 3.92Å
47	T	65.9	Low	62.2	Low	86 Å²	86	56.6 Å²	56.6	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-70.5	-41	179.4	54.1	0	0	0	0	111.7	T43 T44 A50 V51	T43-T47 WeakPolarHBondContact O-CG2 3.4Å; T43-T47 PolarHBondContact O-N 2.91Å; T43-T47 PolarHBondContact O-OG1 3.08Å; T43-T47 VanDerWaalsContact O-OG1 3.1Å; T44-T47 PolarHBondContact O-OG1 3.31Å; T47-A50 PolarHBondContact O-N 3.21Å; T47-V51 VanDerWaalsContact O-CG2 3.28Å; T47-V51 WeakPolarHBondContact O-CG2 3.19Å; T47-V51 PolarHBondContact O-N 3.05Å
48	A	64.7	Low	64	Low	16 Å²	16	55.9 Å²	55.9	13%	0.132	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-45.9	174.8	0	0	0	0	0	111.5	T44 V51 A52	T44-A48 WeakPolarHBondContact O-CB 3.47Å; T44-A48 PolarHBondContact O-N 3.44Å; A48-V51 PolarHBondContact O-N 3.33Å; A48-A52 VanDerWaalsContact O-CB 3.26Å; A48-A52 WeakPolarHBondContact O-CB 3.14Å; A48-A52 PolarHBondContact O-N 3.14Å
49	G	63.9	Low	65.4	Low	17 Å²	17	53.2 Å²	53.2	18%	0.175	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-41.4	176.4	0	0	0	0	0	113.2	H45 A52 G53	H45-G49 PolarHBondContact O-N 3.29Å; G49-A52 PolarHBondContact O-N 3.23Å; G49-G53 PolarHBondContact O-N 3.3Å
50	A	66.3	Low	67	Low	18 Å²	18	48 Å²	48	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-42.7	176.5	0	0	0	0	0	112.6	M46 T47 G53 V54 H115	M46-A50 WeakPolarHBondContact O-CB 3.28Å; M46-A50 PolarHBondContact O-N 3.37Å; T47-A50 PolarHBondContact O-N 3.21Å; A50-G53 PolarHBondContact O-N 3.15Å; A50-V54 VanDerWaalsContact O-CG2 3.28Å; A50-V54 WeakPolarHBondContact O-CG2 3.25Å; A50-V54 PolarHBondContact O-N 3.31Å; A50-H115 HydrophobicContact CB-CB 4.2Å
51	V	68.6	Low	68.2	Low	78 Å²	78	45.4 Å²	45.4	47%	0.473	27%	0.274	S	S	.	.	H	α-helix	trans	-67	-41.2	176.6	177.7	0	0	0	0	110.6	T47 A48 V54 L55 F320	T47-V51 VanDerWaalsContact O-CG2 3.28Å; T47-V51 WeakPolarHBondContact O-CG2 3.19Å; T47-V51 PolarHBondContact O-N 3.05Å; A48-V51 PolarHBondContact O-N 3.33Å; V51-V54 PolarHBondContact O-N 2.96Å; V51-L55 HydrophobicContact CG1-CD1 4.24Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CG 3.34Å; V51-L55 PolarHBondContact O-N 3.2Å; V51-F320 HydrophobicContact CB-CZ 4.44Å; V51-F320 HydrophobicContact CG1-CE1 4.32Å; V51-F320 HydrophobicContact CG1-CZ 3.91Å
52	A	65.6	Low	69.3	Low	24 Å²	24	43.7 Å²	43.7	20%	0.198	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-48.4	175.6	0	0	0	0	0	111.7	A48 G49 V54 L55 E56 F320	A48-A52 VanDerWaalsContact O-CB 3.26Å; A48-A52 WeakPolarHBondContact O-CB 3.14Å; A48-A52 PolarHBondContact O-N 3.14Å; G49-A52 PolarHBondContact O-N 3.23Å; A52-V54 VanDerWaalsContact C-N 3.35Å; A52-V54 PolarHBondContact O-N 2.9Å; A52-L55 PolarHBondContact O-N 2.73Å; A52-E56 WeakPolarHBondContact O-CB 3.19Å; A52-E56 PolarHBondContact O-N 2.91Å; A52-F320 HydrophobicContact CB-CD2 3.83Å; A52-F320 HydrophobicContact CB-CE2 3.66Å; A52-F320 HydrophobicContact CB-CG 4.43Å; A52-F320 HydrophobicContact CB-CZ 4.11Å
53	G	66.7	Low	70.2	Confident	5 Å²	5	41.8 Å²	41.8	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-40.1	177.2	0	0	0	0	0	112.9	G49 A50 E56 H57	G49-G53 PolarHBondContact O-N 3.3Å; A50-G53 PolarHBondContact O-N 3.15Å; G53-E56 PolarHBondContact O-N 2.86Å; G53-H57 PolarHBondContact O-N 3.09Å; G53-H57 VanDerWaalsContact O-N 3.07Å; G53-H57 PolarHBondContact O-ND1 2.77Å
54	V	71.1	Confident	71	Confident	28 Å²	28	39.4 Å²	39.4	17%	0.17	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-41.4	176.1	169.7	0	0	0	0	111.9	A50 V51 A52 T58 M108 A111	A50-V54 VanDerWaalsContact O-CG2 3.28Å; A50-V54 WeakPolarHBondContact O-CG2 3.25Å; A50-V54 PolarHBondContact O-N 3.31Å; V51-V54 PolarHBondContact O-N 2.96Å; A52-V54 VanDerWaalsContact C-N 3.35Å; A52-V54 PolarHBondContact O-N 2.9Å; V54-T58 WeakPolarHBondContact O-CB 3.26Å; V54-T58 PolarHBondContact O-N 2.65Å; V54-T58 VanDerWaalsContact O-N 3.1Å; V54-T58 PolarHBondContact O-OG1 3.03Å; V54-M108 HydrophobicContact CG1-CE 3.26Å; V54-A111 HydrophobicContact CG2-CB 4.05Å
55	L	71.4	Confident	71.8	Confident	76 Å²	76	36.7 Å²	36.7	40%	0.398	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-43.2	176.9	-75.1	177.9	0	0	0	111.7	V51 A52 H57 T58 V59 F320	V51-L55 HydrophobicContact CG1-CD1 4.24Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CG 3.34Å; V51-L55 PolarHBondContact O-N 3.2Å; A52-L55 PolarHBondContact O-N 2.73Å; L55-H57 PolarHBondContact O-N 3.23Å; L55-T58 WeakPolarHBondContact O-CB 3.11Å; L55-T58 PolarHBondContact O-N 3.45Å; L55-T58 VanDerWaalsContact O-N 3.13Å; L55-V59 WeakPolarHBondContact O-CG2 3.2Å; L55-V59 PolarHBondContact O-N 3.08Å; L55-F320 HydrophobicContact CD1-CE2 3.74Å; L55-F320 HydrophobicContact CD1-CZ 3.62Å
56	E	70.4	Confident	72.6	Confident	70 Å²	70	34.8 Å²	34.8	33%	0.327	21%	0.208	S	C	.	.	H	α-helix	trans	-54	-54.4	174.6	-175.5	-164.8	164.3	0	0	111	A52 G53 T58 V59 M60	A52-E56 WeakPolarHBondContact O-CB 3.19Å; A52-E56 PolarHBondContact O-N 2.91Å; G53-E56 PolarHBondContact O-N 2.86Å; E56-T58 PolarHBondContact O-N 3.06Å; E56-V59 PolarHBondContact O-N 3.32Å; E56-M60 WeakPolarHBondContact O-CB 3.45Å; E56-M60 WeakPolarHBondContact O-CG 3.41Å; E56-M60 PolarHBondContact O-N 3.32Å
57	H	74.2	Confident	73.2	Confident	40 Å²	40	35 Å²	35	19%	0.185	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-31.4	179	-77.4	83.6	0	0	0	112.8	G53 L55 Y61 T107 H115	G53-H57 PolarHBondContact O-N 3.09Å; G53-H57 VanDerWaalsContact O-N 3.07Å; G53-H57 PolarHBondContact O-ND1 2.77Å; L55-H57 PolarHBondContact O-N 3.23Å; H57-Y61 WeakPolarHBondContact O-CB 3.42Å; H57-Y61 PolarHBondContact O-N 3.06Å; H57-Y61 VanDerWaalsContact O-N 3.16Å; H57-T107 HydrophobicContact CB-CG2 4.08Å; H57-H115 AromaticContact CE1-CE1 3.74Å; H57-H115 AromaticContact CE1-NE2 3.99Å
58	T	78	Confident	73.9	Confident	41 Å²	41	31.5 Å²	31.5	25%	0.252	19%	0.186	S	C	.	.	H	α-helix	trans	-73.3	-46.7	179	-58.6	0	0	0	0	111.4	V54 L55 E56 Y61 L104	V54-T58 WeakPolarHBondContact O-CB 3.26Å; V54-T58 PolarHBondContact O-N 2.65Å; V54-T58 VanDerWaalsContact O-N 3.1Å; V54-T58 PolarHBondContact O-OG1 3.03Å; L55-T58 WeakPolarHBondContact O-CB 3.11Å; L55-T58 PolarHBondContact O-N 3.45Å; L55-T58 VanDerWaalsContact O-N 3.13Å; E56-T58 PolarHBondContact O-N 3.06Å; T58-Y61 WeakPolarHBondContact O-CB 3.45Å; T58-Y61 PolarHBondContact O-N 3.46Å; T58-L104 HydrophobicContact CG2-CD1 4.42Å; T58-L104 HydrophobicContact CG2-CD2 4.29Å
59	V	75.3	Confident	74.5	Confident	75 Å²	75	31 Å²	31	46%	0.455	18%	0.181	S	C	.	.	H	α-helix	trans	-67.6	-39.1	179.6	178.2	0	0	0	0	110.7	L55 E56 Y61 P62 I312	L55-V59 WeakPolarHBondContact O-CG2 3.2Å; L55-V59 PolarHBondContact O-N 3.08Å; E56-V59 PolarHBondContact O-N 3.32Å; V59-Y61 VanDerWaalsContact C-N 3.26Å; V59-Y61 PolarHBondContact O-N 3.34Å; V59-P62 WeakPolarHBondContact O-CD 3.02Å; V59-I312 HydrophobicContact CB-CG2 4.06Å; V59-I312 HydrophobicContact CG1-CD1 4.11Å; V59-I312 HydrophobicContact CG1-CG1 4.38Å; V59-I312 HydrophobicContact CG1-CG2 3.53Å
60	M	77.3	Confident	75	Confident	8 Å²	8	31.6 Å²	31.6	4%	0.039	18%	0.18	C	C	.	.	S	Bend	trans	-77.4	-9.5	178.6	-69.9	-57.2	-60.4	0	0	113.8	E56 V63 D64 S309 I312	E56-M60 WeakPolarHBondContact O-CB 3.45Å; E56-M60 WeakPolarHBondContact O-CG 3.41Å; E56-M60 PolarHBondContact O-N 3.32Å; M60-V63 HydrophobicContact CE-CB 3.98Å; M60-V63 HydrophobicContact CE-CG1 3.68Å; M60-V63 HydrophobicContact CE-CG2 4.47Å; M60-V63 WeakPolarHBondContact O-CA 3.39Å; M60-V63 VanDerWaalsContact O-CB 3.29Å; M60-V63 WeakPolarHBondContact O-CB 3.49Å; M60-V63 PolarHBondContact O-N 2.86Å; M60-D64 PolarHBondContact O-N 2.84Å; M60-S309 VanDerWaalsContact CE-CB 3.46Å; M60-S309 WeakPolarHBondContact CE-OG 3.38Å; M60-I312 HydrophobicContact CG-CG2 4.36Å; M60-I312 HydrophobicContact SD-CB 4.1Å; M60-I312 HydrophobicContact SD-CD1 3.5Å; M60-I312 VanDerWaalsContact SD-CD1 3.5Å; M60-I312 HydrophobicContact SD-CG1 4.39Å; M60-I312 HydrophobicContact SD-CG2 4.12Å
61	Y	81.8	Confident	75.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-45.5	-171.8	-158.6	-88.9	0	0	0	115.3	H57 T58 V59 V63 D64 S65 P100 L101 R102 G103 L104 T107 K165 Q169	H57-Y61 WeakPolarHBondContact O-CB 3.42Å; H57-Y61 PolarHBondContact O-N 3.06Å; H57-Y61 VanDerWaalsContact O-N 3.16Å; T58-Y61 WeakPolarHBondContact O-CB 3.45Å; T58-Y61 PolarHBondContact O-N 3.46Å; V59-Y61 VanDerWaalsContact C-N 3.26Å; V59-Y61 PolarHBondContact O-N 3.34Å; Y61-V63 PolarHBondContact O-N 3.29Å; Y61-D64 PolarHBondContact O-N 2.99Å; Y61-S65 PolarHBondContact O-N 3.41Å; Y61-P100 WeakPolarHBondContact CD1-O 3.49Å; Y61-P100 WeakPolarHBondContact CE1-O 3.42Å; Y61-L101 HydrophobicContact CD1-CD2 4.2Å; Y61-R102 WeakPolarHBondContact CE1-O 2.99Å; Y61-R102 PolarHBondContact OH-O 3.11Å; Y61-G103 VanDerWaalsContact CZ-C 3.42Å; Y61-G103 WeakPolarHBondContact OH-CA 3.4Å; Y61-G103 PolarHBondContact OH-O 3Å; Y61-L104 HydrophobicContact CD1-CB 4.09Å; Y61-L104 HydrophobicContact CD1-CD1 4.42Å; Y61-L104 HydrophobicContact CD2-CB 4.21Å; Y61-L104 HydrophobicContact CD2-CD1 3.52Å; Y61-L104 HydrophobicContact CD2-CG 4.47Å; Y61-L104 HydrophobicContact CE1-CB 4.01Å; Y61-L104 HydrophobicContact CE2-CB 4.15Å; Y61-L104 HydrophobicContact CE2-CD1 4.15Å; Y61-L104 HydrophobicContact CG-CB 4.19Å; Y61-L104 HydrophobicContact CG-CD1 3.69Å; Y61-L104 HydrophobicContact CG-CG 4.45Å; Y61-L104 PolarHBondContact OH-N 2.81Å; Y61-L104 VanDerWaalsContact OH-N 3.14Å; Y61-T107 WeakPolarHBondContact CE2-OG1 3.28Å; Y61-K165 HydrophobicContact CE2-CD 4.11Å; Y61-K165 HydrophobicContact CE2-CG 4.15Å; Y61-Q169 PolarHBondContact OH-NE2 3.39Å
62	P	81.6	Confident	75.3	Confident	35 Å²	35	27.6 Å²	27.6	23%	0.227	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-34.2	177.7	-21.5	33.9	0	0	0	112.5	V59 S65 V66 L88 P100 L101	V59-P62 WeakPolarHBondContact O-CD 3.02Å; P62-S65 PolarHBondContact O-N 2.87Å; P62-V66 WeakPolarHBondContact O-CG2 3.43Å; P62-V66 PolarHBondContact O-N 3.26Å; P62-L88 HydrophobicContact CB-CD1 4.38Å; P62-P100 HydrophobicContact CB-CB 4.01Å; P62-L101 HydrophobicContact CG-CD2 3.9Å
63	V	78.8	Confident	74.9	Confident	28 Å²	28	28 Å²	28	17%	0.17	15%	0.152	C	C	.	.	H	α-helix	trans	-70.6	-46.1	-178.5	179.6	0	0	0	0	109.5	M60 Y61 S65 V66 K67 Y305	M60-V63 HydrophobicContact CE-CB 3.98Å; M60-V63 HydrophobicContact CE-CG1 3.68Å; M60-V63 HydrophobicContact CE-CG2 4.47Å; M60-V63 WeakPolarHBondContact O-CA 3.39Å; M60-V63 VanDerWaalsContact O-CB 3.29Å; M60-V63 WeakPolarHBondContact O-CB 3.49Å; M60-V63 PolarHBondContact O-N 2.86Å; Y61-V63 PolarHBondContact O-N 3.29Å; V63-S65 VanDerWaalsContact C-N 3.31Å; V63-S65 PolarHBondContact O-N 3.26Å; V63-V66 PolarHBondContact O-N 3.21Å; V63-V66 VanDerWaalsContact O-N 3.14Å; V63-K67 PolarHBondContact O-N 3.44Å; V63-K67 VanDerWaalsContact O-N 3.07Å; V63-Y305 HydrophobicContact CB-CD1 4.44Å; V63-Y305 HydrophobicContact CB-CE1 4.27Å; V63-Y305 HydrophobicContact CG1-CD1 3.06Å; V63-Y305 HydrophobicContact CG1-CE1 3.21Å; V63-Y305 HydrophobicContact CG1-CG 4.21Å; V63-Y305 WeakPolarHBondContact O-CE1 3.46Å
64	D	77	Confident	74.6	Confident	38 Å²	38	31.7 Å²	31.7	20%	0.203	17%	0.167	C	C	.	.	H	α-helix	trans	-58.4	-41	173.4	-73.5	-13.7	0	0	0	112.7	M60 Y61 V66 K67 T68 K165	M60-D64 PolarHBondContact O-N 2.84Å; Y61-D64 PolarHBondContact O-N 2.99Å; D64-V66 PolarHBondContact O-N 3.4Å; D64-K67 WeakPolarHBondContact O-CB 3.41Å; D64-K67 PolarHBondContact O-N 3.15Å; D64-K67 VanDerWaalsContact O-N 3.17Å; D64-T68 PolarHBondContact O-N 3.31Å; D64-T68 PolarHBondContact O-OG1 3.25Å; D64-T68 VanDerWaalsContact O-OG1 3.07Å; D64-K165 IonicContact OD2-NZ 3.62Å; D64-K165 PolarHBondContact OD2-NZ 3.41Å
65	S	81.1	Confident	74.1	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-35.1	178.6	-177	0	0	0	0	112.2	Y61 P62 V63 R69 P100	Y61-S65 PolarHBondContact O-N 3.41Å; P62-S65 PolarHBondContact O-N 2.87Å; V63-S65 VanDerWaalsContact C-N 3.31Å; V63-S65 PolarHBondContact O-N 3.26Å; S65-R69 WeakPolarHBondContact O-CG 3.24Å; S65-R69 PolarHBondContact O-N 3.05Å; S65-P100 WeakPolarHBondContact CB-O 3.32Å
66	V	81.2	Confident	73.8	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-75.1	-41.9	177.8	-176.5	0	0	0	0	109.8	P62 V63 D64 T68 R69 M70 A87 L88 I91 Y305	P62-V66 WeakPolarHBondContact O-CG2 3.43Å; P62-V66 PolarHBondContact O-N 3.26Å; V63-V66 PolarHBondContact O-N 3.21Å; V63-V66 VanDerWaalsContact O-N 3.14Å; D64-V66 PolarHBondContact O-N 3.4Å; V66-T68 PolarHBondContact O-N 3.31Å; V66-R69 PolarHBondContact O-N 2.95Å; V66-M70 HydrophobicContact CG1-CG 4.27Å; V66-M70 HydrophobicContact CG1-SD 4Å; V66-M70 WeakPolarHBondContact O-CG 3.31Å; V66-M70 PolarHBondContact O-N 3.49Å; V66-A87 HydrophobicContact CG1-CB 3.35Å; V66-L88 HydrophobicContact CG2-CB 3.92Å; V66-L88 HydrophobicContact CG2-CD1 3.94Å; V66-I91 HydrophobicContact CG2-CD1 3.92Å; V66-Y305 WeakPolarHBondContact CB-OH 3.42Å; V66-Y305 WeakPolarHBondContact CG1-OH 3.46Å
67	K	77.4	Confident	73.3	Confident	50 Å²	50	32.3 Å²	32.3	22%	0.217	18%	0.182	C	C	.	.	H	α-helix	trans	-53.5	-53.2	174	-178.9	-173.3	168.5	-171.9	0	111.4	V63 D64 R69 M70 Q71 D253 Y305	V63-K67 PolarHBondContact O-N 3.44Å; V63-K67 VanDerWaalsContact O-N 3.07Å; D64-K67 WeakPolarHBondContact O-CB 3.41Å; D64-K67 PolarHBondContact O-N 3.15Å; D64-K67 VanDerWaalsContact O-N 3.17Å; K67-R69 PolarHBondContact O-N 3.24Å; K67-M70 PolarHBondContact O-N 2.9Å; K67-M70 VanDerWaalsContact O-N 3.15Å; K67-Q71 VanDerWaalsContact CE-OE1 3.3Å; K67-Q71 HydrophobicContact CG-CG 4.5Å; K67-Q71 WeakPolarHBondContact O-CG 3.23Å; K67-Q71 PolarHBondContact O-N 2.75Å; K67-D253 IonicContact NZ-OD2 3.89Å; K67-Y305 HydrophobicContact CB-CD2 3.83Å; K67-Y305 HydrophobicContact CB-CE2 3.55Å; K67-Y305 HydrophobicContact CD-CD2 4.45Å; K67-Y305 HydrophobicContact CG-CD2 4.04Å; K67-Y305 HydrophobicContact CG-CE2 4.11Å; K67-Y305 PolarHBondContact N-OH 3.15Å
68	T	78.6	Confident	72.6	Confident	12 Å²	12	36.3 Å²	36.3	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-54.7	-41.4	179.4	-57.6	0	0	0	0	111.7	D64 V66 Q71 S72 Q166 Q169 M170	D64-T68 PolarHBondContact O-N 3.31Å; D64-T68 PolarHBondContact O-OG1 3.25Å; D64-T68 VanDerWaalsContact O-OG1 3.07Å; V66-T68 PolarHBondContact O-N 3.31Å; T68-Q71 PolarHBondContact O-N 3.27Å; T68-S72 PolarHBondContact O-N 3.38Å; T68-Q166 HydrophobicContact CG2-CB 4.24Å; T68-Q166 HydrophobicContact CG2-CG 4.32Å; T68-Q169 HydrophobicContact CG2-CB 4.11Å; T68-Q169 PolarHBondContact OG1-OE1 3.45Å; T68-M170 HydrophobicContact CG2-SD 4.13Å
69	R	78.1	Confident	71.6	Confident	6 Å²	6	34.8 Å²	34.8	2%	0.023	20%	0.197	C	C	.	.	H	α-helix	trans	-73.1	-37.1	179.8	-72.8	174.2	172.5	-137.5	2.4	113.5	S65 V66 K67 Q71 S72 Y81 E95 Q169	S65-R69 WeakPolarHBondContact O-CG 3.24Å; S65-R69 PolarHBondContact O-N 3.05Å; V66-R69 PolarHBondContact O-N 2.95Å; K67-R69 PolarHBondContact O-N 3.24Å; R69-Q71 VanDerWaalsContact C-N 3.26Å; R69-Q71 PolarHBondContact O-N 2.92Å; R69-S72 VanDerWaalsContact O-CB 3.29Å; R69-S72 WeakPolarHBondContact O-CB 3.24Å; R69-S72 PolarHBondContact O-N 3.42Å; R69-Y81 HydrophobicContact CB-CE2 4.48Å; R69-E95 IonicContact CZ-OE1 2.75Å; R69-E95 IonicContact CZ-OE2 2.69Å; R69-E95 IonicContact NH1-OE1 3.66Å; R69-E95 PolarHBondContact NH1-OE1 2.9Å; R69-E95 IonicContact NH1-OE2 3.06Å; R69-E95 PolarHBondContact NH1-OE2 2.92Å; R69-E95 IonicContact NH2-OE1 3.92Å; R69-E95 IonicContact NH2-OE2 2.9Å; R69-E95 PolarHBondContact NH2-OE2 3.41Å; R69-Q169 WeakPolarHBondContact CG-O 3.49Å; R69-Q169 PolarHBondContact NE-O 2.87Å
70	M	74.8	Confident	70.9	Confident	30 Å²	30	38.2 Å²	38.2	15%	0.148	21%	0.207	C	C	.	.	H	α-helix	trans	-69.6	-26.5	176.3	-70	-176	75.9	0	0	112.2	V66 K67 Y81 A87 A301	V66-M70 HydrophobicContact CG1-CG 4.27Å; V66-M70 HydrophobicContact CG1-SD 4Å; V66-M70 WeakPolarHBondContact O-CG 3.31Å; V66-M70 PolarHBondContact O-N 3.49Å; K67-M70 PolarHBondContact O-N 2.9Å; K67-M70 VanDerWaalsContact O-N 3.15Å; M70-Y81 HydrophobicContact CG-CD2 3.96Å; M70-Y81 HydrophobicContact CG-CG 4.2Å; M70-A87 HydrophobicContact SD-CB 4.48Å; M70-A301 HydrophobicContact CB-CB 4.07Å; M70-A301 HydrophobicContact CE-CB 3.5Å; M70-A301 HydrophobicContact CG-CB 4.46Å; M70-A301 HydrophobicContact SD-CB 3.56Å; M70-A301 VanDerWaalsContact SD-CB 3.56Å
71	Q	68.9	Low	70.3	Confident	9 Å²	9	39.4 Å²	39.4	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-87.7	-11.2	177.2	-68	179.5	-35.2	0	0	113.8	K67 T68 R69 D253 T257	K67-Q71 VanDerWaalsContact CE-OE1 3.3Å; K67-Q71 HydrophobicContact CG-CG 4.5Å; K67-Q71 WeakPolarHBondContact O-CG 3.23Å; K67-Q71 PolarHBondContact O-N 2.75Å; T68-Q71 PolarHBondContact O-N 3.27Å; R69-Q71 VanDerWaalsContact C-N 3.26Å; R69-Q71 PolarHBondContact O-N 2.92Å; Q71-D253 PolarHBondContact NE2-OD2 3.04Å; Q71-T257 HydrophobicContact CB-CG2 4.23Å
72	S	72.3	Confident	69.6	Low	2 Å²	2	46 Å²	46	1%	0.014	24%	0.24	C	C	.	.			trans	-57.4	133.7	172	179.2	0	0	0	0	111.5	T68 R69 Q74 M170	T68-S72 PolarHBondContact O-N 3.38Å; R69-S72 VanDerWaalsContact O-CB 3.29Å; R69-S72 WeakPolarHBondContact O-CB 3.24Å; R69-S72 PolarHBondContact O-N 3.42Å; S72-Q74 PolarHBondContact OG-N 3.31Å; S72-Q74 VanDerWaalsContact OG-N 3.15Å; S72-Q74 PolarHBondContact OG-O 3.02Å; S72-M170 VanDerWaalsContact CB-CE 3.5Å; S72-M170 WeakPolarHBondContact OG-CE 3.49Å
73	L	56.9	Low	69	Low	34 Å²	34	46.3 Å²	46.3	18%	0.178	24%	0.243	C	C	.	.	S	Bend	trans	-74.8	-19.2	171.5	-50.7	170.3	0	0	0	111.4	P75 V254 L258 E263 A266 L289 K297	L73-P75 WeakPolarHBondContact O-CD 3.35Å; L73-V254 HydrophobicContact CD2-CG1 4.49Å; L73-L258 HydrophobicContact CD1-CB 4.39Å; L73-L258 HydrophobicContact CD1-CD1 3.68Å; L73-L258 HydrophobicContact CD1-CD2 4.26Å; L73-L258 HydrophobicContact CD1-CG 4.32Å; L73-E263 WeakPolarHBondContact CA-OE2 3.44Å; L73-E263 WeakPolarHBondContact CB-OE2 3.47Å; L73-E263 VanDerWaalsContact N-CD 3.34Å; L73-E263 PolarHBondContact N-OE1 3.35Å; L73-E263 PolarHBondContact N-OE2 3.41Å; L73-E263 VanDerWaalsContact N-OE2 3.11Å; L73-A266 HydrophobicContact CD1-CB 4.38Å; L73-L289 HydrophobicContact CD1-CD1 3.93Å; L73-K297 HydrophobicContact CD2-CD 4.32Å; L73-K297 PolarHBondContact O-NZ 3.23Å
74	Q	60	Low	68.7	Low	82 Å²	82	46.2 Å²	46.2	38%	0.383	24%	0.243	S	C	.	.	S	Bend	trans	-100.8	80.4	166.2	-71.5	178.2	56.1	0	0	111.5	S72 E263 V265	S72-Q74 PolarHBondContact OG-N 3.31Å; S72-Q74 VanDerWaalsContact OG-N 3.15Å; S72-Q74 PolarHBondContact OG-O 3.02Å; Q74-E263 PolarHBondContact N-OE2 3.37Å; Q74-V265 HydrophobicContact CG-CB 4.27Å
75	P	61.4	Low	68.9	Low	57 Å²	57	52.2 Å²	52.2	37%	0.37	26%	0.264	S	S	.	.			trans	-66.8	155.1	166.7	28.8	-32.5	0	0	0	110.1	L73	L73-P75 WeakPolarHBondContact O-CD 3.35Å
76	D	64.7	Low	68.8	Low	12 Å²	12	55.6 Å²	55.6	6%	0.064	28%	0.279	C	S	.	.			trans	-50.1	129.1	166.9	161.1	6.5	0	0	0	108.5	N78 A79 Y171	D76-N78 PolarHBondContact O-N 2.67Å; D76-N78 PolarHBondContact OD1-N 3.43Å; D76-A79 HydrophobicContact CB-CB 3.54Å; D76-A79 PolarHBondContact O-N 3.44Å; D76-Y171 HydrophobicContact CB-CD1 3.89Å; D76-Y171 HydrophobicContact CB-CD2 3.87Å; D76-Y171 HydrophobicContact CB-CE1 3.83Å; D76-Y171 HydrophobicContact CB-CE2 3.79Å; D76-Y171 HydrophobicContact CB-CG 3.9Å
77	P	60	Low	68.7	Low	118 Å²	118	55.5 Å²	55.5	77%	0.766	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-26.1	-177.7	-26.8	32.7	0	0	0	114.1
78	N	59.5	Low	69	Low	123 Å²	123	55.3 Å²	55.3	66%	0.658	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-1.2	179.8	-66	-46.4	0	0	0	113.8	D76 R90	D76-N78 PolarHBondContact O-N 2.67Å; D76-N78 PolarHBondContact OD1-N 3.43Å; N78-R90 PolarHBondContact O-NH2 3.02Å
79	A	57.3	Low	69.3	Low	10 Å²	10	60.5 Å²	60.5	8%	0.083	30%	0.302	C	S	.	.			trans	-98.7	99.2	-175.9	0	0	0	0	0	112	D76 Y81	D76-A79 HydrophobicContact CB-CB 3.54Å; D76-A79 PolarHBondContact O-N 3.44Å; A79-Y81 HydrophobicContact CB-CD1 4.17Å; A79-Y81 HydrophobicContact CB-CD2 4.18Å; A79-Y81 HydrophobicContact CB-CE1 3.7Å; A79-Y81 HydrophobicContact CB-CE2 3.7Å; A79-Y81 HydrophobicContact CB-CG 4.41Å; A79-Y81 VanDerWaalsContact CB-CZ 3.44Å
80	Q	60.3	Low	69.5	Low	146 Å²	146	64.5 Å²	64.5	68%	0.682	32%	0.317	S	S	*	.			trans	-90.7	92	154.8	-70	-173.1	-4.9	0	0	108.2	K82	Q80-K82 PolarHBondContact O-N 3.46Å
81	Y	64.1	Low	69.9	Low	34 Å²	34	63.1 Å²	63.1	13%	0.133	31%	0.31	C	S	.	.			trans	-72.8	96.9	173.8	-60.6	-53.1	0	0	0	109.3	R69 M70 A79 A87	R69-Y81 HydrophobicContact CB-CE2 4.48Å; M70-Y81 HydrophobicContact CG-CD2 3.96Å; M70-Y81 HydrophobicContact CG-CG 4.2Å; A79-Y81 HydrophobicContact CB-CD1 4.17Å; A79-Y81 HydrophobicContact CB-CD2 4.18Å; A79-Y81 HydrophobicContact CB-CE1 3.7Å; A79-Y81 HydrophobicContact CB-CE2 3.7Å; A79-Y81 HydrophobicContact CB-CG 4.41Å; A79-Y81 VanDerWaalsContact CB-CZ 3.44Å; Y81-A87 VanDerWaalsContact CD1-CA 3.46Å; Y81-A87 HydrophobicContact CD1-CB 3.23Å; Y81-A87 HydrophobicContact CE1-CB 3.81Å; Y81-A87 HydrophobicContact CG-CB 3.69Å
82	K	66.7	Low	70.8	Confident	137 Å²	137	65.8 Å²	65.8	60%	0.596	32%	0.324	S	S	*	.			trans	-82.8	-22.4	177.4	-60.8	179.9	178.4	-179.6	0	112.6	Q80	Q80-K82 PolarHBondContact O-N 3.46Å
83	S	69.6	Low	71.5	Confident	42 Å²	42	74.5 Å²	74.5	29%	0.294	36%	0.362	S	S	.	.	S	Bend	trans	-151.3	158.7	178.1	68.6	0	0	0	0	112	Y85 E86 A87	S83-Y85 VanDerWaalsContact C-N 3.34Å; S83-Y85 PolarHBondContact O-N 3.08Å; S83-E86 PolarHBondContact O-N 3Å; S83-E86 WeakPolarHBondContact OG-CB 3.5Å; S83-E86 PolarHBondContact OG-N 3.21Å; S83-E86 VanDerWaalsContact OG-N 3.15Å; S83-A87 VanDerWaalsContact O-CB 3.3Å; S83-A87 WeakPolarHBondContact O-CB 3.44Å; S83-A87 PolarHBondContact O-N 3.06Å
84	V	73.1	Confident	72.8	Confident	27 Å²	27	76.9 Å²	76.9	16%	0.164	38%	0.377	C	S	.	.	H	α-helix	trans	-57.6	-46.2	175.2	174.4	0	0	0	0	111.5	A87 L88 I304 Y305	V84-A87 PolarHBondContact O-N 2.8Å; V84-L88 WeakPolarHBondContact O-CB 3.37Å; V84-L88 PolarHBondContact O-N 3.36Å; V84-I304 HydrophobicContact CG2-CB 4.38Å; V84-I304 HydrophobicContact CG2-CG2 3.78Å; V84-Y305 HydrophobicContact CB-CE1 4.05Å; V84-Y305 HydrophobicContact CG1-CD1 4.28Å; V84-Y305 HydrophobicContact CG1-CE1 3.34Å; V84-Y305 WeakPolarHBondContact CG1-OH 3.48Å; V84-Y305 HydrophobicContact CG2-CD1 4.11Å; V84-Y305 HydrophobicContact CG2-CD2 4.49Å; V84-Y305 HydrophobicContact CG2-CE1 3.53Å; V84-Y305 HydrophobicContact CG2-CE2 3.88Å; V84-Y305 WeakPolarHBondContact CG2-OH 3.36Å
85	Y	79.8	Confident	73.8	Confident	164 Å²	164	75.4 Å²	75.4	64%	0.643	37%	0.371	S	S	*	.	H	α-helix	trans	-63.5	-45.6	-179.6	173.4	-100.8	0	0	0	111.5	S83 A87 L88 K89	S83-Y85 VanDerWaalsContact C-N 3.34Å; S83-Y85 PolarHBondContact O-N 3.08Å; Y85-A87 VanDerWaalsContact C-N 3.32Å; Y85-A87 PolarHBondContact O-N 2.75Å; Y85-L88 PolarHBondContact O-N 2.89Å; Y85-K89 HydrophobicContact CE1-CD 4.03Å; Y85-K89 WeakPolarHBondContact O-CB 3.46Å; Y85-K89 PolarHBondContact O-N 3.27Å
86	E	79.9	Confident	75	Confident	71 Å²	71	74.2 Å²	74.2	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177.5	-173.3	178.7	-178.6	0	0	111.2	S83 R90	S83-E86 PolarHBondContact O-N 3Å; S83-E86 WeakPolarHBondContact OG-CB 3.5Å; S83-E86 PolarHBondContact OG-N 3.21Å; S83-E86 VanDerWaalsContact OG-N 3.15Å; E86-R90 WeakPolarHBondContact O-CB 3.43Å; E86-R90 PolarHBondContact O-N 3.13Å
87	A	79.2	Confident	76.1	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-63.6	-47.7	176.8	0	0	0	0	0	112	V66 M70 Y81 S83 V84 Y85 R90 I91	V66-A87 HydrophobicContact CG1-CB 3.35Å; M70-A87 HydrophobicContact SD-CB 4.48Å; Y81-A87 VanDerWaalsContact CD1-CA 3.46Å; Y81-A87 HydrophobicContact CD1-CB 3.23Å; Y81-A87 HydrophobicContact CE1-CB 3.81Å; Y81-A87 HydrophobicContact CG-CB 3.69Å; S83-A87 VanDerWaalsContact O-CB 3.3Å; S83-A87 WeakPolarHBondContact O-CB 3.44Å; S83-A87 PolarHBondContact O-N 3.06Å; V84-A87 PolarHBondContact O-N 2.8Å; Y85-A87 VanDerWaalsContact C-N 3.32Å; Y85-A87 PolarHBondContact O-N 2.75Å; A87-R90 PolarHBondContact O-N 3.31Å; A87-I91 WeakPolarHBondContact O-CG1 2.93Å; A87-I91 PolarHBondContact O-N 2.88Å
88	L	83	Confident	77.4	Confident	45 Å²	45	81.1 Å²	81.1	24%	0.236	39%	0.391	C	S	.	.	H	α-helix	trans	-61	-48.6	176.1	-176.4	60.9	0	0	0	111.7	P62 V66 V84 Y85 R90 I91 I92 P100	P62-L88 HydrophobicContact CB-CD1 4.38Å; V66-L88 HydrophobicContact CG2-CB 3.92Å; V66-L88 HydrophobicContact CG2-CD1 3.94Å; V84-L88 WeakPolarHBondContact O-CB 3.37Å; V84-L88 PolarHBondContact O-N 3.36Å; Y85-L88 PolarHBondContact O-N 2.89Å; L88-R90 PolarHBondContact O-N 3Å; L88-I91 PolarHBondContact O-N 3.33Å; L88-I92 HydrophobicContact CD1-CD1 4.13Å; L88-I92 HydrophobicContact CD1-CG1 4.49Å; L88-I92 HydrophobicContact CG-CD1 4.01Å; L88-I92 WeakPolarHBondContact O-CG1 3.33Å; L88-I92 PolarHBondContact O-N 3.3Å; L88-P100 HydrophobicContact CD1-CB 4.11Å; L88-P100 HydrophobicContact CD1-CG 3.75Å
89	K	84.6	Confident	78.6	Confident	122 Å²	122	77.8 Å²	77.8	53%	0.53	37%	0.369	S	S	.	.	H	α-helix	trans	-57.5	-40.8	177.1	-177.6	177.3	-176.8	174	0	111.2	Y85 K93	Y85-K89 HydrophobicContact CE1-CD 4.03Å; Y85-K89 WeakPolarHBondContact O-CB 3.46Å; Y85-K89 PolarHBondContact O-N 3.27Å; K89-K93 VanDerWaalsContact O-CB 3.32Å; K89-K93 WeakPolarHBondContact O-CB 3.5Å; K89-K93 PolarHBondContact O-N 3.26Å
90	R	83.3	Confident	79.9	Confident	89 Å²	89	77.5 Å²	77.5	34%	0.336	37%	0.366	S	S	.	.	H	α-helix	trans	-68.7	-46.7	179.5	-167	149.3	-178.6	167.9	-6.1	111.4	N78 E86 A87 L88 I92 K93 T94	N78-R90 PolarHBondContact O-NH2 3.02Å; E86-R90 WeakPolarHBondContact O-CB 3.43Å; E86-R90 PolarHBondContact O-N 3.13Å; A87-R90 PolarHBondContact O-N 3.31Å; L88-R90 PolarHBondContact O-N 3Å; R90-I92 VanDerWaalsContact C-N 3.31Å; R90-I92 PolarHBondContact O-N 3.12Å; R90-K93 PolarHBondContact O-N 3.39Å; R90-K93 VanDerWaalsContact O-N 3.1Å; R90-T94 HydrophobicContact CG-CG2 4.17Å; R90-T94 WeakPolarHBondContact O-CG2 3.45Å; R90-T94 PolarHBondContact O-N 3.41Å; R90-T94 PolarHBondContact O-OG1 3.49Å
91	I	83.7	Confident	81.2	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-55.6	-47.4	175.5	-66.3	166.6	0	0	0	110.7	V66 A87 L88 K93 T94 E95 G96 R99 P100	V66-I91 HydrophobicContact CG2-CD1 3.92Å; A87-I91 WeakPolarHBondContact O-CG1 2.93Å; A87-I91 PolarHBondContact O-N 2.88Å; L88-I91 PolarHBondContact O-N 3.33Å; I91-K93 VanDerWaalsContact C-N 3.32Å; I91-K93 PolarHBondContact O-N 2.87Å; I91-T94 PolarHBondContact O-N 3.41Å; I91-E95 WeakPolarHBondContact O-CA 3.38Å; I91-E95 WeakPolarHBondContact O-CB 3.01Å; I91-E95 PolarHBondContact O-N 2.79Å; I91-G96 PolarHBondContact O-N 2.86Å; I91-R99 HydrophobicContact CG2-CB 4.05Å; I91-R99 HydrophobicContact CG2-CG 4.09Å; I91-P100 HydrophobicContact CG2-CG 3.95Å
92	I	88.1	Confident	82.1	Confident	65 Å²	65	74.5 Å²	74.5	33%	0.333	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-42.5	178.7	-69.4	169.7	0	0	0	110.9	L88 R90 G96 I97 P100	L88-I92 HydrophobicContact CD1-CD1 4.13Å; L88-I92 HydrophobicContact CD1-CG1 4.49Å; L88-I92 HydrophobicContact CG-CD1 4.01Å; L88-I92 WeakPolarHBondContact O-CG1 3.33Å; L88-I92 PolarHBondContact O-N 3.3Å; R90-I92 VanDerWaalsContact C-N 3.31Å; R90-I92 PolarHBondContact O-N 3.12Å; I92-G96 CarbonylContact O-C 3.12Å; I92-G96 WeakPolarHBondContact O-CA 3.25Å; I92-G96 PolarHBondContact O-N 2.99Å; I92-I97 HydrophobicContact CG2-CB 4.28Å; I92-I97 HydrophobicContact CG2-CG1 4.41Å; I92-P100 HydrophobicContact CG1-CG 4.12Å
93	K	85.8	Confident	82.9	Confident	186 Å²	186	68.5 Å²	68.5	81%	0.809	33%	0.33	S	S	*	.	H	α-helix	trans	-71.5	-36.1	-178.3	-169.2	179.4	179.8	-175.7	0	113.2	K89 R90 I91	K89-K93 VanDerWaalsContact O-CB 3.32Å; K89-K93 WeakPolarHBondContact O-CB 3.5Å; K89-K93 PolarHBondContact O-N 3.26Å; R90-K93 PolarHBondContact O-N 3.39Å; R90-K93 VanDerWaalsContact O-N 3.1Å; I91-K93 VanDerWaalsContact C-N 3.32Å; I91-K93 PolarHBondContact O-N 2.87Å
94	T	83.6	Confident	83.7	Confident	83 Å²	83	67.7 Å²	67.7	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-92.2	-33.9	-174.7	56.2	0	0	0	0	113.3	R90 I91	R90-T94 HydrophobicContact CG-CG2 4.17Å; R90-T94 WeakPolarHBondContact O-CG2 3.45Å; R90-T94 PolarHBondContact O-N 3.41Å; R90-T94 PolarHBondContact O-OG1 3.49Å; I91-T94 PolarHBondContact O-N 3.41Å
95	E	82.8	Confident	84.4	Confident	52 Å²	52	72 Å²	72	24%	0.243	34%	0.344	C	S	.	.	H	α-helix	trans	-121.6	-6.1	-171.2	-64.5	174.1	-125.3	0	0	113.7	R69 I91 R99 Y171	R69-E95 IonicContact CZ-OE1 2.75Å; R69-E95 IonicContact CZ-OE2 2.69Å; R69-E95 IonicContact NH1-OE1 3.66Å; R69-E95 PolarHBondContact NH1-OE1 2.9Å; R69-E95 IonicContact NH1-OE2 3.06Å; R69-E95 PolarHBondContact NH1-OE2 2.92Å; R69-E95 IonicContact NH2-OE1 3.92Å; R69-E95 IonicContact NH2-OE2 2.9Å; R69-E95 PolarHBondContact NH2-OE2 3.41Å; I91-E95 WeakPolarHBondContact O-CA 3.38Å; I91-E95 WeakPolarHBondContact O-CB 3.01Å; I91-E95 PolarHBondContact O-N 2.79Å; E95-R99 HydrophobicContact CB-CB 3.87Å; E95-R99 HydrophobicContact CB-CG 3.51Å; E95-R99 HydrophobicContact CG-CG 4.39Å; E95-R99 VanDerWaalsContact OE2-CG 3.31Å; E95-R99 WeakPolarHBondContact OE2-CG 3.37Å; E95-R99 IonicContact OE2-CZ 3.54Å; E95-R99 IonicContact OE2-NE 2.66Å; E95-R99 PolarHBondContact OE2-NE 3.2Å; E95-R99 IonicContact OE2-NH2 3.22Å; E95-Y171 WeakPolarHBondContact OE1-CD2 3.4Å
96	G	86.3	Confident	84.6	Confident	32 Å²	32	65.2 Å²	65.2	33%	0.33	32%	0.319	S	S	.	.			trans	102.3	159.4	175.4	0	0	0	0	0	114.6	I91 I92 F98 R99	I91-G96 PolarHBondContact O-N 2.86Å; I92-G96 CarbonylContact O-C 3.12Å; I92-G96 WeakPolarHBondContact O-CA 3.25Å; I92-G96 PolarHBondContact O-N 2.99Å; G96-F98 VanDerWaalsContact C-N 3.3Å; G96-F98 PolarHBondContact O-N 3.14Å; G96-R99 VanDerWaalsContact O-CB 3.23Å; G96-R99 WeakPolarHBondContact O-CB 3.33Å; G96-R99 PolarHBondContact O-N 2.78Å; G96-R99 VanDerWaalsContact O-N 3.09Å
97	I	87.6	Confident	84.8	Confident	114 Å²	114	62 Å²	62	59%	0.585	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-30.3	-172.7	-165.6	165.4	0	0	0	114.3	I92 R99 P100	I92-I97 HydrophobicContact CG2-CB 4.28Å; I92-I97 HydrophobicContact CG2-CG1 4.41Å; I97-R99 VanDerWaalsContact C-N 3.34Å; I97-P100 WeakPolarHBondContact O-CD 3.43Å
98	F	86.2	Confident	85	Confident	161 Å²	161	65.9 Å²	65.9	71%	0.706	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.6	179	-62.8	-68.6	0	0	0	113.4	G96 L101	G96-F98 VanDerWaalsContact C-N 3.3Å; G96-F98 PolarHBondContact O-N 3.14Å; F98-L101 HydrophobicContact CD1-CD1 4.4Å; F98-L101 PolarHBondContact O-N 3.18Å; F98-L101 VanDerWaalsContact O-N 3.1Å
99	R	85.7	Confident	85.1	Confident	53 Å²	53	68.8 Å²	68.8	20%	0.2	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-60.7	-42.9	-176.4	-165.7	73.4	168.3	158.6	3	113.7	I91 E95 G96 I97 L101 R102	I91-R99 HydrophobicContact CG2-CB 4.05Å; I91-R99 HydrophobicContact CG2-CG 4.09Å; E95-R99 HydrophobicContact CB-CB 3.87Å; E95-R99 HydrophobicContact CB-CG 3.51Å; E95-R99 HydrophobicContact CG-CG 4.39Å; E95-R99 VanDerWaalsContact OE2-CG 3.31Å; E95-R99 WeakPolarHBondContact OE2-CG 3.37Å; E95-R99 IonicContact OE2-CZ 3.54Å; E95-R99 IonicContact OE2-NE 2.66Å; E95-R99 PolarHBondContact OE2-NE 3.2Å; E95-R99 IonicContact OE2-NH2 3.22Å; G96-R99 VanDerWaalsContact O-CB 3.23Å; G96-R99 WeakPolarHBondContact O-CB 3.33Å; G96-R99 PolarHBondContact O-N 2.78Å; G96-R99 VanDerWaalsContact O-N 3.09Å; I97-R99 VanDerWaalsContact C-N 3.34Å; R99-L101 PolarHBondContact O-N 3.39Å; R99-R102 VanDerWaalsContact NH1-CD 3.25Å; R99-R102 VanDerWaalsContact O-CB 3.23Å; R99-R102 WeakPolarHBondContact O-CB 3.36Å; R99-R102 PolarHBondContact O-N 3.48Å; R99-R102 VanDerWaalsContact O-N 3.1Å
100	P	85.3	Confident	85.1	Confident	4 Å²	4	63.4 Å²	63.4	3%	0.026	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-62.1	-21.5	176.9	-22.3	34.6	0	0	0	113.7	Y61 P62 S65 L88 I91 I92 I97 R102	Y61-P100 WeakPolarHBondContact CD1-O 3.49Å; Y61-P100 WeakPolarHBondContact CE1-O 3.42Å; P62-P100 HydrophobicContact CB-CB 4.01Å; S65-P100 WeakPolarHBondContact CB-O 3.32Å; L88-P100 HydrophobicContact CD1-CB 4.11Å; L88-P100 HydrophobicContact CD1-CG 3.75Å; I91-P100 HydrophobicContact CG2-CG 3.95Å; I92-P100 HydrophobicContact CG1-CG 4.12Å; I97-P100 WeakPolarHBondContact O-CD 3.43Å; P100-R102 VanDerWaalsContact C-N 3.31Å
101	L	86.5	Confident	84.7	Confident	69 Å²	69	59.2 Å²	59.2	36%	0.361	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-86.8	0.9	179.1	-59.6	178.8	0	0	0	113.4	Y61 P62 F98 R99 G103 L104	Y61-L101 HydrophobicContact CD1-CD2 4.2Å; P62-L101 HydrophobicContact CG-CD2 3.9Å; F98-L101 HydrophobicContact CD1-CD1 4.4Å; F98-L101 PolarHBondContact O-N 3.18Å; F98-L101 VanDerWaalsContact O-N 3.1Å; R99-L101 PolarHBondContact O-N 3.39Å; L101-G103 PolarHBondContact O-N 3.47Å; L101-L104 HydrophobicContact CD2-CD2 4.49Å; L101-L104 VanDerWaalsContact O-CB 3.29Å; L101-L104 WeakPolarHBondContact O-CB 3.41Å; L101-L104 PolarHBondContact O-N 3.28Å; L101-L104 VanDerWaalsContact O-N 3.1Å
102	R	84.4	Confident	84.5	Confident	48 Å²	48	60.5 Å²	60.5	18%	0.181	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	121.8	-179.5	-169.5	175.3	-153.1	-156.5	1.8	110.8	Y61 R99 P100 M168 Y175 R176	Y61-R102 WeakPolarHBondContact CE1-O 2.99Å; Y61-R102 PolarHBondContact OH-O 3.11Å; R99-R102 VanDerWaalsContact NH1-CD 3.25Å; R99-R102 VanDerWaalsContact O-CB 3.23Å; R99-R102 WeakPolarHBondContact O-CB 3.36Å; R99-R102 PolarHBondContact O-N 3.48Å; R99-R102 VanDerWaalsContact O-N 3.1Å; P100-R102 VanDerWaalsContact C-N 3.31Å; R102-M168 HydrophobicContact CG-CE 4.07Å; R102-Y175 PolarHBondContact NH1-O 2.77Å; R102-Y175 PolarHBondContact NH2-O 2.96Å; R102-R176 PolarHBondContact NH2-O 2.9Å
103	G	83.2	Confident	84.2	Confident	10 Å²	10	60.9 Å²	60.9	10%	0.103	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	1.3	-176.7	0	0	0	0	0	114.5	Y61 L101 N105 I106 T107	Y61-G103 VanDerWaalsContact CZ-C 3.42Å; Y61-G103 WeakPolarHBondContact OH-CA 3.4Å; Y61-G103 PolarHBondContact OH-O 3Å; L101-G103 PolarHBondContact O-N 3.47Å; G103-N105 PolarHBondContact O-N 3.01Å; G103-I106 WeakPolarHBondContact O-CG2 3.37Å; G103-I106 PolarHBondContact O-N 3.36Å; G103-T107 PolarHBondContact O-N 2.99Å; G103-T107 PolarHBondContact O-OG1 2.95Å
104	L	85.8	Confident	83.9	Confident	25 Å²	25	52 Å²	52	13%	0.131	28%	0.282	C	S	.	.	H	α-helix	trans	-56.5	-40.8	178.5	176.2	60.6	0	0	0	111.4	T58 Y61 L101 I106 T107 M108	T58-L104 HydrophobicContact CG2-CD1 4.42Å; T58-L104 HydrophobicContact CG2-CD2 4.29Å; Y61-L104 HydrophobicContact CD1-CB 4.09Å; Y61-L104 HydrophobicContact CD1-CD1 4.42Å; Y61-L104 HydrophobicContact CD2-CB 4.21Å; Y61-L104 HydrophobicContact CD2-CD1 3.52Å; Y61-L104 HydrophobicContact CD2-CG 4.47Å; Y61-L104 HydrophobicContact CE1-CB 4.01Å; Y61-L104 HydrophobicContact CE2-CB 4.15Å; Y61-L104 HydrophobicContact CE2-CD1 4.15Å; Y61-L104 HydrophobicContact CG-CB 4.19Å; Y61-L104 HydrophobicContact CG-CD1 3.69Å; Y61-L104 HydrophobicContact CG-CG 4.45Å; Y61-L104 PolarHBondContact OH-N 2.81Å; Y61-L104 VanDerWaalsContact OH-N 3.14Å; L101-L104 HydrophobicContact CD2-CD2 4.49Å; L101-L104 VanDerWaalsContact O-CB 3.29Å; L101-L104 WeakPolarHBondContact O-CB 3.41Å; L101-L104 PolarHBondContact O-N 3.28Å; L101-L104 VanDerWaalsContact O-N 3.1Å; L104-I106 VanDerWaalsContact C-N 3.31Å; L104-I106 PolarHBondContact O-N 3.45Å; L104-T107 WeakPolarHBondContact O-CA 3.29Å; L104-T107 WeakPolarHBondContact O-CB 3.36Å; L104-T107 PolarHBondContact O-N 3.49Å; L104-M108 HydrophobicContact CD1-CG 4.12Å; L104-M108 HydrophobicContact CG-CG 4.29Å; L104-M108 HydrophobicContact CG-SD 4.42Å; L104-M108 PolarHBondContact O-N 3.43Å
105	N	87.2	Confident	83.4	Confident	118 Å²	118	49.2 Å²	49.2	63%	0.631	26%	0.263	S	S	*	.	H	α-helix	trans	-56.8	-39.7	-179.3	-60.3	-4.8	0	0	0	113.2	G103 T107 M108 M109	G103-N105 PolarHBondContact O-N 3.01Å; N105-T107 VanDerWaalsContact C-N 3.33Å; N105-M108 PolarHBondContact O-N 2.62Å; N105-M109 WeakPolarHBondContact O-CB 3.35Å; N105-M109 VanDerWaalsContact O-CG 3.26Å; N105-M109 WeakPolarHBondContact O-CG 3.19Å; N105-M109 PolarHBondContact O-N 3Å
106	I	85.5	Confident	83	Confident	22 Å²	22	48.9 Å²	48.9	11%	0.113	27%	0.27	C	S	.	.	H	α-helix	trans	-72.2	-32	178.9	-171.9	50.8	0	0	0	111.9	G103 L104 M109 G110 A161 V164 K165 L178	G103-I106 WeakPolarHBondContact O-CG2 3.37Å; G103-I106 PolarHBondContact O-N 3.36Å; L104-I106 VanDerWaalsContact C-N 3.31Å; L104-I106 PolarHBondContact O-N 3.45Å; I106-M109 HydrophobicContact CD1-CB 4.48Å; I106-M109 PolarHBondContact O-N 3.14Å; I106-G110 PolarHBondContact O-N 2.83Å; I106-A161 HydrophobicContact CD1-CB 4.27Å; I106-A161 HydrophobicContact CG1-CB 3.94Å; I106-V164 HydrophobicContact CG1-CB 4.13Å; I106-V164 HydrophobicContact CG1-CG1 4.23Å; I106-V164 HydrophobicContact CG2-CB 4.36Å; I106-V164 HydrophobicContact CG2-CG1 4.11Å; I106-K165 HydrophobicContact CG2-CB 4.36Å; I106-L178 HydrophobicContact CB-CD1 3.64Å; I106-L178 HydrophobicContact CB-CD2 4.04Å; I106-L178 HydrophobicContact CB-CG 4.4Å; I106-L178 HydrophobicContact CD1-CD1 3.66Å; I106-L178 HydrophobicContact CD1-CD2 4.03Å; I106-L178 HydrophobicContact CD1-CG 4.48Å; I106-L178 HydrophobicContact CG1-CD1 3.6Å; I106-L178 HydrophobicContact CG1-CD2 4.46Å; I106-L178 HydrophobicContact CG2-CD1 4.4Å
107	T	83.5	Confident	82.7	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-43	175.3	-54.1	0	0	0	0	110.3	H57 Y61 G103 L104 N105 G110 A111 M158 K165	H57-T107 HydrophobicContact CB-CG2 4.08Å; Y61-T107 WeakPolarHBondContact CE2-OG1 3.28Å; G103-T107 PolarHBondContact O-N 2.99Å; G103-T107 PolarHBondContact O-OG1 2.95Å; L104-T107 WeakPolarHBondContact O-CA 3.29Å; L104-T107 WeakPolarHBondContact O-CB 3.36Å; L104-T107 PolarHBondContact O-N 3.49Å; N105-T107 VanDerWaalsContact C-N 3.33Å; T107-G110 PolarHBondContact O-N 2.91Å; T107-A111 WeakPolarHBondContact O-CB 3.45Å; T107-A111 PolarHBondContact O-N 2.85Å; T107-M158 HydrophobicContact CG2-CE 3.95Å; T107-K165 WeakPolarHBondContact OG1-CD 3.45Å
108	M	83.4	Confident	82.3	Confident	83 Å²	83	46.8 Å²	46.8	41%	0.409	25%	0.249	S	C	.	.	H	α-helix	trans	-65.7	-40.3	175.8	-61.3	-161.1	89.8	0	0	112.4	V54 L104 N105 G110	V54-M108 HydrophobicContact CG1-CE 3.26Å; L104-M108 HydrophobicContact CD1-CG 4.12Å; L104-M108 HydrophobicContact CG-CG 4.29Å; L104-M108 HydrophobicContact CG-SD 4.42Å; L104-M108 PolarHBondContact O-N 3.43Å; N105-M108 PolarHBondContact O-N 2.62Å; M108-G110 VanDerWaalsContact C-N 3.34Å; M108-G110 PolarHBondContact O-N 2.95Å
109	M	85.7	Confident	81.6	Confident	105 Å²	105	41.6 Å²	41.6	52%	0.517	23%	0.226	S	C	.	.	H	α-helix	trans	-64.2	-36.4	176.1	-73.9	176.3	67.3	0	0	112.7	N105 I106 P113 L178 W179	N105-M109 WeakPolarHBondContact O-CB 3.35Å; N105-M109 VanDerWaalsContact O-CG 3.26Å; N105-M109 WeakPolarHBondContact O-CG 3.19Å; N105-M109 PolarHBondContact O-N 3Å; I106-M109 HydrophobicContact CD1-CB 4.48Å; I106-M109 PolarHBondContact O-N 3.14Å; M109-P113 VanDerWaalsContact O-CD 3.28Å; M109-P113 WeakPolarHBondContact O-CD 3.39Å; M109-L178 HydrophobicContact SD-CD2 3.84Å; M109-W179 HydrophobicContact CE-CH2 4.45Å; M109-W179 HydrophobicContact CE-CZ2 4.31Å
110	G	82.8	Confident	81.2	Confident	10 Å²	10	41.2 Å²	41.2	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-81.1	-38.3	178.6	0	0	0	0	0	114	I106 T107 M108 G112 A114	I106-G110 PolarHBondContact O-N 2.83Å; T107-G110 PolarHBondContact O-N 2.91Å; M108-G110 VanDerWaalsContact C-N 3.34Å; M108-G110 PolarHBondContact O-N 2.95Å; G110-G112 PolarHBondContact O-N 3Å; G110-A114 VanDerWaalsContact O-CB 3.3Å; G110-A114 WeakPolarHBondContact O-CB 3.21Å; G110-A114 PolarHBondContact O-N 2.98Å
111	A	76.3	Confident	80.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-45.6	-172.3	0	0	0	0	0	112.5	V54 T107 A114 H115 M158	V54-A111 HydrophobicContact CG2-CB 4.05Å; T107-A111 WeakPolarHBondContact O-CB 3.45Å; T107-A111 PolarHBondContact O-N 2.85Å; A111-A114 PolarHBondContact O-N 3.32Å; A111-H115 PolarHBondContact O-N 2.63Å; A111-H115 PolarHBondContact O-ND1 3.05Å; A111-M158 HydrophobicContact CB-CE 4.25Å
112	G	78.1	Confident	80	Confident	27 Å²	27	39.7 Å²	39.7	28%	0.278	23%	0.226	S	C	.	.	H	α-helix	trans	-55.2	-58.6	-178	0	0	0	0	0	113.3	G110 A114 H115 A116	G110-G112 PolarHBondContact O-N 3Å; G112-A114 VanDerWaalsContact C-N 3.33Å; G112-A114 PolarHBondContact O-N 3.46Å; G112-H115 PolarHBondContact O-N 2.91Å; G112-A116 WeakPolarHBondContact O-CB 3.5Å; G112-A116 PolarHBondContact O-N 2.91Å
113	P	82.3	Confident	79.4	Confident	73 Å²	73	41.1 Å²	41.1	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-38.2	177.1	-25.4	35.1	0	0	0	113.8	M109 A116 L117 I157	M109-P113 VanDerWaalsContact O-CD 3.28Å; M109-P113 WeakPolarHBondContact O-CD 3.39Å; P113-A116 PolarHBondContact O-N 3.09Å; P113-L117 WeakPolarHBondContact O-CB 3.38Å; P113-L117 PolarHBondContact O-N 3.27Å; P113-I157 HydrophobicContact CB-CG2 4.2Å
114	A	79.8	Confident	79.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-47.1	179.8	0	0	0	0	0	111.8	G110 A111 G112 L117 Y118 H154 I157 M158	G110-A114 VanDerWaalsContact O-CB 3.3Å; G110-A114 WeakPolarHBondContact O-CB 3.21Å; G110-A114 PolarHBondContact O-N 2.98Å; A111-A114 PolarHBondContact O-N 3.32Å; G112-A114 VanDerWaalsContact C-N 3.33Å; G112-A114 PolarHBondContact O-N 3.46Å; A114-L117 PolarHBondContact O-N 3.34Å; A114-Y118 PolarHBondContact O-N 3.19Å; A114-H154 VanDerWaalsContact C-CD2 3.47Å; A114-H154 PolarHBondContact O-CD2 3.41Å; A114-I157 HydrophobicContact CB-CB 4.19Å; A114-I157 HydrophobicContact CB-CG2 4.03Å; A114-M158 HydrophobicContact CB-CB 4.02Å; A114-M158 HydrophobicContact CB-SD 4.46Å
115	H	72.6	Confident	78.6	Confident	24 Å²	24	50 Å²	50	11%	0.111	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-38.8	178.7	-69.7	72	0	0	0	111.4	A50 H57 A111 G112 L117 Y118 F119 H154	A50-H115 HydrophobicContact CB-CB 4.2Å; H57-H115 AromaticContact CE1-CE1 3.74Å; H57-H115 AromaticContact CE1-NE2 3.99Å; A111-H115 PolarHBondContact O-N 2.63Å; A111-H115 PolarHBondContact O-ND1 3.05Å; G112-H115 PolarHBondContact O-N 2.91Å; H115-L117 VanDerWaalsContact C-N 3.32Å; H115-L117 PolarHBondContact O-N 2.85Å; H115-Y118 WeakPolarHBondContact O-CB 3.24Å; H115-Y118 PolarHBondContact O-N 3.47Å; H115-F119 HydrophobicContact CB-CE2 4.47Å; H115-F119 WeakPolarHBondContact O-CD2 3.29Å; H115-F119 PolarHBondContact O-N 2.95Å; H115-H154 AromaticContact CE1-NE2 3.69Å; H115-H154 AromaticContact ND1-NE2 3.78Å
116	A	74.9	Confident	77.8	Confident	46 Å²	46	46.8 Å²	46.8	38%	0.38	25%	0.247	S	C	.	.	H	α-helix	trans	-59.3	-43.7	174.5	0	0	0	0	0	111.9	G112 P113 A120	G112-A116 WeakPolarHBondContact O-CB 3.5Å; G112-A116 PolarHBondContact O-N 2.91Å; P113-A116 PolarHBondContact O-N 3.09Å; A116-A120 VanDerWaalsContact O-CB 3.32Å; A116-A120 WeakPolarHBondContact O-CB 3.16Å; A116-A120 PolarHBondContact O-N 3.18Å
117	L	80.1	Confident	77.2	Confident	65 Å²	65	51.6 Å²	51.6	34%	0.34	27%	0.269	S	S	.	.	H	α-helix	trans	-68.2	-39.2	176.9	-176	61.5	0	0	0	112.2	P113 A114 H115 A120 C121 L153 I157	P113-L117 WeakPolarHBondContact O-CB 3.38Å; P113-L117 PolarHBondContact O-N 3.27Å; A114-L117 PolarHBondContact O-N 3.34Å; H115-L117 VanDerWaalsContact C-N 3.32Å; H115-L117 PolarHBondContact O-N 2.85Å; L117-A120 PolarHBondContact O-N 2.87Å; L117-C121 VanDerWaalsContact O-CB 3.27Å; L117-C121 WeakPolarHBondContact O-CB 3.26Å; L117-C121 PolarHBondContact O-N 3.33Å; L117-L153 HydrophobicContact CD2-CB 4.07Å; L117-L153 HydrophobicContact CG-CB 4.34Å; L117-I157 HydrophobicContact CD2-CD1 4.37Å; L117-I157 HydrophobicContact CD2-CG1 3.59Å
118	Y	78.9	Confident	76.9	Confident	36 Å²	36	54.1 Å²	54.1	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-52.8	-58.2	174.1	178.4	-95.3	0	0	0	110.6	A114 H115 A120 C121 Y122 A150 H154	A114-Y118 PolarHBondContact O-N 3.19Å; H115-Y118 WeakPolarHBondContact O-CB 3.24Å; H115-Y118 PolarHBondContact O-N 3.47Å; Y118-A120 PolarHBondContact O-N 3.01Å; Y118-C121 PolarHBondContact O-N 3Å; Y118-Y122 VanDerWaalsContact O-CB 3.28Å; Y118-Y122 WeakPolarHBondContact O-CB 3.37Å; Y118-Y122 PolarHBondContact O-N 3.45Å; Y118-A150 HydrophobicContact CD2-CB 3.55Å; Y118-A150 HydrophobicContact CE2-CB 3.6Å; Y118-A150 HydrophobicContact CG-CB 4.18Å; Y118-A150 WeakPolarHBondContact O-CB 3.28Å; Y118-H154 HydrophobicContact CD2-CB 4.05Å
119	F	71.8	Confident	76.3	Confident	53 Å²	53	51.8 Å²	51.8	23%	0.232	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-39.3	-176.8	-69.5	-68.3	0	0	0	112.4	M46 H115 C121 Y122 E123	M46-F119 HydrophobicContact CB-CB 4.38Å; M46-F119 HydrophobicContact CE-CB 4.12Å; M46-F119 HydrophobicContact CG-CB 3.78Å; M46-F119 HydrophobicContact CG-CG 4.46Å; H115-F119 HydrophobicContact CB-CE2 4.47Å; H115-F119 WeakPolarHBondContact O-CD2 3.29Å; H115-F119 PolarHBondContact O-N 2.95Å; F119-C121 VanDerWaalsContact C-N 3.35Å; F119-C121 PolarHBondContact O-N 3.21Å; F119-Y122 PolarHBondContact O-N 2.78Å; F119-E123 WeakPolarHBondContact O-CB 3.32Å; F119-E123 PolarHBondContact O-N 2.62Å
120	A	76.2	Confident	75.4	Confident	44 Å²	44	48.7 Å²	48.7	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.2	0	0	0	0	0	112	M46 A116 L117 Y118 R124	M46-A120 HydrophobicContact CE-CB 3.92Å; A116-A120 VanDerWaalsContact O-CB 3.32Å; A116-A120 WeakPolarHBondContact O-CB 3.16Å; A116-A120 PolarHBondContact O-N 3.18Å; L117-A120 PolarHBondContact O-N 2.87Å; Y118-A120 PolarHBondContact O-N 3.01Å; A120-R124 WeakPolarHBondContact O-CB 3.47Å; A120-R124 PolarHBondContact O-N 3.19Å; A120-R124 VanDerWaalsContact O-N 3.17Å
121	C	75.6	Confident	74.6	Confident	16 Å²	16	55.4 Å²	55.4	11%	0.108	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-45.2	177.5	-177	0	0	0	0	111.7	L117 Y118 F119 E123 R124 V125 A150 L153	L117-C121 VanDerWaalsContact O-CB 3.27Å; L117-C121 WeakPolarHBondContact O-CB 3.26Å; L117-C121 PolarHBondContact O-N 3.33Å; Y118-C121 PolarHBondContact O-N 3Å; F119-C121 VanDerWaalsContact C-N 3.35Å; F119-C121 PolarHBondContact O-N 3.21Å; C121-E123 VanDerWaalsContact C-N 3.3Å; C121-E123 PolarHBondContact O-N 3.43Å; C121-R124 PolarHBondContact O-N 3.3Å; C121-V125 WeakPolarHBondContact O-CB 3.38Å; C121-V125 VanDerWaalsContact O-CG2 3.31Å; C121-V125 WeakPolarHBondContact O-CG2 3.47Å; C121-V125 PolarHBondContact O-N 3.42Å; C121-A150 HydrophobicContact CB-CB 4.2Å; C121-L153 HydrophobicContact CB-CD1 3.94Å; C121-L153 WeakPolarHBondContact SG-CD1 3.31Å
122	Y	71.9	Confident	74.1	Confident	26 Å²	26	61.8 Å²	61.8	10%	0.102	33%	0.325	C	S	.	.	H	α-helix	trans	-54.1	-50.3	178.6	-178.7	-90.4	0	0	0	110.5	Y118 F119 R124 V125 K126 A146	Y118-Y122 VanDerWaalsContact O-CB 3.28Å; Y118-Y122 WeakPolarHBondContact O-CB 3.37Å; Y118-Y122 PolarHBondContact O-N 3.45Å; F119-Y122 PolarHBondContact O-N 2.78Å; Y122-R124 PolarHBondContact O-N 2.89Å; Y122-V125 PolarHBondContact O-N 3.07Å; Y122-K126 HydrophobicContact CD1-CD 4.37Å; Y122-K126 HydrophobicContact CE1-CD 3.64Å; Y122-K126 WeakPolarHBondContact O-CB 3.37Å; Y122-K126 PolarHBondContact O-N 2.89Å; Y122-A146 HydrophobicContact CD2-CB 4.1Å; Y122-A146 HydrophobicContact CE2-CB 4.26Å
123	E	71.5	Confident	73.4	Confident	78 Å²	78	63.7 Å²	63.7	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-46.5	178.8	-171.1	60.9	-148.6	0	0	111.8	V42 F119 C121 V125 H127	V42-E123 HydrophobicContact CG1-CG 4.24Å; F119-E123 WeakPolarHBondContact O-CB 3.32Å; F119-E123 PolarHBondContact O-N 2.62Å; C121-E123 VanDerWaalsContact C-N 3.3Å; C121-E123 PolarHBondContact O-N 3.43Å; E123-V125 PolarHBondContact O-N 2.67Å; E123-H127 WeakPolarHBondContact O-CB 3.43Å; E123-H127 PolarHBondContact O-N 3.43Å
124	R	77.4	Confident	72	Confident	187 Å²	187	67.7 Å²	67.7	71%	0.706	34%	0.341	S	S	*	.	H	α-helix	trans	-62.2	-45.5	-179.4	-169	103.2	179.1	112.1	0.6	112	A120 C121 Y122 S128	A120-R124 WeakPolarHBondContact O-CB 3.47Å; A120-R124 PolarHBondContact O-N 3.19Å; A120-R124 VanDerWaalsContact O-N 3.17Å; C121-R124 PolarHBondContact O-N 3.3Å; Y122-R124 PolarHBondContact O-N 2.89Å; R124-S128 WeakPolarHBondContact O-CB 3.44Å; R124-S128 PolarHBondContact O-N 3.36Å; R124-S128 VanDerWaalsContact O-N 3.09Å; R124-S128 PolarHBondContact O-OG 3.19Å
125	V	76.1	Confident	70.5	Confident	34 Å²	34	73.7 Å²	73.7	21%	0.206	38%	0.383	C	S	.	.	H	α-helix	trans	-72.2	-43.6	-178.1	178	0	0	0	0	110	C121 Y122 E123 S128 L129 A146 V149	C121-V125 WeakPolarHBondContact O-CB 3.38Å; C121-V125 VanDerWaalsContact O-CG2 3.31Å; C121-V125 WeakPolarHBondContact O-CG2 3.47Å; C121-V125 PolarHBondContact O-N 3.42Å; Y122-V125 PolarHBondContact O-N 3.07Å; E123-V125 PolarHBondContact O-N 2.67Å; V125-S128 PolarHBondContact O-N 3.14Å; V125-L129 WeakPolarHBondContact O-CB 3.36Å; V125-L129 PolarHBondContact O-N 3.41Å; V125-A146 HydrophobicContact CB-CB 3.95Å; V125-A146 HydrophobicContact CG1-CB 3.83Å; V125-V149 HydrophobicContact CG2-CB 4.44Å; V125-V149 HydrophobicContact CG2-CG1 4.13Å
126	K	70.3	Confident	69.3	Low	50 Å²	50	76.8 Å²	76.8	22%	0.217	42%	0.421	C	S	.	.	H	α-helix	trans	-59	-49.7	175.7	-176.6	175.2	176.8	171.9	0	111.3	Y122 S128 L129 S130 N143 A146	Y122-K126 HydrophobicContact CD1-CD 4.37Å; Y122-K126 HydrophobicContact CE1-CD 3.64Å; Y122-K126 WeakPolarHBondContact O-CB 3.37Å; Y122-K126 PolarHBondContact O-N 2.89Å; K126-S128 VanDerWaalsContact C-N 3.33Å; K126-S128 PolarHBondContact O-N 3.28Å; K126-L129 PolarHBondContact O-N 3.44Å; K126-S130 VanDerWaalsContact O-CB 3.31Å; K126-S130 WeakPolarHBondContact O-CB 3.29Å; K126-S130 PolarHBondContact O-N 3.03Å; K126-S130 PolarHBondContact O-OG 3.33Å; K126-N143 WeakPolarHBondContact CD-OD1 3.43Å; K126-N143 WeakPolarHBondContact CE-OD1 3.3Å; K126-A146 HydrophobicContact CB-CB 4Å
127	H	72.9	Confident	67.7	Low	123 Å²	123	76.9 Å²	76.9	57%	0.569	43%	0.426	S	S	*	.	H	α-helix	trans	-60	-42.5	177.9	-175.6	-74.7	0	0	0	112.2	E123 H131	E123-H127 WeakPolarHBondContact O-CB 3.43Å; E123-H127 PolarHBondContact O-N 3.43Å; H127-H131 PolarHBondContact O-N 3.28Å
128	S	76.7	Confident	66.3	Low	55 Å²	55	79.9 Å²	79.9	39%	0.385	44%	0.443	S	S	.	.	H	α-helix	trans	-67	-39.9	179.1	-56.2	0	0	0	0	112	R124 V125 K126 I132	R124-S128 WeakPolarHBondContact O-CB 3.44Å; R124-S128 PolarHBondContact O-N 3.36Å; R124-S128 VanDerWaalsContact O-N 3.09Å; R124-S128 PolarHBondContact O-OG 3.19Å; V125-S128 PolarHBondContact O-N 3.14Å; K126-S128 VanDerWaalsContact C-N 3.33Å; K126-S128 PolarHBondContact O-N 3.28Å; S128-I132 WeakPolarHBondContact O-CD1 3.39Å; S128-I132 WeakPolarHBondContact O-CG1 3.4Å; S128-I132 PolarHBondContact O-N 2.74Å
129	L	69.9	Low	65.5	Low	35 Å²	35	81.3 Å²	81.3	18%	0.183	46%	0.458	C	S	.	.	H	α-helix	trans	-78.7	-34.9	-175.6	-163.9	52.7	0	0	0	112	V125 K126 H131 I132 I133 A142 V145	V125-L129 WeakPolarHBondContact O-CB 3.36Å; V125-L129 PolarHBondContact O-N 3.41Å; K126-L129 PolarHBondContact O-N 3.44Å; L129-H131 VanDerWaalsContact C-N 3.3Å; L129-H131 PolarHBondContact O-N 2.96Å; L129-I132 PolarHBondContact O-N 3.45Å; L129-I132 VanDerWaalsContact O-N 3.13Å; L129-I133 HydrophobicContact CD1-CD1 3.7Å; L129-I133 HydrophobicContact CD1-CG1 4.25Å; L129-I133 HydrophobicContact CD2-CD1 4.49Å; L129-I133 HydrophobicContact CG-CD1 3.66Å; L129-I133 HydrophobicContact CG-CG1 4.48Å; L129-I133 WeakPolarHBondContact O-CB 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.3Å; L129-A142 HydrophobicContact CB-CB 4.31Å; L129-A142 HydrophobicContact CD2-CB 3.91Å; L129-A142 HydrophobicContact CG-CB 3.88Å; L129-V145 HydrophobicContact CD2-CB 3.78Å; L129-V145 HydrophobicContact CD2-CG1 3.88Å; L129-V145 HydrophobicContact CD2-CG2 4.44Å
130	S	67.4	Low	64.9	Low	39 Å²	39	83.8 Å²	83.8	27%	0.273	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-36.7	171.1	-66.5	0	0	0	0	112.6	K126 I132 I133 Q134	K126-S130 VanDerWaalsContact O-CB 3.31Å; K126-S130 WeakPolarHBondContact O-CB 3.29Å; K126-S130 PolarHBondContact O-N 3.03Å; K126-S130 PolarHBondContact O-OG 3.33Å; S130-I132 VanDerWaalsContact C-N 3.29Å; S130-I132 PolarHBondContact O-N 2.95Å; S130-I133 PolarHBondContact O-N 3.08Å; S130-Q134 WeakPolarHBondContact O-CG 3.31Å; S130-Q134 PolarHBondContact O-N 2.99Å
131	H	65.9	Low	64.4	Low	151 Å²	151	87.8 Å²	87.8	70%	0.699	48%	0.484	S	S	*	.	H	α-helix	trans	-71.1	-24.1	175.8	-168.9	-72.5	0	0	0	112.9	H127 L129	H127-H131 PolarHBondContact O-N 3.28Å; L129-H131 VanDerWaalsContact C-N 3.3Å; L129-H131 PolarHBondContact O-N 2.96Å
132	I	66.6	Low	63.9	Low	135 Å²	135	87.1 Å²	87.1	69%	0.692	48%	0.479	S	S	*	.	H	α-helix	trans	-87	-29.1	178.3	-64.2	165.7	0	0	0	111.2	S128 L129 S130	S128-I132 WeakPolarHBondContact O-CD1 3.39Å; S128-I132 WeakPolarHBondContact O-CG1 3.4Å; S128-I132 PolarHBondContact O-N 2.74Å; L129-I132 PolarHBondContact O-N 3.45Å; L129-I132 VanDerWaalsContact O-N 3.13Å; S130-I132 VanDerWaalsContact C-N 3.29Å; S130-I132 PolarHBondContact O-N 2.95Å
133	I	62.3	Low	63.7	Low	67 Å²	67	86.9 Å²	86.9	34%	0.344	48%	0.48	S	S	.	.	H	α-helix	trans	-98.2	-3.4	-170.4	-66.6	177.7	0	0	0	113.6	L129 S130 S135 A142	L129-I133 HydrophobicContact CD1-CD1 3.7Å; L129-I133 HydrophobicContact CD1-CG1 4.25Å; L129-I133 HydrophobicContact CD2-CD1 4.49Å; L129-I133 HydrophobicContact CG-CD1 3.66Å; L129-I133 HydrophobicContact CG-CG1 4.48Å; L129-I133 WeakPolarHBondContact O-CB 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.47Å; L129-I133 PolarHBondContact O-N 3.3Å; S130-I133 PolarHBondContact O-N 3.08Å; I133-S135 VanDerWaalsContact C-N 3.32Å; I133-S135 PolarHBondContact O-N 3.07Å; I133-A142 HydrophobicContact CD1-CB 4.17Å
134	Q	52.4	Low	63.4	Low	158 Å²	158	85 Å²	85	74%	0.738	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	82	178	-88.2	176	-5.3	0	0	114	S130	S130-Q134 WeakPolarHBondContact O-CG 3.31Å; S130-Q134 PolarHBondContact O-N 2.99Å
135	S	48	Very low	63.1	Low	126 Å²	126	79.3 Å²	79.3	88%	0.881	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.5	65.8	143.4	-71.3	0	0	0	0	108.1	I133	I133-S135 VanDerWaalsContact C-N 3.32Å; I133-S135 PolarHBondContact O-N 3.07Å
136	G	47.6	Very low	62.8	Low	89 Å²	89	77.7 Å²	77.7	92%	0.918	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	18.8	157	0	0	0	0	0	119.9
137	G	41.9	Very low	62.6	Low	47 Å²	47	75.8 Å²	75.8	49%	0.485	45%	0.452	S	S	.	.			trans	-127.3	120.4	-178.8	0	0	0	0	0	115.6
138	N	50.4	Low	62.5	Low	129 Å²	129	73.4 Å²	73.4	69%	0.69	45%	0.45	S	S	*	.			trans	10.1	108.5	166.3	-66.9	-12.8	0	0	0	119.6	H140	N138-H140 PolarHBondContact O-N 2.82Å
139	S	62	Low	62.5	Low	66 Å²	66	73.7 Å²	73.7	46%	0.462	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-16.1	174.9	-171.7	0	0	0	0	116	I141 A142 N143	S139-I141 PolarHBondContact O-N 2.75Å; S139-A142 PolarHBondContact O-N 3.06Å; S139-N143 VanDerWaalsContact O-CG 3.26Å; S139-N143 PolarHBondContact O-N 2.75Å; S139-N143 PolarHBondContact O-ND2 3.43Å; S139-N143 PolarHBondContact OG-ND2 3.47Å
140	H	60.1	Low	62.7	Low	105 Å²	105	72 Å²	72	49%	0.486	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-36.3	-173.5	-59.8	-72.1	0	0	0	114.2	N138 G144	N138-H140 PolarHBondContact O-N 2.82Å; H140-G144 PolarHBondContact O-N 3.5Å
141	I	65.4	Low	63	Low	127 Å²	127	72.5 Å²	72.5	65%	0.651	44%	0.441	S	S	*	.	H	α-helix	trans	-69.7	-39.6	178.4	-61.3	174.4	0	0	0	109.8	S139 G144 V145	S139-I141 PolarHBondContact O-N 2.75Å; I141-G144 PolarHBondContact O-N 3.48Å; I141-V145 HydrophobicContact CG2-CG2 4.42Å; I141-V145 WeakPolarHBondContact O-CG2 3.27Å; I141-V145 PolarHBondContact O-N 3.08Å
142	A	65.3	Low	63.8	Low	2 Å²	2	68.1 Å²	68.1	2%	0.017	43%	0.425	C	S	.	.	H	α-helix	trans	-63.4	-45.6	177.9	0	0	0	0	0	111.7	L129 I133 S139 V145 A146	L129-A142 HydrophobicContact CB-CB 4.31Å; L129-A142 HydrophobicContact CD2-CB 3.91Å; L129-A142 HydrophobicContact CG-CB 3.88Å; I133-A142 HydrophobicContact CD1-CB 4.17Å; S139-A142 PolarHBondContact O-N 3.06Å; A142-V145 PolarHBondContact O-N 2.96Å; A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.36Å; A142-A146 PolarHBondContact O-N 3.47Å
143	N	67.8	Low	64.5	Low	22 Å²	22	65 Å²	65	12%	0.118	41%	0.41	C	S	.	.	H	α-helix	trans	-64.1	-40.5	175.4	-65.2	-19	0	0	0	111.8	K126 S139 A146 G147	K126-N143 WeakPolarHBondContact CD-OD1 3.43Å; K126-N143 WeakPolarHBondContact CE-OD1 3.3Å; S139-N143 VanDerWaalsContact O-CG 3.26Å; S139-N143 PolarHBondContact O-N 2.75Å; S139-N143 PolarHBondContact O-ND2 3.43Å; S139-N143 PolarHBondContact OG-ND2 3.47Å; N143-A146 PolarHBondContact O-N 2.68Å; N143-G147 PolarHBondContact O-N 3.15Å
144	G	64.9	Low	65.5	Low	39 Å²	39	63.1 Å²	63.1	40%	0.402	40%	0.399	S	S	.	.	H	α-helix	trans	-65.3	-40.7	178	0	0	0	0	0	113.5	H140 I141 S148	H140-G144 PolarHBondContact O-N 3.5Å; I141-G144 PolarHBondContact O-N 3.48Å; G144-S148 WeakPolarHBondContact O-CB 3.26Å; G144-S148 PolarHBondContact O-N 3.43Å; G144-S148 PolarHBondContact O-OG 3.4Å
145	V	71.9	Confident	66.9	Low	66 Å²	66	56 Å²	56	40%	0.4	37%	0.366	S	S	.	.	H	α-helix	trans	-67.8	-45	174.6	172.6	0	0	0	0	110.6	L129 I141 A142 G147 S148 V149	L129-V145 HydrophobicContact CD2-CB 3.78Å; L129-V145 HydrophobicContact CD2-CG1 3.88Å; L129-V145 HydrophobicContact CD2-CG2 4.44Å; I141-V145 HydrophobicContact CG2-CG2 4.42Å; I141-V145 WeakPolarHBondContact O-CG2 3.27Å; I141-V145 PolarHBondContact O-N 3.08Å; A142-V145 PolarHBondContact O-N 2.96Å; V145-G147 PolarHBondContact O-N 2.92Å; V145-S148 PolarHBondContact O-N 2.68Å; V145-V149 HydrophobicContact CG1-CG2 4.49Å; V145-V149 WeakPolarHBondContact O-CG2 3.38Å; V145-V149 PolarHBondContact O-N 3.2Å
146	A	68.4	Low	68.7	Low	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-45.9	176.9	0	0	0	0	0	112.2	Y122 V125 K126 A142 N143 V149 A150	Y122-A146 HydrophobicContact CD2-CB 4.1Å; Y122-A146 HydrophobicContact CE2-CB 4.26Å; V125-A146 HydrophobicContact CB-CB 3.95Å; V125-A146 HydrophobicContact CG1-CB 3.83Å; K126-A146 HydrophobicContact CB-CB 4Å; A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.36Å; A142-A146 PolarHBondContact O-N 3.47Å; N143-A146 PolarHBondContact O-N 2.68Å; A146-V149 PolarHBondContact O-N 3.4Å; A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.44Å; A146-A150 PolarHBondContact O-N 2.95Å
147	G	67.4	Low	70.6	Confident	10 Å²	10	50.4 Å²	50.4	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-57.7	-49.7	173.6	0	0	0	0	0	112	N143 V145 V149 A150 T151	N143-G147 PolarHBondContact O-N 3.15Å; V145-G147 PolarHBondContact O-N 2.92Å; G147-V149 PolarHBondContact O-N 3.45Å; G147-A150 PolarHBondContact O-N 2.72Å; G147-T151 WeakPolarHBondContact O-CB 3.43Å; G147-T151 PolarHBondContact O-N 3.14Å; G147-T151 PolarHBondContact O-OG1 2.93Å
148	S	69.8	Low	72.6	Confident	74 Å²	74	48.3 Å²	48.3	52%	0.517	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-45.2	-179.2	-60.2	0	0	0	0	112.7	G144 V145 T151 V152	G144-S148 WeakPolarHBondContact O-CB 3.26Å; G144-S148 PolarHBondContact O-N 3.43Å; G144-S148 PolarHBondContact O-OG 3.4Å; V145-S148 PolarHBondContact O-N 2.68Å; S148-T151 PolarHBondContact O-N 3.24Å; S148-V152 VanDerWaalsContact O-CG2 3.29Å; S148-V152 WeakPolarHBondContact O-CG2 3.05Å; S148-V152 PolarHBondContact O-N 3.18Å; S148-V152 VanDerWaalsContact O-N 3.07Å
149	V	77.4	Confident	74.3	Confident	60 Å²	60	42.2 Å²	42.2	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-41.8	177.9	177	0	0	0	0	110.8	V125 V145 A146 G147 V152 L153	V125-V149 HydrophobicContact CG2-CB 4.44Å; V125-V149 HydrophobicContact CG2-CG1 4.13Å; V145-V149 HydrophobicContact CG1-CG2 4.49Å; V145-V149 WeakPolarHBondContact O-CG2 3.38Å; V145-V149 PolarHBondContact O-N 3.2Å; A146-V149 PolarHBondContact O-N 3.4Å; G147-V149 PolarHBondContact O-N 3.45Å; V149-V152 PolarHBondContact O-N 2.91Å; V149-L153 PolarHBondContact O-N 2.66Å
150	A	73.8	Confident	75.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-42.7	176.7	0	0	0	0	0	112	Y118 C121 A146 G147 L153 H154	Y118-A150 HydrophobicContact CD2-CB 3.55Å; Y118-A150 HydrophobicContact CE2-CB 3.6Å; Y118-A150 HydrophobicContact CG-CB 4.18Å; Y118-A150 WeakPolarHBondContact O-CB 3.28Å; C121-A150 HydrophobicContact CB-CB 4.2Å; A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.44Å; A146-A150 PolarHBondContact O-N 2.95Å; G147-A150 PolarHBondContact O-N 2.72Å; A150-L153 PolarHBondContact O-N 2.93Å; A150-H154 VanDerWaalsContact O-CB 3.31Å; A150-H154 WeakPolarHBondContact O-CB 3.04Å; A150-H154 PolarHBondContact O-N 2.96Å
151	T	74.3	Confident	77	Confident	49 Å²	49	35.8 Å²	35.8	30%	0.301	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-42.8	176.4	-58.4	0	0	0	0	111.6	G147 S148 L153 H154 D155	G147-T151 WeakPolarHBondContact O-CB 3.43Å; G147-T151 PolarHBondContact O-N 3.14Å; G147-T151 PolarHBondContact O-OG1 2.93Å; S148-T151 PolarHBondContact O-N 3.24Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 2.93Å; T151-H154 WeakPolarHBondContact O-CB 3.29Å; T151-H154 PolarHBondContact O-N 3.44Å; T151-D155 VanDerWaalsContact O-CB 3.26Å; T151-D155 WeakPolarHBondContact O-CB 3.37Å; T151-D155 VanDerWaalsContact O-CG 3.23Å; T151-D155 PolarHBondContact O-N 3.45Å
152	V	81.6	Confident	77.9	Confident	60 Å²	60	31.8 Å²	31.8	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-57.7	-46.7	176.9	169.2	0	0	0	0	110.8	S148 V149 A156 Y198 L202	S148-V152 VanDerWaalsContact O-CG2 3.29Å; S148-V152 WeakPolarHBondContact O-CG2 3.05Å; S148-V152 PolarHBondContact O-N 3.18Å; S148-V152 VanDerWaalsContact O-N 3.07Å; V149-V152 PolarHBondContact O-N 2.91Å; V152-A156 PolarHBondContact O-N 2.66Å; V152-Y198 VanDerWaalsContact CG1-OH 3.24Å; V152-Y198 WeakPolarHBondContact CG1-OH 3.49Å; V152-Y198 PolarHBondContact O-OH 3.38Å; V152-L202 HydrophobicContact CB-CD2 4.43Å; V152-L202 HydrophobicContact CG2-CD2 3.85Å
153	L	82.4	Confident	78.9	Confident	70 Å²	70	31.7 Å²	31.7	37%	0.366	20%	0.197	S	C	.	.	H	α-helix	trans	-70.2	-40	179.3	-68.9	178.6	0	0	0	112.9	L117 C121 V149 A150 T151 D155 A156 I157	L117-L153 HydrophobicContact CD2-CB 4.07Å; L117-L153 HydrophobicContact CG-CB 4.34Å; C121-L153 HydrophobicContact CB-CD1 3.94Å; C121-L153 WeakPolarHBondContact SG-CD1 3.31Å; V149-L153 PolarHBondContact O-N 2.66Å; A150-L153 PolarHBondContact O-N 2.93Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 2.93Å; L153-D155 VanDerWaalsContact C-N 3.34Å; L153-A156 WeakPolarHBondContact O-CB 3.4Å; L153-A156 PolarHBondContact O-N 3.22Å; L153-I157 PolarHBondContact O-N 3.14Å
154	H	83.8	Confident	80	Confident	27 Å²	27	30.8 Å²	30.8	13%	0.125	19%	0.192	C	C	.	.	H	α-helix	trans	-53.7	-54.3	172.3	168.8	-84	0	0	0	110.6	A114 H115 Y118 A150 T151 A156 I157 M158	A114-H154 VanDerWaalsContact C-CD2 3.47Å; A114-H154 PolarHBondContact O-CD2 3.41Å; H115-H154 AromaticContact CE1-NE2 3.69Å; H115-H154 AromaticContact ND1-NE2 3.78Å; Y118-H154 HydrophobicContact CD2-CB 4.05Å; A150-H154 VanDerWaalsContact O-CB 3.31Å; A150-H154 WeakPolarHBondContact O-CB 3.04Å; A150-H154 PolarHBondContact O-N 2.96Å; T151-H154 WeakPolarHBondContact O-CB 3.29Å; T151-H154 PolarHBondContact O-N 3.44Å; H154-A156 PolarHBondContact O-N 3Å; H154-I157 PolarHBondContact O-N 3.15Å; H154-M158 WeakPolarHBondContact O-CB 3.3Å; H154-M158 PolarHBondContact O-N 2.78Å
155	D	81	Confident	81	Confident	9 Å²	9	30 Å²	30	5%	0.048	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-34.2	-178.1	-75.4	0.8	0	0	0	110.9	T151 L153 I157 M158 N159 Y198 Q201 N205	T151-D155 VanDerWaalsContact O-CB 3.26Å; T151-D155 WeakPolarHBondContact O-CB 3.37Å; T151-D155 VanDerWaalsContact O-CG 3.23Å; T151-D155 PolarHBondContact O-N 3.45Å; L153-D155 VanDerWaalsContact C-N 3.34Å; D155-I157 VanDerWaalsContact C-N 3.28Å; D155-I157 PolarHBondContact O-N 3.37Å; D155-M158 PolarHBondContact O-N 2.91Å; D155-N159 WeakPolarHBondContact O-CB 3.48Å; D155-N159 PolarHBondContact O-N 3.35Å; D155-Y198 HydrophobicContact CB-CD2 4.46Å; D155-Y198 HydrophobicContact CB-CE2 3.75Å; D155-Q201 VanDerWaalsContact CG-OE1 3.24Å; D155-Q201 PolarHBondContact OD2-OE1 3.28Å; D155-N205 PolarHBondContact OD2-ND2 3.46Å
156	A	86.1	Confident	81.6	Confident	23 Å²	23	28 Å²	28	19%	0.19	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-33.9	176.9	0	0	0	0	0	112.8	V152 L153 H154 Y195 Y198	V152-A156 PolarHBondContact O-N 2.66Å; L153-A156 WeakPolarHBondContact O-CB 3.4Å; L153-A156 PolarHBondContact O-N 3.22Å; H154-A156 PolarHBondContact O-N 3Å; A156-Y195 WeakPolarHBondContact O-CE1 3.19Å; A156-Y195 PolarHBondContact O-OH 3.48Å; A156-Y198 HydrophobicContact CB-CE2 4.04Å
157	I	87	Confident	82.5	Confident	73 Å²	73	28.5 Å²	28.5	37%	0.374	17%	0.166	S	C	.	.	H	α-helix	trans	-83.6	-36.6	176.5	-61.8	-55.8	0	0	0	111.3	P113 A114 L117 L153 H154 D155 P160	P113-I157 HydrophobicContact CB-CG2 4.2Å; A114-I157 HydrophobicContact CB-CB 4.19Å; A114-I157 HydrophobicContact CB-CG2 4.03Å; L117-I157 HydrophobicContact CD2-CD1 4.37Å; L117-I157 HydrophobicContact CD2-CG1 3.59Å; L153-I157 PolarHBondContact O-N 3.14Å; H154-I157 PolarHBondContact O-N 3.15Å; D155-I157 VanDerWaalsContact C-N 3.28Å; D155-I157 PolarHBondContact O-N 3.37Å; I157-P160 WeakPolarHBondContact O-CD 3.19Å
158	M	84.6	Confident	83.5	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.02	16%	0.163	C	C	.	.	H	α-helix	trans	-78.2	-29.4	-176.1	-166.8	57	173.7	0	0	112.8	T107 A111 A114 H154 D155 A161 E162	T107-M158 HydrophobicContact CG2-CE 3.95Å; A111-M158 HydrophobicContact CB-CE 4.25Å; A114-M158 HydrophobicContact CB-CB 4.02Å; A114-M158 HydrophobicContact CB-SD 4.46Å; H154-M158 WeakPolarHBondContact O-CB 3.3Å; H154-M158 PolarHBondContact O-N 2.78Å; D155-M158 PolarHBondContact O-N 2.91Å; M158-A161 WeakPolarHBondContact O-CA 3.35Å; M158-A161 WeakPolarHBondContact O-CB 3.32Å; M158-A161 PolarHBondContact O-N 3.32Å; M158-A161 HydrophobicContact SD-CB 4.31Å; M158-E162 HydrophobicContact CG-CG 4.06Å; M158-E162 PolarHBondContact O-N 3.26Å
159	N	86.2	Confident	84.1	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.6	-42.9	-171.5	-162.6	80.1	0	0	0	114.4	D155 A161 E162 V163 F194 S197 Y198 Q201	D155-N159 WeakPolarHBondContact O-CB 3.48Å; D155-N159 PolarHBondContact O-N 3.35Å; N159-A161 VanDerWaalsContact C-N 3.28Å; N159-A161 PolarHBondContact O-N 3.05Å; N159-E162 PolarHBondContact O-N 3.41Å; N159-V163 WeakPolarHBondContact O-CG2 3.33Å; N159-V163 PolarHBondContact O-N 3.5Å; N159-F194 PolarHBondContact ND2-O 2.98Å; N159-S197 PolarHBondContact ND2-OG 2.95Å; N159-S197 PolarHBondContact OD1-OG 3.37Å; N159-Y198 HydrophobicContact CB-CD2 4.24Å; N159-Q201 PolarHBondContact OD1-NE2 3Å
160	P	89.8	Confident	84.3	Confident	32 Å²	32	23.2 Å²	23.2	21%	0.208	13%	0.127	C	C	.	.	H	α-helix	trans	-58.2	-39.3	174.5	-25.4	35	0	0	0	113.2	I157 V163 V164 F194 Y195	I157-P160 WeakPolarHBondContact O-CD 3.19Å; P160-V163 PolarHBondContact O-N 3.01Å; P160-V164 WeakPolarHBondContact O-CG2 3.42Å; P160-V164 PolarHBondContact O-N 3.05Å; P160-F194 HydrophobicContact CB-CB 4.13Å; P160-F194 HydrophobicContact CB-CD1 4.08Å; P160-F194 HydrophobicContact CB-CG 4.42Å; P160-F194 HydrophobicContact CG-CB 4.31Å; P160-Y195 HydrophobicContact CG-CE1 4.33Å; P160-Y195 HydrophobicContact CG-CE2 3.9Å; P160-Y195 WeakPolarHBondContact CG-OH 3.44Å
161	A	88.7	Confident	84.4	Confident	5 Å²	5	27.5 Å²	27.5	4%	0.041	14%	0.144	C	C	.	.	H	α-helix	trans	-68	-40.3	177.2	0	0	0	0	0	111.4	I106 M158 N159 V164 K165	I106-A161 HydrophobicContact CD1-CB 4.27Å; I106-A161 HydrophobicContact CG1-CB 3.94Å; M158-A161 WeakPolarHBondContact O-CA 3.35Å; M158-A161 WeakPolarHBondContact O-CB 3.32Å; M158-A161 PolarHBondContact O-N 3.32Å; M158-A161 HydrophobicContact SD-CB 4.31Å; N159-A161 VanDerWaalsContact C-N 3.28Å; N159-A161 PolarHBondContact O-N 3.05Å; A161-V164 PolarHBondContact O-N 2.95Å; A161-K165 VanDerWaalsContact O-CB 3.26Å; A161-K165 WeakPolarHBondContact O-CB 3.31Å; A161-K165 PolarHBondContact O-N 3.35Å
162	E	83.8	Confident	84.5	Confident	43 Å²	43	31.3 Å²	31.3	20%	0.201	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-43.7	174.4	-63.8	-159.1	149.4	0	0	112.5	M158 N159 V164 K165 Q166 Q201 K256	M158-E162 HydrophobicContact CG-CG 4.06Å; M158-E162 PolarHBondContact O-N 3.26Å; N159-E162 PolarHBondContact O-N 3.41Å; E162-V164 VanDerWaalsContact C-N 3.34Å; E162-V164 PolarHBondContact O-N 3.22Å; E162-K165 WeakPolarHBondContact O-CB 3.47Å; E162-K165 PolarHBondContact O-N 2.95Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 WeakPolarHBondContact O-CG 3.5Å; E162-Q166 PolarHBondContact O-N 3.31Å; E162-Q201 PolarHBondContact OE2-NE2 3.26Å; E162-K256 IonicContact OE2-NZ 2.96Å; E162-K256 PolarHBondContact OE2-NZ 3.07Å; E162-K256 VanDerWaalsContact OE2-NZ 3.07Å
163	V	87.1	Confident	84.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-46.3	179.3	171.5	0	0	0	0	110.6	N159 P160 R167 F194 N260	N159-V163 WeakPolarHBondContact O-CG2 3.33Å; N159-V163 PolarHBondContact O-N 3.5Å; P160-V163 PolarHBondContact O-N 3.01Å; V163-R167 WeakPolarHBondContact O-CB 3.26Å; V163-R167 WeakPolarHBondContact O-CG 3.03Å; V163-R167 PolarHBondContact O-N 3.39Å; V163-R167 VanDerWaalsContact O-N 3.14Å; V163-F194 HydrophobicContact CG1-CD1 4.43Å; V163-N260 WeakPolarHBondContact CG2-OD1 3.36Å
164	V	89.4	Confident	84.6	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-43.8	178.4	178.7	0	0	0	0	111.2	I106 P160 A161 E162 Q166 R167 M168 L178 C181 V182 F194	I106-V164 HydrophobicContact CG1-CB 4.13Å; I106-V164 HydrophobicContact CG1-CG1 4.23Å; I106-V164 HydrophobicContact CG2-CB 4.36Å; I106-V164 HydrophobicContact CG2-CG1 4.11Å; P160-V164 WeakPolarHBondContact O-CG2 3.42Å; P160-V164 PolarHBondContact O-N 3.05Å; A161-V164 PolarHBondContact O-N 2.95Å; E162-V164 VanDerWaalsContact C-N 3.34Å; E162-V164 PolarHBondContact O-N 3.22Å; V164-Q166 PolarHBondContact O-N 3.07Å; V164-R167 PolarHBondContact O-N 3.32Å; V164-M168 HydrophobicContact CG1-CG 4.18Å; V164-M168 HydrophobicContact CG1-SD 3.86Å; V164-M168 WeakPolarHBondContact O-CB 3.23Å; V164-M168 VanDerWaalsContact O-CG 3.31Å; V164-M168 WeakPolarHBondContact O-CG 3.34Å; V164-M168 PolarHBondContact O-N 3.2Å; V164-L178 HydrophobicContact CG1-CD1 3.61Å; V164-C181 HydrophobicContact CG1-CB 4.07Å; V164-V182 HydrophobicContact CG2-CG2 3.83Å; V164-F194 HydrophobicContact CG2-CD1 4.34Å; V164-F194 HydrophobicContact CG2-CE1 3.73Å
165	K	87.6	Confident	84.7	Confident	23 Å²	23	31 Å²	31	10%	0.1	16%	0.164	C	C	.	.	H	α-helix	trans	-51.9	-54.6	174.5	173.6	-171.1	-179.9	176.4	0	110.4	Y61 D64 I106 T107 A161 E162 R167 M168 Q169	Y61-K165 HydrophobicContact CE2-CD 4.11Å; Y61-K165 HydrophobicContact CE2-CG 4.15Å; D64-K165 IonicContact OD2-NZ 3.62Å; D64-K165 PolarHBondContact OD2-NZ 3.41Å; I106-K165 HydrophobicContact CG2-CB 4.36Å; T107-K165 WeakPolarHBondContact OG1-CD 3.45Å; A161-K165 VanDerWaalsContact O-CB 3.26Å; A161-K165 WeakPolarHBondContact O-CB 3.31Å; A161-K165 PolarHBondContact O-N 3.35Å; E162-K165 WeakPolarHBondContact O-CB 3.47Å; E162-K165 PolarHBondContact O-N 2.95Å; K165-R167 PolarHBondContact O-N 2.86Å; K165-M168 PolarHBondContact O-N 3.38Å; K165-Q169 WeakPolarHBondContact O-CB 3.45Å; K165-Q169 VanDerWaalsContact O-CG 3.29Å; K165-Q169 WeakPolarHBondContact O-CG 3.31Å; K165-Q169 PolarHBondContact O-N 3.48Å
166	Q	84.3	Confident	84.8	Confident	24 Å²	24	41.3 Å²	41.3	11%	0.112	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-47.1	-176.9	-72.4	-179.4	-0.7	0	0	111.4	T68 E162 V164 M168 Q169 M170 N260	T68-Q166 HydrophobicContact CG2-CB 4.24Å; T68-Q166 HydrophobicContact CG2-CG 4.32Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 WeakPolarHBondContact O-CG 3.5Å; E162-Q166 PolarHBondContact O-N 3.31Å; V164-Q166 PolarHBondContact O-N 3.07Å; Q166-M168 PolarHBondContact O-N 3.44Å; Q166-Q169 PolarHBondContact O-N 3.32Å; Q166-M170 WeakPolarHBondContact O-CG 3.39Å; Q166-M170 PolarHBondContact O-N 2.85Å; Q166-N260 PolarHBondContact OE1-ND2 2.92Å
167	R	87.1	Confident	84.8	Confident	10 Å²	10	41.4 Å²	41.4	4%	0.038	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-36.5	179.2	-73.5	174.4	175.8	-120.5	2.7	113.7	V163 V164 K165 S173 Y175 E189 N260	V163-R167 WeakPolarHBondContact O-CB 3.26Å; V163-R167 WeakPolarHBondContact O-CG 3.03Å; V163-R167 PolarHBondContact O-N 3.39Å; V163-R167 VanDerWaalsContact O-N 3.14Å; V164-R167 PolarHBondContact O-N 3.32Å; K165-R167 PolarHBondContact O-N 2.86Å; R167-S173 WeakPolarHBondContact O-CB 3.11Å; R167-S173 PolarHBondContact O-OG 3.33Å; R167-Y175 HydrophobicContact CB-CD2 4.41Å; R167-Y175 HydrophobicContact CB-CE2 3.95Å; R167-E189 IonicContact CZ-OE1 3.77Å; R167-E189 IonicContact CZ-OE2 3.64Å; R167-E189 IonicContact NH1-OE1 3.85Å; R167-E189 PolarHBondContact NH1-OE1 2.97Å; R167-E189 VanDerWaalsContact NH2-CD 3.26Å; R167-E189 IonicContact NH2-OE1 3.47Å; R167-E189 PolarHBondContact NH2-OE1 3.43Å; R167-E189 IonicContact NH2-OE2 3.43Å; R167-E189 PolarHBondContact NH2-OE2 3.46Å; R167-N260 PolarHBondContact NE-O 2.82Å; R167-N260 PolarHBondContact NH2-O 2.9Å
168	M	87.2	Confident	84.9	Confident	9 Å²	9	39.1 Å²	39.1	4%	0.044	19%	0.194	C	C	.	.	H	α-helix	trans	-73.2	-28.5	176.5	-71.8	-172.2	73.3	0	0	113	R102 V164 K165 Q166 C181	R102-M168 HydrophobicContact CG-CE 4.07Å; V164-M168 HydrophobicContact CG1-CG 4.18Å; V164-M168 HydrophobicContact CG1-SD 3.86Å; V164-M168 WeakPolarHBondContact O-CB 3.23Å; V164-M168 VanDerWaalsContact O-CG 3.31Å; V164-M168 WeakPolarHBondContact O-CG 3.34Å; V164-M168 PolarHBondContact O-N 3.2Å; K165-M168 PolarHBondContact O-N 3.38Å; Q166-M168 PolarHBondContact O-N 3.44Å; M168-C181 HydrophobicContact CG-CB 4.16Å; M168-C181 HydrophobicContact SD-CB 4.43Å
169	Q	84.1	Confident	85.1	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-81.4	-16.1	-179.1	-75.5	-178.5	-26.1	0	0	113.8	Y61 T68 R69 K165 Q166	Y61-Q169 PolarHBondContact OH-NE2 3.39Å; T68-Q169 HydrophobicContact CG2-CB 4.11Å; T68-Q169 PolarHBondContact OG1-OE1 3.45Å; R69-Q169 WeakPolarHBondContact CG-O 3.49Å; R69-Q169 PolarHBondContact NE-O 2.87Å; K165-Q169 WeakPolarHBondContact O-CB 3.45Å; K165-Q169 VanDerWaalsContact O-CG 3.29Å; K165-Q169 WeakPolarHBondContact O-CG 3.31Å; K165-Q169 PolarHBondContact O-N 3.48Å; Q166-Q169 PolarHBondContact O-N 3.32Å
170	M	81.4	Confident	85.3	Confident	23 Å²	23	50.7 Å²	50.7	11%	0.113	24%	0.242	C	C	.	.	S	Bend	trans	-57.7	148.6	177.8	-65.2	-60	-81.1	0	0	112.8	T68 S72 Q166 N172 S173 T261 E263	T68-M170 HydrophobicContact CG2-SD 4.13Å; S72-M170 VanDerWaalsContact CB-CE 3.5Å; S72-M170 WeakPolarHBondContact OG-CE 3.49Å; Q166-M170 WeakPolarHBondContact O-CG 3.39Å; Q166-M170 PolarHBondContact O-N 2.85Å; M170-N172 PolarHBondContact O-N 2.91Å; M170-S173 WeakPolarHBondContact O-CB 3.45Å; M170-S173 PolarHBondContact O-N 3.34Å; M170-T261 HydrophobicContact CE-CG2 4.08Å; M170-T261 HydrophobicContact CG-CG2 4.32Å; M170-T261 HydrophobicContact SD-CG2 3.81Å; M170-E263 HydrophobicContact CE-CG 4.5Å
171	Y	74.8	Confident	85.4	Confident	91 Å²	91	49.1 Å²	49.1	36%	0.357	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	137.7	172.1	-179.7	-104.3	0	0	0	110.4	D76 E95 S173	D76-Y171 HydrophobicContact CB-CD1 3.89Å; D76-Y171 HydrophobicContact CB-CD2 3.87Å; D76-Y171 HydrophobicContact CB-CE1 3.83Å; D76-Y171 HydrophobicContact CB-CE2 3.79Å; D76-Y171 HydrophobicContact CB-CG 3.9Å; E95-Y171 WeakPolarHBondContact OE1-CD2 3.4Å; Y171-S173 PolarHBondContact O-N 2.94Å; Y171-S173 VanDerWaalsContact O-N 3.12Å
172	N	77.1	Confident	85.5	Confident	129 Å²	129	50.7 Å²	50.7	69%	0.69	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	34.6	-176.1	-156.3	28.9	0	0	0	114.6	M170	M170-N172 PolarHBondContact O-N 2.91Å
173	S	81.8	Confident	85.9	Confident	11 Å²	11	57.7 Å²	57.7	8%	0.077	27%	0.266	C	S	.	.			trans	-53.7	124.1	179.1	-179.8	0	0	0	0	111.4	R167 M170 Y171 Y175	R167-S173 WeakPolarHBondContact O-CB 3.11Å; R167-S173 PolarHBondContact O-OG 3.33Å; M170-S173 WeakPolarHBondContact O-CB 3.45Å; M170-S173 PolarHBondContact O-N 3.34Å; Y171-S173 PolarHBondContact O-N 2.94Å; Y171-S173 VanDerWaalsContact O-N 3.12Å; S173-Y175 PolarHBondContact O-N 3.47Å; S173-Y175 WeakPolarHBondContact OG-CD2 3.23Å
174	P	82.9	Confident	86	Confident	107 Å²	107	60.5 Å²	60.5	70%	0.695	28%	0.283	S	S	*	.			trans	-73.1	-17.1	-172.1	30.3	-36.5	0	0	0	113
175	Y	86.6	Confident	86	Confident	32 Å²	32	60.4 Å²	60.4	13%	0.125	28%	0.282	C	S	.	.			trans	-75.6	135	-177.1	-48.7	-66.9	0	0	0	110.4	R102 R167 S173 C181 T184 V185	R102-Y175 PolarHBondContact NH1-O 2.77Å; R102-Y175 PolarHBondContact NH2-O 2.96Å; R167-Y175 HydrophobicContact CB-CD2 4.41Å; R167-Y175 HydrophobicContact CB-CE2 3.95Å; S173-Y175 PolarHBondContact O-N 3.47Å; S173-Y175 WeakPolarHBondContact OG-CD2 3.23Å; Y175-C181 VanDerWaalsContact CD1-CA 3.5Å; Y175-C181 HydrophobicContact CD1-CB 3.94Å; Y175-C181 HydrophobicContact CD2-CB 4.2Å; Y175-C181 VanDerWaalsContact CD2-SG 3.56Å; Y175-C181 HydrophobicContact CG-CB 3.69Å; Y175-T184 HydrophobicContact CD1-CG2 4.4Å; Y175-T184 HydrophobicContact CE1-CG2 3.72Å; Y175-V185 HydrophobicContact CE1-CG2 4.46Å
176	R	82.4	Confident	86.2	Confident	226 Å²	226	62 Å²	62	85%	0.853	29%	0.294	S	S	*	.			trans	-82.2	-35	178.3	-70.7	-176.5	166.1	-153	-3.4	112.5	R102 D180	R102-R176 PolarHBondContact NH2-O 2.9Å; R176-D180 PolarHBondContact N-OD2 3.48Å
177	G	86.8	Confident	86.4	Confident	24 Å²	24	69 Å²	69	25%	0.247	33%	0.326	C	S	.	.	S	Bend	trans	-156.1	-177.5	-179.6	0	0	0	0	0	113.1	D180 C181	G177-D180 PolarHBondContact O-N 2.97Å; G177-C181 PolarHBondContact O-N 3.23Å
178	L	88.3	Confident	86.3	Confident	26 Å²	26	71.6 Å²	71.6	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-55.2	-58.8	-179.4	166.4	52.9	0	0	0	111.9	I106 M109 V164 D180 C181 V182	I106-L178 HydrophobicContact CB-CD1 3.64Å; I106-L178 HydrophobicContact CB-CD2 4.04Å; I106-L178 HydrophobicContact CB-CG 4.4Å; I106-L178 HydrophobicContact CD1-CD1 3.66Å; I106-L178 HydrophobicContact CD1-CD2 4.03Å; I106-L178 HydrophobicContact CD1-CG 4.48Å; I106-L178 HydrophobicContact CG1-CD1 3.6Å; I106-L178 HydrophobicContact CG1-CD2 4.46Å; I106-L178 HydrophobicContact CG2-CD1 4.4Å; M109-L178 HydrophobicContact SD-CD2 3.84Å; V164-L178 HydrophobicContact CG1-CD1 3.61Å; L178-D180 VanDerWaalsContact C-N 3.26Å; L178-D180 PolarHBondContact O-N 2.82Å; L178-C181 WeakPolarHBondContact O-CB 3.41Å; L178-C181 PolarHBondContact O-N 3.14Å; L178-C181 VanDerWaalsContact O-N 3.09Å; L178-V182 HydrophobicContact CD1-CG2 3.84Å; L178-V182 WeakPolarHBondContact O-CG2 3.22Å; L178-V182 PolarHBondContact O-N 2.67Å
179	W	89.9	Confident	86.1	Confident	184 Å²	184	72.8 Å²	72.8	70%	0.697	36%	0.355	S	S	*	.	H	α-helix	trans	-65.5	-32	-175.1	-62.2	116.2	0	0	0	113	M109 R183	M109-W179 HydrophobicContact CE-CH2 4.45Å; M109-W179 HydrophobicContact CE-CZ2 4.31Å; W179-R183 WeakPolarHBondContact O-CB 3.48Å; W179-R183 PolarHBondContact O-N 3.17Å
180	D	91.3	Very high	86.3	Confident	62 Å²	62	74 Å²	74	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-43	173.4	-177.7	46.6	0	0	0	111.3	R176 G177 L178 T184	R176-D180 PolarHBondContact N-OD2 3.48Å; G177-D180 PolarHBondContact O-N 2.97Å; L178-D180 VanDerWaalsContact C-N 3.26Å; L178-D180 PolarHBondContact O-N 2.82Å; D180-T184 VanDerWaalsContact O-CB 3.24Å; D180-T184 WeakPolarHBondContact O-CB 3.39Å; D180-T184 PolarHBondContact O-N 2.94Å; D180-T184 PolarHBondContact O-OG1 2.94Å
181	C	89.9	Confident	86.5	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.9	-52.2	173.4	-169.4	0	0	0	0	111.4	V164 M168 Y175 G177 L178 R183 T184 V185	V164-C181 HydrophobicContact CG1-CB 4.07Å; M168-C181 HydrophobicContact CG-CB 4.16Å; M168-C181 HydrophobicContact SD-CB 4.43Å; Y175-C181 VanDerWaalsContact CD1-CA 3.5Å; Y175-C181 HydrophobicContact CD1-CB 3.94Å; Y175-C181 HydrophobicContact CD2-CB 4.2Å; Y175-C181 VanDerWaalsContact CD2-SG 3.56Å; Y175-C181 HydrophobicContact CG-CB 3.69Å; G177-C181 PolarHBondContact O-N 3.23Å; L178-C181 WeakPolarHBondContact O-CB 3.41Å; L178-C181 PolarHBondContact O-N 3.14Å; L178-C181 VanDerWaalsContact O-N 3.09Å; C181-R183 VanDerWaalsContact C-N 3.35Å; C181-R183 PolarHBondContact O-N 3.23Å; C181-T184 PolarHBondContact O-N 3.21Å; C181-V185 WeakPolarHBondContact O-CB 3.43Å; C181-V185 VanDerWaalsContact O-CG2 3.23Å; C181-V185 WeakPolarHBondContact O-CG2 3.23Å; C181-V185 PolarHBondContact O-N 3.17Å
182	V	91.1	Very high	86.9	Confident	37 Å²	37	76.1 Å²	76.1	22%	0.224	40%	0.402	C	S	.	.	H	α-helix	trans	-56.8	-49.4	179.7	172.3	0	0	0	0	110.8	V164 L178 T184 V185 T186 F194	V164-V182 HydrophobicContact CG2-CG2 3.83Å; L178-V182 HydrophobicContact CD1-CG2 3.84Å; L178-V182 WeakPolarHBondContact O-CG2 3.22Å; L178-V182 PolarHBondContact O-N 2.67Å; V182-T184 PolarHBondContact O-N 3.23Å; V182-V185 PolarHBondContact O-N 2.69Å; V182-T186 HydrophobicContact CG1-CG2 4.36Å; V182-T186 VanDerWaalsContact O-CG2 3.31Å; V182-T186 WeakPolarHBondContact O-CG2 3.01Å; V182-T186 PolarHBondContact O-N 3.07Å; V182-T186 PolarHBondContact O-OG1 3.27Å; V182-T186 VanDerWaalsContact O-OG1 3.05Å; V182-F194 HydrophobicContact CG1-CZ 4.25Å
183	R	92.6	Very high	87.2	Confident	191 Å²	191	70.1 Å²	70.1	72%	0.721	37%	0.371	S	S	*	.	H	α-helix	trans	-63.3	-42.1	-179.7	-176.5	179.3	-179.6	174.1	1	112.7	W179 C181 T186 H187	W179-R183 WeakPolarHBondContact O-CB 3.48Å; W179-R183 PolarHBondContact O-N 3.17Å; C181-R183 VanDerWaalsContact C-N 3.35Å; C181-R183 PolarHBondContact O-N 3.23Å; R183-T186 WeakPolarHBondContact CA-OG1 3.45Å; R183-T186 PolarHBondContact O-OG1 3.14Å; R183-H187 VanDerWaalsContact O-CB 3.28Å; R183-H187 WeakPolarHBondContact O-CB 3.19Å; R183-H187 PolarHBondContact O-N 3.42Å
184	T	89.9	Confident	87.4	Confident	58 Å²	58	70.3 Å²	70.3	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-42	-179.6	-57.9	0	0	0	0	110.6	Y175 D180 C181 V182 H187 A188	Y175-T184 HydrophobicContact CD1-CG2 4.4Å; Y175-T184 HydrophobicContact CE1-CG2 3.72Å; D180-T184 VanDerWaalsContact O-CB 3.24Å; D180-T184 WeakPolarHBondContact O-CB 3.39Å; D180-T184 PolarHBondContact O-N 2.94Å; D180-T184 PolarHBondContact O-OG1 2.94Å; C181-T184 PolarHBondContact O-N 3.21Å; V182-T184 PolarHBondContact O-N 3.23Å; T184-H187 PolarHBondContact O-N 3.38Å; T184-A188 WeakPolarHBondContact O-CB 3.44Å; T184-A188 PolarHBondContact O-N 2.9Å
185	V	88.9	Confident	87.6	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-66.9	-44.4	178	175.2	0	0	0	0	111.4	Y175 C181 V182 H187 E189 G190 A193 F194	Y175-V185 HydrophobicContact CE1-CG2 4.46Å; C181-V185 WeakPolarHBondContact O-CB 3.43Å; C181-V185 VanDerWaalsContact O-CG2 3.23Å; C181-V185 WeakPolarHBondContact O-CG2 3.23Å; C181-V185 PolarHBondContact O-N 3.17Å; V182-V185 PolarHBondContact O-N 2.69Å; V185-H187 VanDerWaalsContact C-N 3.32Å; V185-H187 PolarHBondContact O-N 3.49Å; V185-E189 PolarHBondContact O-N 3.37Å; V185-G190 PolarHBondContact O-N 3.46Å; V185-A193 HydrophobicContact CG1-CB 3.81Å; V185-F194 HydrophobicContact CB-CZ 3.99Å; V185-F194 HydrophobicContact CG1-CE1 4.28Å; V185-F194 HydrophobicContact CG1-CE2 3.94Å; V185-F194 HydrophobicContact CG1-CZ 3.75Å
186	T	91.1	Very high	87.1	Confident	55 Å²	55	70.3 Å²	70.3	34%	0.337	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-41	176.7	52.6	0	0	0	0	111.9	V182 R183 G190 F194	V182-T186 HydrophobicContact CG1-CG2 4.36Å; V182-T186 VanDerWaalsContact O-CG2 3.31Å; V182-T186 WeakPolarHBondContact O-CG2 3.01Å; V182-T186 PolarHBondContact O-N 3.07Å; V182-T186 PolarHBondContact O-OG1 3.27Å; V182-T186 VanDerWaalsContact O-OG1 3.05Å; R183-T186 WeakPolarHBondContact CA-OG1 3.45Å; R183-T186 PolarHBondContact O-OG1 3.14Å; T186-G190 WeakPolarHBondContact O-CA 3.39Å; T186-G190 PolarHBondContact O-N 3.29Å; T186-G190 VanDerWaalsContact O-N 3.14Å; T186-F194 HydrophobicContact CG2-CE2 3.48Å; T186-F194 VanDerWaalsContact CG2-CE2 3.48Å; T186-F194 HydrophobicContact CG2-CZ 3.89Å
187	H	88.5	Confident	86.5	Confident	172 Å²	172	59.5 Å²	59.5	80%	0.796	32%	0.316	S	S	*	.	H	α-helix	trans	-76.9	-36.9	-178.3	-168.7	-76.6	0	0	0	113.2	R183 T184 V185	R183-H187 VanDerWaalsContact O-CB 3.28Å; R183-H187 WeakPolarHBondContact O-CB 3.19Å; R183-H187 PolarHBondContact O-N 3.42Å; T184-H187 PolarHBondContact O-N 3.38Å; V185-H187 VanDerWaalsContact C-N 3.32Å; V185-H187 PolarHBondContact O-N 3.49Å
188	A	86.3	Confident	86.1	Confident	65 Å²	65	60.6 Å²	60.6	54%	0.537	31%	0.313	S	S	.	.	H	α-helix	trans	-85.5	-38.1	-176.4	0	0	0	0	0	113.3	T184	T184-A188 WeakPolarHBondContact O-CB 3.44Å; T184-A188 PolarHBondContact O-N 2.9Å
189	E	82.1	Confident	85.3	Confident	33 Å²	33	62.5 Å²	62.5	15%	0.154	33%	0.329	C	S	.	.	H	α-helix	trans	-119.6	-9.8	-171.2	-48.9	-164.1	-155	0	0	114	R167 V185 A193 R196 H275	R167-E189 IonicContact CZ-OE1 3.77Å; R167-E189 IonicContact CZ-OE2 3.64Å; R167-E189 IonicContact NH1-OE1 3.85Å; R167-E189 PolarHBondContact NH1-OE1 2.97Å; R167-E189 VanDerWaalsContact NH2-CD 3.26Å; R167-E189 IonicContact NH2-OE1 3.47Å; R167-E189 PolarHBondContact NH2-OE1 3.43Å; R167-E189 IonicContact NH2-OE2 3.43Å; R167-E189 PolarHBondContact NH2-OE2 3.46Å; V185-E189 PolarHBondContact O-N 3.37Å; E189-A193 HydrophobicContact CB-CB 3.64Å; E189-R196 IonicContact OE2-CZ 3.9Å; E189-R196 IonicContact OE2-NH1 3.09Å; E189-R196 PolarHBondContact OE2-NH1 3.29Å; E189-R196 VanDerWaalsContact OE2-NH1 3.09Å; E189-R196 IonicContact OE2-NH2 3.85Å; E189-H275 WeakPolarHBondContact CG-NE2 3.39Å; E189-H275 IonicContact OE2-CD2 3.69Å
190	G	87.6	Confident	84.2	Confident	28 Å²	28	53.8 Å²	53.8	29%	0.289	30%	0.296	S	S	.	.			trans	80.7	172.2	-175.9	0	0	0	0	0	114.2	V185 T186 G192 A193	V185-G190 PolarHBondContact O-N 3.46Å; T186-G190 WeakPolarHBondContact O-CA 3.39Å; T186-G190 PolarHBondContact O-N 3.29Å; T186-G190 VanDerWaalsContact O-N 3.14Å; G190-G192 PolarHBondContact O-N 2.87Å; G190-A193 WeakPolarHBondContact O-CB 3.49Å; G190-A193 PolarHBondContact O-N 3.38Å
191	V	86.4	Confident	83.1	Confident	104 Å²	104	50.9 Å²	50.9	63%	0.63	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-66	-27	-179	-175.6	0	0	0	0	112.2	A193 F194	V191-A193 PolarHBondContact O-N 3.35Å; V191-A193 VanDerWaalsContact O-N 3.15Å; V191-F194 WeakPolarHBondContact O-CD2 3.45Å; V191-F194 PolarHBondContact O-N 3.48Å
192	G	83.9	Confident	82.2	Confident	53 Å²	53	52.8 Å²	52.8	55%	0.546	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-63	-18.3	176.1	0	0	0	0	0	114.2	G190 F194 Y195 R196	G190-G192 PolarHBondContact O-N 2.87Å; G192-F194 VanDerWaalsContact C-N 3.27Å; G192-F194 PolarHBondContact O-N 3.07Å; G192-Y195 PolarHBondContact O-N 3.25Å; G192-R196 PolarHBondContact O-N 2.84Å
193	A	83.3	Confident	81.3	Confident	3 Å²	3	54.7 Å²	54.7	3%	0.025	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-63.8	-31.3	176.8	0	0	0	0	0	112.8	V185 E189 G190 V191 Y195	V185-A193 HydrophobicContact CG1-CB 3.81Å; E189-A193 HydrophobicContact CB-CB 3.64Å; G190-A193 WeakPolarHBondContact O-CB 3.49Å; G190-A193 PolarHBondContact O-N 3.38Å; V191-A193 PolarHBondContact O-N 3.35Å; V191-A193 VanDerWaalsContact O-N 3.15Å; A193-Y195 PolarHBondContact O-N 3.46Å
194	F	86.4	Confident	80.3	Confident	15 Å²	15	46.2 Å²	46.2	7%	0.066	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-73.4	-11.4	-180	-63.8	-83.4	0	0	0	114.2	N159 P160 V163 V164 V182 V185 T186 V191 G192	N159-F194 PolarHBondContact ND2-O 2.98Å; P160-F194 HydrophobicContact CB-CB 4.13Å; P160-F194 HydrophobicContact CB-CD1 4.08Å; P160-F194 HydrophobicContact CB-CG 4.42Å; P160-F194 HydrophobicContact CG-CB 4.31Å; V163-F194 HydrophobicContact CG1-CD1 4.43Å; V164-F194 HydrophobicContact CG2-CD1 4.34Å; V164-F194 HydrophobicContact CG2-CE1 3.73Å; V182-F194 HydrophobicContact CG1-CZ 4.25Å; V185-F194 HydrophobicContact CB-CZ 3.99Å; V185-F194 HydrophobicContact CG1-CE1 4.28Å; V185-F194 HydrophobicContact CG1-CE2 3.94Å; V185-F194 HydrophobicContact CG1-CZ 3.75Å; T186-F194 HydrophobicContact CG2-CE2 3.48Å; T186-F194 VanDerWaalsContact CG2-CE2 3.48Å; T186-F194 HydrophobicContact CG2-CZ 3.89Å; V191-F194 WeakPolarHBondContact O-CD2 3.45Å; V191-F194 PolarHBondContact O-N 3.48Å; G192-F194 VanDerWaalsContact C-N 3.27Å; G192-F194 PolarHBondContact O-N 3.07Å
195	Y	86.3	Confident	79.4	Confident	103 Å²	103	45.4 Å²	45.4	40%	0.404	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-123.9	4.5	-178.7	-72.5	-84.3	0	0	0	112.9	A156 P160 G192 A193 S197 Y198	A156-Y195 WeakPolarHBondContact O-CE1 3.19Å; A156-Y195 PolarHBondContact O-OH 3.48Å; P160-Y195 HydrophobicContact CG-CE1 4.33Å; P160-Y195 HydrophobicContact CG-CE2 3.9Å; P160-Y195 WeakPolarHBondContact CG-OH 3.44Å; G192-Y195 PolarHBondContact O-N 3.25Å; A193-Y195 PolarHBondContact O-N 3.46Å; Y195-S197 PolarHBondContact O-N 2.9Å; Y195-Y198 HydrophobicContact CD1-CG 4.41Å; Y195-Y198 VanDerWaalsContact O-CB 3.24Å; Y195-Y198 WeakPolarHBondContact O-CB 3.49Å; Y195-Y198 PolarHBondContact O-N 3.15Å
196	R	76.3	Confident	78.5	Confident	36 Å²	36	51.3 Å²	51.3	14%	0.136	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-32.1	-174.3	-162	178.7	-71.1	149.1	-1.6	112.8	E189 G192 L276	E189-R196 IonicContact OE2-CZ 3.9Å; E189-R196 IonicContact OE2-NH1 3.09Å; E189-R196 PolarHBondContact OE2-NH1 3.29Å; E189-R196 VanDerWaalsContact OE2-NH1 3.09Å; E189-R196 IonicContact OE2-NH2 3.85Å; G192-R196 PolarHBondContact O-N 2.84Å; R196-L276 WeakPolarHBondContact CD-O 3.14Å
197	S	70.7	Confident	77.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.5	175.7	63.5	0	0	0	0	115.1	N159 Y195 S199 T200 Q201 N260	N159-S197 PolarHBondContact ND2-OG 2.95Å; N159-S197 PolarHBondContact OD1-OG 3.37Å; Y195-S197 PolarHBondContact O-N 2.9Å; S197-S199 PolarHBondContact O-N 3.45Å; S197-T200 WeakPolarHBondContact CA-OG1 2.86Å; S197-T200 CarbonylContact O-C 3.4Å; S197-T200 WeakPolarHBondContact O-CA 3.4Å; S197-T200 VanDerWaalsContact O-CB 3.25Å; S197-T200 WeakPolarHBondContact O-CB 3.45Å; S197-T200 PolarHBondContact O-N 2.91Å; S197-T200 VanDerWaalsContact O-N 3.08Å; S197-T200 PolarHBondContact O-OG1 3.2Å; S197-Q201 WeakPolarHBondContact O-CB 3.38Å; S197-Q201 PolarHBondContact O-N 3.34Å; S197-N260 VanDerWaalsContact CB-CG 3.47Å; S197-N260 WeakPolarHBondContact CB-OD1 3.4Å; S197-N260 PolarHBondContact OG-ND2 3.27Å; S197-N260 PolarHBondContact OG-OD1 2.97Å
198	Y	77.6	Confident	77.1	Confident	46 Å²	46	44.5 Å²	44.5	18%	0.18	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-44.4	-168.7	179.2	-113.7	0	0	0	111.4	V152 D155 A156 N159 Y195 T200 Q201 L202	V152-Y198 VanDerWaalsContact CG1-OH 3.24Å; V152-Y198 WeakPolarHBondContact CG1-OH 3.49Å; V152-Y198 PolarHBondContact O-OH 3.38Å; D155-Y198 HydrophobicContact CB-CD2 4.46Å; D155-Y198 HydrophobicContact CB-CE2 3.75Å; A156-Y198 HydrophobicContact CB-CE2 4.04Å; N159-Y198 HydrophobicContact CB-CD2 4.24Å; Y195-Y198 HydrophobicContact CD1-CG 4.41Å; Y195-Y198 VanDerWaalsContact O-CB 3.24Å; Y195-Y198 WeakPolarHBondContact O-CB 3.49Å; Y195-Y198 PolarHBondContact O-N 3.15Å; Y198-T200 VanDerWaalsContact C-N 3.29Å; Y198-T200 PolarHBondContact O-N 3.29Å; Y198-Q201 WeakPolarHBondContact O-CB 3.3Å; Y198-Q201 PolarHBondContact O-N 2.85Å; Y198-L202 HydrophobicContact CD1-CD1 4.32Å; Y198-L202 HydrophobicContact CE1-CD1 3.78Å; Y198-L202 HydrophobicContact CE2-CD1 4.39Å; Y198-L202 HydrophobicContact CE2-CD2 4.45Å; Y198-L202 HydrophobicContact CE2-CG 4.38Å; Y198-L202 WeakPolarHBondContact O-CG 3.17Å; Y198-L202 PolarHBondContact O-N 3.1Å
199	S	71.1	Confident	76.3	Confident	67 Å²	67	46 Å²	46	47%	0.469	26%	0.259	S	S	.	.	H	α-helix	trans	-59.9	-39.3	172.9	57	0	0	0	0	112.7	S197 T203	S197-S199 PolarHBondContact O-N 3.45Å; S199-T203 WeakPolarHBondContact O-CB 2.8Å; S199-T203 PolarHBondContact O-N 2.86Å; S199-T203 PolarHBondContact O-OG1 3.05Å
200	T	67.8	Low	75.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-39.8	177.2	-23.4	0	0	0	0	111.9	S197 Y198 T203 M204 K256 L259 M279	S197-T200 WeakPolarHBondContact CA-OG1 2.86Å; S197-T200 CarbonylContact O-C 3.4Å; S197-T200 WeakPolarHBondContact O-CA 3.4Å; S197-T200 VanDerWaalsContact O-CB 3.25Å; S197-T200 WeakPolarHBondContact O-CB 3.45Å; S197-T200 PolarHBondContact O-N 2.91Å; S197-T200 VanDerWaalsContact O-N 3.08Å; S197-T200 PolarHBondContact O-OG1 3.2Å; Y198-T200 VanDerWaalsContact C-N 3.29Å; Y198-T200 PolarHBondContact O-N 3.29Å; T200-T203 PolarHBondContact O-N 3.18Å; T200-M204 WeakPolarHBondContact O-CB 3.26Å; T200-M204 PolarHBondContact O-N 2.81Å; T200-K256 HydrophobicContact CG2-CB 4.15Å; T200-L259 HydrophobicContact CG2-CD1 4.02Å; T200-L259 WeakPolarHBondContact OG1-CD1 3.39Å; T200-M279 HydrophobicContact CG2-CE 3.79Å; T200-M279 HydrophobicContact CG2-SD 3.26Å; T200-M279 WeakPolarHBondContact CG2-SD 3.34Å
201	Q	68.2	Low	75.2	Confident	1 Å²	1	47 Å²	47	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-48.1	177.7	-175.1	177.5	101.3	0	0	110.6	D155 N159 E162 S197 Y198 T203 M204 N205 K256	D155-Q201 VanDerWaalsContact CG-OE1 3.24Å; D155-Q201 PolarHBondContact OD2-OE1 3.28Å; N159-Q201 PolarHBondContact OD1-NE2 3Å; E162-Q201 PolarHBondContact OE2-NE2 3.26Å; S197-Q201 WeakPolarHBondContact O-CB 3.38Å; S197-Q201 PolarHBondContact O-N 3.34Å; Y198-Q201 WeakPolarHBondContact O-CB 3.3Å; Y198-Q201 PolarHBondContact O-N 2.85Å; Q201-T203 PolarHBondContact O-N 3.45Å; Q201-M204 PolarHBondContact O-N 3.47Å; Q201-M204 VanDerWaalsContact O-N 3.13Å; Q201-N205 WeakPolarHBondContact O-CB 3.45Å; Q201-N205 PolarHBondContact O-N 3.42Å; Q201-N205 PolarHBondContact O-OD1 2.91Å; Q201-K256 HydrophobicContact CB-CD 4.36Å
202	L	70.8	Confident	74.7	Confident	40 Å²	40	43.9 Å²	43.9	21%	0.209	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-43.5	175.8	-65	179	0	0	0	112.2	V152 Y198 M204 N205 I206	V152-L202 HydrophobicContact CB-CD2 4.43Å; V152-L202 HydrophobicContact CG2-CD2 3.85Å; Y198-L202 HydrophobicContact CD1-CD1 4.32Å; Y198-L202 HydrophobicContact CE1-CD1 3.78Å; Y198-L202 HydrophobicContact CE2-CD1 4.39Å; Y198-L202 HydrophobicContact CE2-CD2 4.45Å; Y198-L202 HydrophobicContact CE2-CG 4.38Å; Y198-L202 WeakPolarHBondContact O-CG 3.17Å; Y198-L202 PolarHBondContact O-N 3.1Å; L202-M204 PolarHBondContact O-N 3.15Å; L202-N205 PolarHBondContact O-N 2.84Å; L202-I206 PolarHBondContact O-N 3.32Å
203	T	71.7	Confident	74.1	Confident	77 Å²	77	47 Å²	47	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-65.9	-22.9	178.1	-53.3	0	0	0	0	112.4	S199 T200 Q201 P207	S199-T203 WeakPolarHBondContact O-CB 2.8Å; S199-T203 PolarHBondContact O-N 2.86Å; S199-T203 PolarHBondContact O-OG1 3.05Å; T200-T203 PolarHBondContact O-N 3.18Å; Q201-T203 PolarHBondContact O-N 3.45Å; T203-P207 WeakPolarHBondContact O-CD 3.35Å; T203-P207 VanDerWaalsContact O-CG 3.25Å; T203-P207 WeakPolarHBondContact O-CG 3.32Å
204	M	72.6	Confident	73.6	Confident	13 Å²	13	52 Å²	52	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-88.4	-41.1	176.5	-174.8	-168.7	77.1	0	0	112.7	T200 Q201 L202 I206 P207 F208 L252 D253 K256	T200-M204 WeakPolarHBondContact O-CB 3.26Å; T200-M204 PolarHBondContact O-N 2.81Å; Q201-M204 PolarHBondContact O-N 3.47Å; Q201-M204 VanDerWaalsContact O-N 3.13Å; L202-M204 PolarHBondContact O-N 3.15Å; M204-I206 VanDerWaalsContact C-N 3.35Å; M204-I206 PolarHBondContact O-N 3.13Å; M204-P207 WeakPolarHBondContact O-CD 3.22Å; M204-F208 WeakPolarHBondContact O-CB 3.18Å; M204-F208 PolarHBondContact O-N 2.92Å; M204-F208 VanDerWaalsContact O-N 3.08Å; M204-L252 HydrophobicContact CB-CB 4.17Å; M204-L252 HydrophobicContact CG-CB 3.96Å; M204-D253 HydrophobicContact SD-CB 3.67Å; M204-K256 HydrophobicContact CE-CD 4.34Å; M204-K256 HydrophobicContact SD-CD 4.43Å
205	N	69.6	Low	73	Confident	40 Å²	40	52.4 Å²	52.4	21%	0.214	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-40.4	-174.1	-72.9	-4.5	0	0	0	111.2	D155 Q201 L202 F208 Q209	D155-N205 PolarHBondContact OD2-ND2 3.46Å; Q201-N205 WeakPolarHBondContact O-CB 3.45Å; Q201-N205 PolarHBondContact O-N 3.42Å; Q201-N205 PolarHBondContact O-OD1 2.91Å; L202-N205 PolarHBondContact O-N 2.84Å; N205-F208 PolarHBondContact O-N 3.38Å; N205-Q209 VanDerWaalsContact O-CG 3.31Å; N205-Q209 WeakPolarHBondContact O-CG 3.43Å; N205-Q209 PolarHBondContact O-N 3.47Å
206	I	71.1	Confident	72.5	Confident	126 Å²	126	49 Å²	49	65%	0.646	26%	0.259	S	S	*	.	H	α-helix	trans	-62.1	-53.7	-179.6	-64.6	166.8	0	0	0	111.8	L202 M204 F208 Q209 A210	L202-I206 PolarHBondContact O-N 3.32Å; M204-I206 VanDerWaalsContact C-N 3.35Å; M204-I206 PolarHBondContact O-N 3.13Å; I206-F208 VanDerWaalsContact C-N 3.32Å; I206-F208 PolarHBondContact O-N 3.43Å; I206-Q209 PolarHBondContact O-N 3.43Å; I206-A210 WeakPolarHBondContact O-CB 3.38Å; I206-A210 PolarHBondContact O-N 3.39Å
207	P	75.6	Confident	72.4	Confident	48 Å²	48	49.8 Å²	49.8	31%	0.312	26%	0.264	S	S	.	.	H	α-helix	trans	-60.4	-37.4	174.1	-25.4	33.4	0	0	0	113.9	T203 M204 V211 T249 L252	T203-P207 WeakPolarHBondContact O-CD 3.35Å; T203-P207 VanDerWaalsContact O-CG 3.25Å; T203-P207 WeakPolarHBondContact O-CG 3.32Å; M204-P207 WeakPolarHBondContact O-CD 3.22Å; P207-V211 VanDerWaalsContact O-CG2 3.3Å; P207-V211 WeakPolarHBondContact O-CG2 3.49Å; P207-V211 PolarHBondContact O-N 2.86Å; P207-V211 VanDerWaalsContact O-N 3.08Å; P207-T249 HydrophobicContact CB-CG2 4.17Å; P207-L252 HydrophobicContact CG-CD1 4.39Å
208	F	74.3	Confident	72.8	Confident	36 Å²	36	53.9 Å²	53.9	16%	0.158	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-51.1	179.1	-178.2	-90.8	0	0	0	110.8	M204 N205 I206 A210 V211 H212 T249	M204-F208 WeakPolarHBondContact O-CB 3.18Å; M204-F208 PolarHBondContact O-N 2.92Å; M204-F208 VanDerWaalsContact O-N 3.08Å; N205-F208 PolarHBondContact O-N 3.38Å; I206-F208 VanDerWaalsContact C-N 3.32Å; I206-F208 PolarHBondContact O-N 3.43Å; F208-A210 PolarHBondContact O-N 3.3Å; F208-V211 PolarHBondContact O-N 3.47Å; F208-H212 VanDerWaalsContact O-CB 3.27Å; F208-H212 WeakPolarHBondContact O-CB 3.19Å; F208-H212 PolarHBondContact O-N 3.33Å; F208-T249 HydrophobicContact CB-CG2 3.95Å; F208-T249 HydrophobicContact CD2-CG2 4.36Å
209	Q	69.4	Low	73	Confident	95 Å²	95	53.9 Å²	53.9	44%	0.444	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-43.4	-179.7	-67.1	-65.8	83.1	0	0	111.4	N205 I206 V211 H212 F213	N205-Q209 VanDerWaalsContact O-CG 3.31Å; N205-Q209 WeakPolarHBondContact O-CG 3.43Å; N205-Q209 PolarHBondContact O-N 3.47Å; I206-Q209 PolarHBondContact O-N 3.43Å; Q209-V211 PolarHBondContact O-N 3.42Å; Q209-H212 WeakPolarHBondContact O-CB 3.37Å; Q209-H212 PolarHBondContact O-N 3.28Å; Q209-F213 WeakPolarHBondContact O-CD2 3.38Å; Q209-F213 PolarHBondContact O-N 2.87Å
210	A	70.5	Confident	73.2	Confident	48 Å²	48	51.1 Å²	51.1	40%	0.397	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-48.3	179.4	0	0	0	0	0	112.4	I206 F208 H212 I214	I206-A210 WeakPolarHBondContact O-CB 3.38Å; I206-A210 PolarHBondContact O-N 3.39Å; F208-A210 PolarHBondContact O-N 3.3Å; A210-H212 VanDerWaalsContact C-N 3.29Å; A210-H212 PolarHBondContact O-N 3.09Å; A210-I214 WeakPolarHBondContact O-CD1 3.19Å; A210-I214 VanDerWaalsContact O-CG1 3.26Å; A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 2.7Å; A210-I214 VanDerWaalsContact O-N 3.14Å
211	V	75	Confident	73.8	Confident	34 Å²	34	56.6 Å²	56.6	21%	0.206	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-35.9	177.8	177	0	0	0	0	111	P207 F208 Q209 T215 V244 V248	P207-V211 VanDerWaalsContact O-CG2 3.3Å; P207-V211 WeakPolarHBondContact O-CG2 3.49Å; P207-V211 PolarHBondContact O-N 2.86Å; P207-V211 VanDerWaalsContact O-N 3.08Å; F208-V211 PolarHBondContact O-N 3.47Å; Q209-V211 PolarHBondContact O-N 3.42Å; V211-T215 VanDerWaalsContact O-CB 3.28Å; V211-T215 WeakPolarHBondContact O-CB 3.48Å; V211-T215 PolarHBondContact O-N 2.88Å; V211-T215 PolarHBondContact O-OG1 3.22Å; V211-V244 HydrophobicContact CG1-CG1 3.96Å; V211-V248 HydrophobicContact CG1-CG2 4.42Å; V211-V248 HydrophobicContact CG2-CG1 4.24Å
212	H	75.8	Confident	74.5	Confident	39 Å²	39	63.2 Å²	63.2	18%	0.181	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-53	179.5	-171.4	89.7	0	0	0	110.8	F208 Q209 A210 I214 T215 Y216 A241 G242 S245	F208-H212 VanDerWaalsContact O-CB 3.27Å; F208-H212 WeakPolarHBondContact O-CB 3.19Å; F208-H212 PolarHBondContact O-N 3.33Å; Q209-H212 WeakPolarHBondContact O-CB 3.37Å; Q209-H212 PolarHBondContact O-N 3.28Å; A210-H212 VanDerWaalsContact C-N 3.29Å; A210-H212 PolarHBondContact O-N 3.09Å; H212-I214 PolarHBondContact O-N 3.39Å; H212-T215 PolarHBondContact O-N 3.46Å; H212-Y216 WeakPolarHBondContact O-CB 3.43Å; H212-Y216 PolarHBondContact O-N 3.43Å; H212-A241 WeakPolarHBondContact O-CB 3.28Å; H212-G242 WeakPolarHBondContact ND1-CA 3.47Å; H212-G242 PolarHBondContact ND1-N 3.17Å; H212-S245 WeakPolarHBondContact CA-OG 3.49Å; H212-S245 WeakPolarHBondContact CB-OG 3.27Å; H212-S245 PolarHBondContact N-OG 3.48Å
213	F	72.1	Confident	74.8	Confident	120 Å²	120	65.2 Å²	65.2	53%	0.526	34%	0.335	S	S	.	.	H	α-helix	trans	-59	-49.1	178.6	-83.1	-68.8	0	0	0	112	Q209 T215 Y216 E217	Q209-F213 WeakPolarHBondContact O-CD2 3.38Å; Q209-F213 PolarHBondContact O-N 2.87Å; F213-T215 VanDerWaalsContact C-N 3.34Å; F213-T215 PolarHBondContact O-N 3.29Å; F213-Y216 PolarHBondContact O-N 3.01Å; F213-E217 WeakPolarHBondContact O-CG 3.26Å; F213-E217 PolarHBondContact O-N 3.46Å
214	I	73.8	Confident	75.2	Confident	108 Å²	108	62.3 Å²	62.3	55%	0.554	32%	0.316	S	S	*	.	H	α-helix	trans	-59.4	-46.9	-179.8	-67.1	166.3	0	0	0	110.8	A210 H212 Y216 L218	A210-I214 WeakPolarHBondContact O-CD1 3.19Å; A210-I214 VanDerWaalsContact O-CG1 3.26Å; A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 2.7Å; A210-I214 VanDerWaalsContact O-N 3.14Å; H212-I214 PolarHBondContact O-N 3.39Å; I214-Y216 VanDerWaalsContact C-N 3.34Å; I214-L218 HydrophobicContact CG2-CD1 4.03Å; I214-L218 VanDerWaalsContact O-CG 3.26Å; I214-L218 WeakPolarHBondContact O-CG 3.46Å; I214-L218 PolarHBondContact O-N 3.29Å
215	T	73.8	Confident	75.3	Confident	22 Å²	22	66 Å²	66	14%	0.135	34%	0.341	C	S	.	.	H	α-helix	trans	-69	-36.7	-178.3	-50.8	0	0	0	0	111.4	V211 H212 F213 M219 A241 V244	V211-T215 VanDerWaalsContact O-CB 3.28Å; V211-T215 WeakPolarHBondContact O-CB 3.48Å; V211-T215 PolarHBondContact O-N 2.88Å; V211-T215 PolarHBondContact O-OG1 3.22Å; H212-T215 PolarHBondContact O-N 3.46Å; F213-T215 VanDerWaalsContact C-N 3.34Å; F213-T215 PolarHBondContact O-N 3.29Å; T215-M219 HydrophobicContact CG2-CG 4.41Å; T215-M219 WeakPolarHBondContact O-CB 3.31Å; T215-M219 WeakPolarHBondContact O-CG 3.31Å; T215-M219 PolarHBondContact O-N 2.89Å; T215-A241 HydrophobicContact CG2-CB 4.23Å; T215-V244 HydrophobicContact CG2-CB 4.08Å; T215-V244 HydrophobicContact CG2-CG1 4.41Å; T215-V244 HydrophobicContact CG2-CG2 4.03Å
216	Y	75.8	Confident	75.6	Confident	31 Å²	31	70.2 Å²	70.2	12%	0.122	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-49.6	177.6	173.8	-92.9	0	0	0	111.6	D30 H212 F213 I214 L218 M219 Q220 H234 S237	D30-Y216 PolarHBondContact OD1-OH 3.42Å; H212-Y216 WeakPolarHBondContact O-CB 3.43Å; H212-Y216 PolarHBondContact O-N 3.43Å; F213-Y216 PolarHBondContact O-N 3.01Å; I214-Y216 VanDerWaalsContact C-N 3.34Å; Y216-L218 PolarHBondContact O-N 3.2Å; Y216-M219 PolarHBondContact O-N 2.77Å; Y216-M219 VanDerWaalsContact O-N 3.13Å; Y216-Q220 HydrophobicContact CD1-CG 4.21Å; Y216-Q220 HydrophobicContact CD2-CG 4.49Å; Y216-Q220 HydrophobicContact CE1-CG 3.76Å; Y216-Q220 HydrophobicContact CE2-CG 4.07Å; Y216-Q220 PolarHBondContact O-N 3.5Å; Y216-Q220 PolarHBondContact OH-NE2 3.34Å; Y216-H234 AromaticContact CZ-ND1 3.95Å; Y216-H234 PolarHBondContact OH-CE1 3.06Å; Y216-H234 PolarHBondContact OH-ND1 3.45Å; Y216-S237 VanDerWaalsContact CE2-OG 3.26Å; Y216-S237 WeakPolarHBondContact CE2-OG 3.1Å
217	E	74	Confident	75.6	Confident	53 Å²	53	69.6 Å²	69.6	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-47.4	178.3	-71	-62.2	138.7	0	0	111.2	F213 M219 Q220 E221 R227	F213-E217 WeakPolarHBondContact O-CG 3.26Å; F213-E217 PolarHBondContact O-N 3.46Å; E217-M219 PolarHBondContact O-N 3.5Å; E217-Q220 PolarHBondContact O-N 3.41Å; E217-Q220 VanDerWaalsContact O-N 3.12Å; E217-E221 WeakPolarHBondContact O-CG 3.14Å; E217-E221 PolarHBondContact O-N 3.44Å; E217-R227 IonicContact OE2-NH2 2.75Å; E217-R227 PolarHBondContact OE2-NH2 3.4Å
218	L	79.5	Confident	75.5	Confident	86 Å²	86	73.6 Å²	73.6	45%	0.45	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-34.2	177.5	-69.7	173.5	0	0	0	112.7	I214 Y216 Q222	I214-L218 HydrophobicContact CG2-CD1 4.03Å; I214-L218 VanDerWaalsContact O-CG 3.26Å; I214-L218 WeakPolarHBondContact O-CG 3.46Å; I214-L218 PolarHBondContact O-N 3.29Å; Y216-L218 PolarHBondContact O-N 3.2Å; L218-Q222 WeakPolarHBondContact O-CG 3.5Å
219	M	80.5	Confident	75.2	Confident	47 Å²	47	78.1 Å²	78.1	23%	0.232	38%	0.38	C	S	.	.	H	α-helix	trans	-75.8	-35.7	176.1	-70.4	-68.9	96.5	0	0	112.2	T215 Y216 E217 Q222 L223 A240	T215-M219 HydrophobicContact CG2-CG 4.41Å; T215-M219 WeakPolarHBondContact O-CB 3.31Å; T215-M219 WeakPolarHBondContact O-CG 3.31Å; T215-M219 PolarHBondContact O-N 2.89Å; Y216-M219 PolarHBondContact O-N 2.77Å; Y216-M219 VanDerWaalsContact O-N 3.13Å; E217-M219 PolarHBondContact O-N 3.5Å; M219-Q222 PolarHBondContact O-N 2.83Å; M219-L223 HydrophobicContact CB-CD1 4.46Å; M219-L223 VanDerWaalsContact O-CB 3.28Å; M219-L223 WeakPolarHBondContact O-CB 3.28Å; M219-L223 WeakPolarHBondContact O-CG 3.39Å; M219-L223 PolarHBondContact O-N 3.35Å; M219-A240 HydrophobicContact CG-CB 4.17Å; M219-A240 HydrophobicContact SD-CB 4.31Å
220	Q	76.5	Confident	75.3	Confident	9 Å²	9	76.7 Å²	76.7	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-68.6	-38.5	174.8	-74.9	-70.7	3.2	0	0	112.1	Y216 E217 Q222 L223 N224 S233 H234 S237	Y216-Q220 HydrophobicContact CD1-CG 4.21Å; Y216-Q220 HydrophobicContact CD2-CG 4.49Å; Y216-Q220 HydrophobicContact CE1-CG 3.76Å; Y216-Q220 HydrophobicContact CE2-CG 4.07Å; Y216-Q220 PolarHBondContact O-N 3.5Å; Y216-Q220 PolarHBondContact OH-NE2 3.34Å; E217-Q220 PolarHBondContact O-N 3.41Å; E217-Q220 VanDerWaalsContact O-N 3.12Å; Q220-Q222 PolarHBondContact O-N 2.99Å; Q220-L223 PolarHBondContact O-N 2.87Å; Q220-N224 CarbonylContact O-C 3.55Å; Q220-N224 VanDerWaalsContact O-CA 3.31Å; Q220-N224 WeakPolarHBondContact O-CA 3.3Å; Q220-N224 PolarHBondContact O-N 2.97Å; Q220-N224 VanDerWaalsContact OE1-CB 3.29Å; Q220-S233 PolarHBondContact OE1-OG 3.44Å; Q220-H234 PolarHBondContact NE2-CE1 2.76Å; Q220-H234 PolarHBondContact NE2-ND1 3.37Å; Q220-S237 PolarHBondContact NE2-OG 2.85Å
221	E	79.8	Confident	75.4	Confident	116 Å²	116	76.6 Å²	76.6	54%	0.542	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-32.4	173.3	-75.4	178.8	174.1	0	0	112.3	E217	E217-E221 WeakPolarHBondContact O-CG 3.14Å; E217-E221 PolarHBondContact O-N 3.44Å
222	Q	82.2	Confident	75.4	Confident	139 Å²	139	78.3 Å²	78.3	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-86.2	-43.4	179.2	-67.7	177.7	22.2	0	0	113.3	L218 M219 Q220	L218-Q222 WeakPolarHBondContact O-CG 3.5Å; M219-Q222 PolarHBondContact O-N 2.83Å; Q220-Q222 PolarHBondContact O-N 2.99Å
223	L	78.4	Confident	75.4	Confident	83 Å²	83	76.7 Å²	76.7	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-90.7	-24.3	-172.3	-66.5	169.7	0	0	0	113.3	M219 Q220 S233 V236	M219-L223 HydrophobicContact CB-CD1 4.46Å; M219-L223 VanDerWaalsContact O-CB 3.28Å; M219-L223 WeakPolarHBondContact O-CB 3.28Å; M219-L223 WeakPolarHBondContact O-CG 3.39Å; M219-L223 PolarHBondContact O-N 3.35Å; Q220-L223 PolarHBondContact O-N 2.87Å; L223-S233 WeakPolarHBondContact CB-OG 3.35Å; L223-V236 HydrophobicContact CD1-CB 4.21Å; L223-V236 HydrophobicContact CD1-CG1 3.7Å
224	N	79.1	Confident	75.5	Confident	16 Å²	16	72.7 Å²	72.7	9%	0.086	36%	0.36	C	S	.	.			trans	-142.5	66.3	-179.8	-169.4	23	0	0	0	112.1	Q220 H226 R227 H228 S233	Q220-N224 CarbonylContact O-C 3.55Å; Q220-N224 VanDerWaalsContact O-CA 3.31Å; Q220-N224 WeakPolarHBondContact O-CA 3.3Å; Q220-N224 PolarHBondContact O-N 2.97Å; Q220-N224 VanDerWaalsContact OE1-CB 3.29Å; N224-H226 PolarHBondContact O-N 3.07Å; N224-H226 VanDerWaalsContact O-N 3.09Å; N224-R227 PolarHBondContact O-N 3.27Å; N224-H228 PolarHBondContact ND2-O 3.5Å; N224-H228 PolarHBondContact OD1-N 2.93Å; N224-H228 PolarHBondContact OD1-O 2.91Å; N224-S233 WeakPolarHBondContact CB-OG 3.16Å
225	P	75	Confident	75.6	Confident	89 Å²	89	70.4 Å²	70.4	58%	0.578	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.8	-174.9	-19	29.8	0	0	0	114
226	H	74.8	Confident	76	Confident	130 Å²	130	73.1 Å²	73.1	60%	0.602	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	8.7	-178	-60.3	82	0	0	0	112.8	N224 H228	N224-H226 PolarHBondContact O-N 3.07Å; N224-H226 VanDerWaalsContact O-N 3.09Å; H226-H228 PolarHBondContact O-N 2.74Å
227	R	71.8	Confident	76.2	Confident	113 Å²	113	71.7 Å²	71.7	43%	0.426	36%	0.359	S	S	.	.			trans	47.4	27.3	176.3	-65.4	-171.8	169.1	-147.3	-12	115.7	E217 N224	E217-R227 IonicContact OE2-NH2 2.75Å; E217-R227 PolarHBondContact OE2-NH2 3.4Å; N224-R227 PolarHBondContact O-N 3.27Å
228	H	73.9	Confident	76.3	Confident	131 Å²	131	69.4 Å²	69.4	61%	0.606	35%	0.35	S	S	*	.			trans	-73.8	151.5	174.4	-70	-56	0	0	0	111.1	N224 H226 N230	N224-H228 PolarHBondContact ND2-O 3.5Å; N224-H228 PolarHBondContact OD1-N 2.93Å; N224-H228 PolarHBondContact OD1-O 2.91Å; H226-H228 PolarHBondContact O-N 2.74Å; H228-N230 PolarHBondContact O-N 2.83Å
229	Y	67.4	Low	76.3	Confident	132 Å²	132	65.8 Å²	65.8	52%	0.518	33%	0.333	S	S	.	.			trans	-62.9	103.2	179	-175.6	-104	0	0	0	111.2	P231 W314 E318	Y229-P231 HydrophobicContact CD1-CG 4.33Å; Y229-P231 HydrophobicContact CE1-CG 3.74Å; Y229-W314 HydrophobicContact CE2-CH2 4.36Å; Y229-W314 WeakPolarHBondContact OH-CH2 3.47Å; Y229-E318 PolarHBondContact OH-OE1 2.91Å; Y229-E318 PolarHBondContact OH-OE2 3Å
230	N	72.4	Confident	76.4	Confident	64 Å²	64	65.1 Å²	65.1	34%	0.342	33%	0.334	S	S	.	.			trans	-131	97.2	177.3	-173.4	-18.4	0	0	0	110.5	H228 S232 S233 H234	H228-N230 PolarHBondContact O-N 2.83Å; N230-S232 PolarHBondContact O-N 3.36Å; N230-S232 VanDerWaalsContact O-N 3.08Å; N230-S232 PolarHBondContact OD1-N 2.96Å; N230-S232 VanDerWaalsContact OD1-N 3.15Å; N230-S232 PolarHBondContact OD1-OG 3.48Å; N230-S233 WeakPolarHBondContact O-CB 3.29Å; N230-S233 PolarHBondContact O-N 2.99Å; N230-H234 PolarHBondContact O-CD2 3.25Å; N230-H234 PolarHBondContact O-N 3.02Å
231	P	71.8	Confident	76.4	Confident	46 Å²	46	64.7 Å²	64.7	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-50.2	-37.5	-179.3	-31.3	36.5	0	0	0	114.4	Y229 H234 I235 W314	Y229-P231 HydrophobicContact CD1-CG 4.33Å; Y229-P231 HydrophobicContact CE1-CG 3.74Å; P231-H234 PolarHBondContact O-N 3.45Å; P231-I235 VanDerWaalsContact O-CG1 3.31Å; P231-I235 WeakPolarHBondContact O-CG1 3.16Å; P231-I235 PolarHBondContact O-N 3.1Å; P231-W314 HydrophobicContact CB-CH2 3.5Å; P231-W314 VanDerWaalsContact CB-CH2 3.5Å; P231-W314 HydrophobicContact CB-CZ2 4.35Å; P231-W314 HydrophobicContact CB-CZ3 3.64Å; P231-W314 HydrophobicContact CG-CH2 3.8Å; P231-W314 HydrophobicContact CG-CZ3 4.16Å
232	S	75.6	Confident	76.4	Confident	70 Å²	70	59.1 Å²	59.1	49%	0.49	31%	0.306	S	S	.	.	H	α-helix	trans	-69.5	-36.3	-179.3	68.6	0	0	0	0	112.5	N230 I235 V236	N230-S232 PolarHBondContact O-N 3.36Å; N230-S232 VanDerWaalsContact O-N 3.08Å; N230-S232 PolarHBondContact OD1-N 2.96Å; N230-S232 VanDerWaalsContact OD1-N 3.15Å; N230-S232 PolarHBondContact OD1-OG 3.48Å; S232-I235 PolarHBondContact O-N 3.1Å; S232-V236 WeakPolarHBondContact O-CB 3.15Å; S232-V236 VanDerWaalsContact O-CG2 3.27Å; S232-V236 WeakPolarHBondContact O-CG2 3.39Å; S232-V236 PolarHBondContact O-N 3.46Å
233	S	75.9	Confident	76.4	Confident	5 Å²	5	53.6 Å²	53.6	4%	0.035	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-44.1	174.4	-173.1	0	0	0	0	110.9	Q220 L223 N224 N230 V236 S237	Q220-S233 PolarHBondContact OE1-OG 3.44Å; L223-S233 WeakPolarHBondContact CB-OG 3.35Å; N224-S233 WeakPolarHBondContact CB-OG 3.16Å; N230-S233 WeakPolarHBondContact O-CB 3.29Å; N230-S233 PolarHBondContact O-N 2.99Å; S233-V236 PolarHBondContact O-N 2.95Å; S233-S237 VanDerWaalsContact O-CB 3.26Å; S233-S237 WeakPolarHBondContact O-CB 3.33Å; S233-S237 PolarHBondContact O-N 3.41Å; S233-S237 PolarHBondContact O-OG 3.05Å
234	H	73.5	Confident	76.8	Confident	36 Å²	36	52.7 Å²	52.7	17%	0.167	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-41	177.6	-67.2	-75.5	0	0	0	112.7	Y216 Q220 N230 P231 S237 G238 W314	Y216-H234 AromaticContact CZ-ND1 3.95Å; Y216-H234 PolarHBondContact OH-CE1 3.06Å; Y216-H234 PolarHBondContact OH-ND1 3.45Å; Q220-H234 PolarHBondContact NE2-CE1 2.76Å; Q220-H234 PolarHBondContact NE2-ND1 3.37Å; N230-H234 PolarHBondContact O-CD2 3.25Å; N230-H234 PolarHBondContact O-N 3.02Å; P231-H234 PolarHBondContact O-N 3.45Å; H234-S237 WeakPolarHBondContact CA-OG 3.42Å; H234-S237 PolarHBondContact O-OG 3.24Å; H234-G238 WeakPolarHBondContact O-CA 3.2Å; H234-G238 PolarHBondContact O-N 3.21Å; H234-W314 HydrophobicContact CB-CZ2 4.11Å
235	I	75.1	Confident	76.7	Confident	61 Å²	61	52 Å²	52	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-44.8	177.4	-69.3	167.3	0	0	0	110.5	P231 S232 A239 W314	P231-I235 VanDerWaalsContact O-CG1 3.31Å; P231-I235 WeakPolarHBondContact O-CG1 3.16Å; P231-I235 PolarHBondContact O-N 3.1Å; S232-I235 PolarHBondContact O-N 3.1Å; I235-A239 WeakPolarHBondContact O-CB 3.29Å; I235-A239 PolarHBondContact O-N 3.38Å; I235-W314 HydrophobicContact CG1-CD2 4.38Å; I235-W314 HydrophobicContact CG1-CG 4.33Å
236	V	83	Confident	77	Confident	79 Å²	79	47.8 Å²	47.8	48%	0.479	25%	0.251	S	S	.	.	H	α-helix	trans	-70.3	-47	-178.2	174.1	0	0	0	0	111.5	L223 S232 S233 A239 A240	L223-V236 HydrophobicContact CD1-CB 4.21Å; L223-V236 HydrophobicContact CD1-CG1 3.7Å; S232-V236 WeakPolarHBondContact O-CB 3.15Å; S232-V236 VanDerWaalsContact O-CG2 3.27Å; S232-V236 WeakPolarHBondContact O-CG2 3.39Å; S232-V236 PolarHBondContact O-N 3.46Å; S233-V236 PolarHBondContact O-N 2.95Å; V236-A239 PolarHBondContact O-N 3.06Å; V236-A240 WeakPolarHBondContact O-CB 3.49Å; V236-A240 PolarHBondContact O-N 3.16Å
237	S	79.9	Confident	77.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-45.5	177	55.4	0	0	0	0	111.7	Y216 Q220 S233 H234 A239 A240 A241	Y216-S237 VanDerWaalsContact CE2-OG 3.26Å; Y216-S237 WeakPolarHBondContact CE2-OG 3.1Å; Q220-S237 PolarHBondContact NE2-OG 2.85Å; S233-S237 VanDerWaalsContact O-CB 3.26Å; S233-S237 WeakPolarHBondContact O-CB 3.33Å; S233-S237 PolarHBondContact O-N 3.41Å; S233-S237 PolarHBondContact O-OG 3.05Å; H234-S237 WeakPolarHBondContact CA-OG 3.42Å; H234-S237 PolarHBondContact O-OG 3.24Å; S237-A239 PolarHBondContact O-N 3.31Å; S237-A240 PolarHBondContact O-N 3.32Å; S237-A241 WeakPolarHBondContact O-CB 3.42Å; S237-A241 PolarHBondContact O-N 3.1Å
238	G	76.1	Confident	78.3	Confident	6 Å²	6	42 Å²	42	6%	0.062	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-38.1	176.5	0	0	0	0	0	113	H234 G242	H234-G238 WeakPolarHBondContact O-CA 3.2Å; H234-G238 PolarHBondContact O-N 3.21Å; G238-G242 PolarHBondContact O-N 3.05Å
239	A	79.5	Confident	78.8	Confident	10 Å²	10	35.9 Å²	35.9	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-48.3	173.7	0	0	0	0	0	112.2	I235 V236 S237 A243 M307	I235-A239 WeakPolarHBondContact O-CB 3.29Å; I235-A239 PolarHBondContact O-N 3.38Å; V236-A239 PolarHBondContact O-N 3.06Å; S237-A239 PolarHBondContact O-N 3.31Å; A239-A243 VanDerWaalsContact O-CB 3.22Å; A239-A243 WeakPolarHBondContact O-CB 3.36Å; A239-A243 PolarHBondContact O-N 3.06Å; A239-M307 HydrophobicContact CB-CG 3.57Å
240	A	83.7	Confident	79.7	Confident	32 Å²	32	29.6 Å²	29.6	26%	0.264	19%	0.188	S	C	.	.	H	α-helix	trans	-62.6	-45.6	177.9	0	0	0	0	0	111.1	M219 V236 S237 A243 V244	M219-A240 HydrophobicContact CG-CB 4.17Å; M219-A240 HydrophobicContact SD-CB 4.31Å; V236-A240 WeakPolarHBondContact O-CB 3.49Å; V236-A240 PolarHBondContact O-N 3.16Å; S237-A240 PolarHBondContact O-N 3.32Å; A240-A243 WeakPolarHBondContact O-CB 3.42Å; A240-A243 PolarHBondContact O-N 3.05Å; A240-V244 WeakPolarHBondContact O-CG2 3.21Å; A240-V244 PolarHBondContact O-N 3.07Å
241	A	76.3	Confident	80.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.4	-49.8	177.7	0	0	0	0	0	112.4	H212 T215 S237 A243 V244 S245	H212-A241 WeakPolarHBondContact O-CB 3.28Å; T215-A241 HydrophobicContact CG2-CB 4.23Å; S237-A241 WeakPolarHBondContact O-CB 3.42Å; S237-A241 PolarHBondContact O-N 3.1Å; A241-A243 VanDerWaalsContact C-N 3.34Å; A241-A243 PolarHBondContact O-N 3.09Å; A241-V244 PolarHBondContact O-N 3.27Å; A241-S245 VanDerWaalsContact O-CB 3.29Å; A241-S245 WeakPolarHBondContact O-CB 3.26Å; A241-S245 PolarHBondContact O-N 2.83Å; A241-S245 PolarHBondContact O-OG 3.28Å
242	G	78.5	Confident	81	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.8	-29.4	178.4	0	0	0	0	0	112.8	H212 G238 A246 Q306	H212-G242 WeakPolarHBondContact ND1-CA 3.47Å; H212-G242 PolarHBondContact ND1-N 3.17Å; G238-G242 PolarHBondContact O-N 3.05Å; G242-A246 WeakPolarHBondContact O-CB 3.4Å; G242-A246 PolarHBondContact O-N 3.2Å; G242-Q306 VanDerWaalsContact CA-CG 3.48Å
243	A	83.6	Confident	81.3	Confident	22 Å²	22	24 Å²	24	18%	0.182	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-48.9	172.4	0	0	0	0	0	111.9	A239 A240 A241 A246 A247 V303	A239-A243 VanDerWaalsContact O-CB 3.22Å; A239-A243 WeakPolarHBondContact O-CB 3.36Å; A239-A243 PolarHBondContact O-N 3.06Å; A240-A243 WeakPolarHBondContact O-CB 3.42Å; A240-A243 PolarHBondContact O-N 3.05Å; A241-A243 VanDerWaalsContact C-N 3.34Å; A241-A243 PolarHBondContact O-N 3.09Å; A243-A246 PolarHBondContact O-N 3.04Å; A243-A247 WeakPolarHBondContact O-CB 3.06Å; A243-A247 PolarHBondContact O-N 2.85Å; A243-V303 HydrophobicContact CB-CG1 3.83Å
244	V	85.3	Confident	81.6	Confident	65 Å²	65	23.9 Å²	23.9	39%	0.394	15%	0.15	S	C	.	.	H	α-helix	trans	-62.6	-45.8	176.7	173.6	0	0	0	0	110.4	V211 T215 A240 A241 A246 A247 V248	V211-V244 HydrophobicContact CG1-CG1 3.96Å; T215-V244 HydrophobicContact CG2-CB 4.08Å; T215-V244 HydrophobicContact CG2-CG1 4.41Å; T215-V244 HydrophobicContact CG2-CG2 4.03Å; A240-V244 WeakPolarHBondContact O-CG2 3.21Å; A240-V244 PolarHBondContact O-N 3.07Å; A241-V244 PolarHBondContact O-N 3.27Å; V244-A246 PolarHBondContact O-N 3.49Å; V244-A247 PolarHBondContact O-N 3.01Å; V244-V248 HydrophobicContact CG1-CG2 4.44Å; V244-V248 WeakPolarHBondContact O-CG2 3.4Å; V244-V248 PolarHBondContact O-N 3.12Å
245	S	78.5	Confident	82.1	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-42.5	178.6	-54.3	0	0	0	0	112.2	H212 A241 V248 T249	H212-S245 WeakPolarHBondContact CA-OG 3.49Å; H212-S245 WeakPolarHBondContact CB-OG 3.27Å; H212-S245 PolarHBondContact N-OG 3.48Å; A241-S245 VanDerWaalsContact O-CB 3.29Å; A241-S245 WeakPolarHBondContact O-CB 3.26Å; A241-S245 PolarHBondContact O-N 2.83Å; A241-S245 PolarHBondContact O-OG 3.28Å; S245-V248 PolarHBondContact O-N 3.26Å; S245-T249 WeakPolarHBondContact O-CB 3.46Å; S245-T249 WeakPolarHBondContact O-CG2 3.26Å; S245-T249 PolarHBondContact O-N 2.86Å; S245-T249 PolarHBondContact O-OG1 2.9Å
246	A	81.2	Confident	82.4	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-47.1	174.6	0	0	0	0	0	111.1	G242 A243 V244 T249 T250 R302	G242-A246 WeakPolarHBondContact O-CB 3.4Å; G242-A246 PolarHBondContact O-N 3.2Å; A243-A246 PolarHBondContact O-N 3.04Å; V244-A246 PolarHBondContact O-N 3.49Å; A246-T249 PolarHBondContact O-N 3.13Å; A246-T250 PolarHBondContact O-N 2.92Å; A246-T250 PolarHBondContact O-OG1 2.87Å; A246-R302 HydrophobicContact CB-CB 4.28Å; A246-R302 HydrophobicContact CB-CG 3.71Å
247	A	87	Confident	82.1	Confident	34 Å²	34	16.2 Å²	16.2	28%	0.281	11%	0.108	S	C	.	.	H	α-helix	trans	-60.8	-50.1	178.7	0	0	0	0	0	111.9	A243 V244 T249 T250 V299 V303	A243-A247 WeakPolarHBondContact O-CB 3.06Å; A243-A247 PolarHBondContact O-N 2.85Å; V244-A247 PolarHBondContact O-N 3.01Å; A247-T249 VanDerWaalsContact C-N 3.31Å; A247-T249 PolarHBondContact O-N 3.36Å; A247-T250 PolarHBondContact O-N 3.32Å; A247-T250 PolarHBondContact O-OG1 2.89Å; A247-V299 HydrophobicContact CB-CG2 4.17Å; A247-V303 HydrophobicContact CB-CG2 4.19Å
248	V	86.9	Confident	82.1	Confident	88 Å²	88	16.3 Å²	16.3	53%	0.533	11%	0.108	S	C	.	.	H	α-helix	trans	-61.2	-39.2	-179.6	171.9	0	0	0	0	111.8	V211 V244 S245 P251	V211-V248 HydrophobicContact CG1-CG2 4.42Å; V211-V248 HydrophobicContact CG2-CG1 4.24Å; V244-V248 HydrophobicContact CG1-CG2 4.44Å; V244-V248 WeakPolarHBondContact O-CG2 3.4Å; V244-V248 PolarHBondContact O-N 3.12Å; S245-V248 PolarHBondContact O-N 3.26Å; V248-P251 WeakPolarHBondContact O-CD 3.18Å
249	T	83.6	Confident	82.2	Confident	2 Å²	2	16 Å²	16	1%	0.012	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5.2	-176.8	61.8	0	0	0	0	114.1	P207 F208 S245 A246 A247 L252 D253 R302	P207-T249 HydrophobicContact CB-CG2 4.17Å; F208-T249 HydrophobicContact CB-CG2 3.95Å; F208-T249 HydrophobicContact CD2-CG2 4.36Å; S245-T249 WeakPolarHBondContact O-CB 3.46Å; S245-T249 WeakPolarHBondContact O-CG2 3.26Å; S245-T249 PolarHBondContact O-N 2.86Å; S245-T249 PolarHBondContact O-OG1 2.9Å; A246-T249 PolarHBondContact O-N 3.13Å; A247-T249 VanDerWaalsContact C-N 3.31Å; A247-T249 PolarHBondContact O-N 3.36Å; T249-L252 PolarHBondContact O-N 3.07Å; T249-D253 PolarHBondContact O-N 3.47Å; T249-R302 PolarHBondContact O-NH1 2.84Å; T249-R302 PolarHBondContact OG1-NH1 3.4Å; T249-R302 PolarHBondContact OG1-NH2 2.66Å
250	T	85.9	Confident	81.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.7	-42.2	178.5	-63.7	0	0	0	0	113.1	A246 A247 L252 D253 V254 F295 V299	A246-T250 PolarHBondContact O-N 2.92Å; A246-T250 PolarHBondContact O-OG1 2.87Å; A247-T250 PolarHBondContact O-N 3.32Å; A247-T250 PolarHBondContact O-OG1 2.89Å; T250-L252 VanDerWaalsContact C-N 3.29Å; T250-L252 PolarHBondContact O-N 3.42Å; T250-D253 PolarHBondContact O-N 3.45Å; T250-D253 VanDerWaalsContact O-N 3.14Å; T250-V254 HydrophobicContact CG2-CG2 4.17Å; T250-V254 WeakPolarHBondContact O-CG2 3.36Å; T250-V254 PolarHBondContact O-N 3.49Å; T250-F295 CarbonylContact C-O 3.55Å; T250-F295 WeakPolarHBondContact CG2-O 3.27Å; T250-V299 HydrophobicContact CG2-CB 3.95Å; T250-V299 HydrophobicContact CG2-CG2 4.37Å
251	P	87.6	Confident	81	Confident	25 Å²	25	14.9 Å²	14.9	16%	0.162	9%	0.094	C	C	.	.	H	α-helix	trans	-57	-39.1	177.4	-28.2	37	0	0	0	114.1	V248 C255 F295 F296	V248-P251 WeakPolarHBondContact O-CD 3.18Å; P251-C255 PolarHBondContact O-N 3.45Å; P251-C255 PolarHBondContact O-SG 2.96Å; P251-F295 WeakPolarHBondContact CA-O 3.09Å; P251-F295 HydrophobicContact CB-CB 3.99Å; P251-F295 HydrophobicContact CB-CD1 3.96Å; P251-F295 HydrophobicContact CB-CG 4.32Å; P251-F295 HydrophobicContact CG-CB 4.18Å; P251-F296 HydrophobicContact CG-CE1 4.12Å; P251-F296 HydrophobicContact CG-CE2 4.5Å; P251-F296 HydrophobicContact CG-CZ 4.02Å
252	L	84.9	Confident	80.6	Confident	32 Å²	32	15 Å²	15	17%	0.168	10%	0.095	C	C	.	.	H	α-helix	trans	-70.5	-38.5	178.9	-68.7	169.7	0	0	0	111.7	M204 P207 T249 T250 C255 K256 M279 F283	M204-L252 HydrophobicContact CB-CB 4.17Å; M204-L252 HydrophobicContact CG-CB 3.96Å; P207-L252 HydrophobicContact CG-CD1 4.39Å; T249-L252 PolarHBondContact O-N 3.07Å; T250-L252 VanDerWaalsContact C-N 3.29Å; T250-L252 PolarHBondContact O-N 3.42Å; L252-C255 PolarHBondContact O-N 3.04Å; L252-K256 PolarHBondContact O-N 3.42Å; L252-M279 HydrophobicContact CD2-SD 4.25Å; L252-F283 HydrophobicContact CD2-CE2 3.98Å; L252-F283 HydrophobicContact CD2-CZ 3.7Å
253	D	81.4	Confident	80	Confident	6 Å²	6	15.3 Å²	15.3	3%	0.032	10%	0.096	C	C	.	.	H	α-helix	trans	-72.1	-36.9	-178.4	-167.1	47.5	0	0	0	112.5	K67 Q71 M204 T249 T250 C255 K256 T257 R302	K67-D253 IonicContact NZ-OD2 3.89Å; Q71-D253 PolarHBondContact NE2-OD2 3.04Å; M204-D253 HydrophobicContact SD-CB 3.67Å; T249-D253 PolarHBondContact O-N 3.47Å; T250-D253 PolarHBondContact O-N 3.45Å; T250-D253 VanDerWaalsContact O-N 3.14Å; D253-C255 VanDerWaalsContact C-N 3.27Å; D253-C255 PolarHBondContact O-N 3.01Å; D253-K256 PolarHBondContact O-N 3.34Å; D253-T257 WeakPolarHBondContact O-CB 3.38Å; D253-T257 PolarHBondContact O-N 3.36Å; D253-T257 PolarHBondContact O-OG1 2.97Å; D253-R302 IonicContact OD2-CZ 2.65Å; D253-R302 IonicContact OD2-NE 3.53Å; D253-R302 IonicContact OD2-NH1 3.07Å; D253-R302 PolarHBondContact OD2-NH1 3.08Å
254	V	82.9	Confident	78.9	Confident	3 Å²	3	19.5 Å²	19.5	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-58.7	-43.3	170.7	172.1	0	0	0	0	110.3	L73 T250 T257 L258 V286 F295	L73-V254 HydrophobicContact CD2-CG1 4.49Å; T250-V254 HydrophobicContact CG2-CG2 4.17Å; T250-V254 WeakPolarHBondContact O-CG2 3.36Å; T250-V254 PolarHBondContact O-N 3.49Å; V254-T257 PolarHBondContact O-N 3.42Å; V254-L258 PolarHBondContact O-N 3.47Å; V254-V286 HydrophobicContact CG1-CG1 4.09Å; V254-V286 HydrophobicContact CG1-CG2 4.09Å; V254-F295 WeakPolarHBondContact CG2-O 3.28Å
255	C	83.5	Confident	77.4	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-72.1	-37.1	178.6	-61.6	0	0	0	0	113.3	P251 L252 D253 T257 L258 L259 M279 A282	P251-C255 PolarHBondContact O-N 3.45Å; P251-C255 PolarHBondContact O-SG 2.96Å; L252-C255 PolarHBondContact O-N 3.04Å; D253-C255 VanDerWaalsContact C-N 3.27Å; D253-C255 PolarHBondContact O-N 3.01Å; C255-T257 VanDerWaalsContact C-N 3.31Å; C255-L258 PolarHBondContact O-N 2.92Å; C255-L259 WeakPolarHBondContact O-CG 3.22Å; C255-L259 PolarHBondContact O-N 3.24Å; C255-M279 HydrophobicContact CB-CE 3.09Å; C255-A282 HydrophobicContact CB-CB 3.91Å
256	K	80.4	Confident	76.4	Confident	12 Å²	12	21 Å²	21	5%	0.052	13%	0.125	C	C	.	.	H	α-helix	trans	-57.1	-47.8	170.8	-178	-170.8	174.2	-174.7	0	110	E162 T200 Q201 M204 L252 D253 L259 N260	E162-K256 IonicContact OE2-NZ 2.96Å; E162-K256 PolarHBondContact OE2-NZ 3.07Å; E162-K256 VanDerWaalsContact OE2-NZ 3.07Å; T200-K256 HydrophobicContact CG2-CB 4.15Å; Q201-K256 HydrophobicContact CB-CD 4.36Å; M204-K256 HydrophobicContact CE-CD 4.34Å; M204-K256 HydrophobicContact SD-CD 4.43Å; L252-K256 PolarHBondContact O-N 3.42Å; D253-K256 PolarHBondContact O-N 3.34Å; K256-L259 PolarHBondContact O-N 2.76Å; K256-N260 PolarHBondContact O-N 3.02Å
257	T	77	Confident	75.5	Confident	3 Å²	3	21 Å²	21	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-60.1	-49.9	-179.9	-57.5	0	0	0	0	110.5	Q71 D253 V254 C255 L259 N260 T261	Q71-T257 HydrophobicContact CB-CG2 4.23Å; D253-T257 WeakPolarHBondContact O-CB 3.38Å; D253-T257 PolarHBondContact O-N 3.36Å; D253-T257 PolarHBondContact O-OG1 2.97Å; V254-T257 PolarHBondContact O-N 3.42Å; C255-T257 VanDerWaalsContact C-N 3.31Å; T257-L259 VanDerWaalsContact C-N 3.34Å; T257-L259 PolarHBondContact O-N 3.1Å; T257-N260 PolarHBondContact O-N 3.33Å; T257-T261 HydrophobicContact CG2-CG2 4.12Å; T257-T261 PolarHBondContact O-N 3.23Å; T257-T261 PolarHBondContact O-OG1 2.94Å
258	L	79.9	Confident	74.1	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-56	-44.4	176.6	176.6	57.1	0	0	0	113.1	L73 V254 C255 N260 Q262 E263 L276 T285 V286	L73-L258 HydrophobicContact CD1-CB 4.39Å; L73-L258 HydrophobicContact CD1-CD1 3.68Å; L73-L258 HydrophobicContact CD1-CD2 4.26Å; L73-L258 HydrophobicContact CD1-CG 4.32Å; V254-L258 PolarHBondContact O-N 3.47Å; C255-L258 PolarHBondContact O-N 2.92Å; L258-N260 VanDerWaalsContact C-N 3.3Å; L258-N260 PolarHBondContact O-N 3.48Å; L258-Q262 PolarHBondContact O-N 2.9Å; L258-Q262 VanDerWaalsContact O-N 3.08Å; L258-E263 HydrophobicContact CD1-CB 4.49Å; L258-L276 HydrophobicContact CD2-CD2 3.78Å; L258-L276 HydrophobicContact CG-CD2 3.8Å; L258-T285 HydrophobicContact CD2-CG2 3.93Å; L258-V286 HydrophobicContact CD2-CG2 3.69Å
259	L	77.8	Confident	72.8	Confident	1 Å²	1	23 Å²	23	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-32.1	178	-73.7	170.6	0	0	0	112.4	T200 C255 K256 T257 Q262 L276 A282	T200-L259 HydrophobicContact CG2-CD1 4.02Å; T200-L259 WeakPolarHBondContact OG1-CD1 3.39Å; C255-L259 WeakPolarHBondContact O-CG 3.22Å; C255-L259 PolarHBondContact O-N 3.24Å; K256-L259 PolarHBondContact O-N 2.76Å; T257-L259 VanDerWaalsContact C-N 3.34Å; T257-L259 PolarHBondContact O-N 3.1Å; L259-Q262 PolarHBondContact O-NE2 3.19Å; L259-L276 HydrophobicContact CD2-CD2 3.99Å; L259-L276 HydrophobicContact CD2-CG 3.96Å; L259-L276 WeakPolarHBondContact CD2-O 3.43Å; L259-A282 HydrophobicContact CD1-CB 3.95Å; L259-A282 HydrophobicContact CD2-CB 4.12Å; L259-A282 HydrophobicContact CG-CB 3.83Å
260	N	70.2	Confident	71.7	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-80.2	-42.2	179.6	-86.6	-19	0	0	0	114.1	V163 Q166 R167 S197 K256 T257 L258	V163-N260 WeakPolarHBondContact CG2-OD1 3.36Å; Q166-N260 PolarHBondContact OE1-ND2 2.92Å; R167-N260 PolarHBondContact NE-O 2.82Å; R167-N260 PolarHBondContact NH2-O 2.9Å; S197-N260 VanDerWaalsContact CB-CG 3.47Å; S197-N260 WeakPolarHBondContact CB-OD1 3.4Å; S197-N260 PolarHBondContact OG-ND2 3.27Å; S197-N260 PolarHBondContact OG-OD1 2.97Å; K256-N260 PolarHBondContact O-N 3.02Å; T257-N260 PolarHBondContact O-N 3.33Å; L258-N260 VanDerWaalsContact C-N 3.3Å; L258-N260 PolarHBondContact O-N 3.48Å
261	T	68.6	Low	70.5	Confident	16 Å²	16	31.6 Å²	31.6	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-84.3	-18.5	-174.8	56.9	0	0	0	0	112.6	M170 T257 E263	M170-T261 HydrophobicContact CE-CG2 4.08Å; M170-T261 HydrophobicContact CG-CG2 4.32Å; M170-T261 HydrophobicContact SD-CG2 3.81Å; T257-T261 HydrophobicContact CG2-CG2 4.12Å; T257-T261 PolarHBondContact O-N 3.23Å; T257-T261 PolarHBondContact O-OG1 2.94Å; T261-E263 VanDerWaalsContact C-N 3.31Å; T261-E263 PolarHBondContact O-N 3.13Å; T261-E263 WeakPolarHBondContact OG1-CG 3.32Å; T261-E263 PolarHBondContact OG1-OE1 2.9Å
262	Q	67.7	Low	69.2	Low	4 Å²	4	33 Å²	33	2%	0.019	19%	0.193	C	C	.	.			trans	45.5	55.7	178.7	-66.8	-70	-45.9	0	0	111.4	L258 L259 N264 L276	L258-Q262 PolarHBondContact O-N 2.9Å; L258-Q262 VanDerWaalsContact O-N 3.08Å; L259-Q262 PolarHBondContact O-NE2 3.19Å; Q262-N264 PolarHBondContact O-N 3.48Å; Q262-L276 PolarHBondContact NE2-O 3.45Å
263	E	66.9	Low	67.6	Low	5 Å²	5	37.3 Å²	37.3	2%	0.023	23%	0.226	C	C	.	.			trans	-64.8	94.4	-172.9	-69.5	-174.1	-148.2	0	0	111.8	L73 Q74 M170 L258 T261 V265 A266 L267	L73-E263 WeakPolarHBondContact CA-OE2 3.44Å; L73-E263 WeakPolarHBondContact CB-OE2 3.47Å; L73-E263 VanDerWaalsContact N-CD 3.34Å; L73-E263 PolarHBondContact N-OE1 3.35Å; L73-E263 PolarHBondContact N-OE2 3.41Å; L73-E263 VanDerWaalsContact N-OE2 3.11Å; Q74-E263 PolarHBondContact N-OE2 3.37Å; M170-E263 HydrophobicContact CE-CG 4.5Å; L258-E263 HydrophobicContact CD1-CB 4.49Å; T261-E263 VanDerWaalsContact C-N 3.31Å; T261-E263 PolarHBondContact O-N 3.13Å; T261-E263 WeakPolarHBondContact OG1-CG 3.32Å; T261-E263 PolarHBondContact OG1-OE1 2.9Å; E263-V265 PolarHBondContact O-N 2.81Å; E263-V265 VanDerWaalsContact O-N 3.08Å; E263-A266 HydrophobicContact CB-CB 3.99Å; E263-A266 WeakPolarHBondContact O-CA 3.34Å; E263-A266 WeakPolarHBondContact O-CB 3.28Å; E263-A266 PolarHBondContact O-N 2.91Å; E263-L267 PolarHBondContact O-N 2.81Å
264	N	60	Low	66.7	Low	110 Å²	110	39.3 Å²	39.3	59%	0.588	25%	0.248	S	C	*	.	H	α-helix	trans	-54.1	-31.4	-174.7	-75	-45.3	0	0	0	114	Q262 S268	Q262-N264 PolarHBondContact O-N 3.48Å; N264-S268 VanDerWaalsContact O-CB 3.22Å; N264-S268 WeakPolarHBondContact O-CB 3.47Å; N264-S268 PolarHBondContact O-N 2.99Å; N264-S268 PolarHBondContact O-OG 3.17Å
265	V	53.5	Low	65.8	Low	89 Å²	89	43.5 Å²	43.5	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-71.6	-38.9	176.6	-178.7	0	0	0	0	111.3	Q74 E263 L267 S268 S269	Q74-V265 HydrophobicContact CG-CB 4.27Å; E263-V265 PolarHBondContact O-N 2.81Å; E263-V265 VanDerWaalsContact O-N 3.08Å; V265-L267 VanDerWaalsContact C-N 3.33Å; V265-S268 PolarHBondContact O-N 3.24Å; V265-S269 WeakPolarHBondContact O-CB 3.1Å; V265-S269 PolarHBondContact O-N 3.19Å; V265-S269 PolarHBondContact O-OG 3.39Å
266	A	57.9	Low	65.1	Low	7 Å²	7	43.8 Å²	43.8	6%	0.058	27%	0.269	C	S	.	.	H	α-helix	trans	-71.6	-28.7	176.5	0	0	0	0	0	112.1	L73 E263 S269 V270 L289	L73-A266 HydrophobicContact CD1-CB 4.38Å; E263-A266 HydrophobicContact CB-CB 3.99Å; E263-A266 WeakPolarHBondContact O-CA 3.34Å; E263-A266 WeakPolarHBondContact O-CB 3.28Å; E263-A266 PolarHBondContact O-N 2.91Å; A266-S269 PolarHBondContact O-OG 3.42Å; A266-V270 WeakPolarHBondContact O-CG2 3.47Å; A266-L289 HydrophobicContact CB-CD1 3.83Å; A266-L289 HydrophobicContact CB-CD2 4.37Å
267	L	61.9	Low	64.6	Low	3 Å²	3	46.6 Å²	46.6	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-76.8	-40.8	173.1	-62.9	171.6	0	0	0	111.5	E263 V265 V270 N271 I272 L276	E263-L267 PolarHBondContact O-N 2.81Å; V265-L267 VanDerWaalsContact C-N 3.33Å; L267-V270 PolarHBondContact O-N 2.88Å; L267-N271 PolarHBondContact O-N 2.87Å; L267-I272 PolarHBondContact O-N 3.09Å; L267-L276 HydrophobicContact CD1-CB 4.47Å; L267-L276 HydrophobicContact CD2-CB 3.73Å; L267-L276 HydrophobicContact CD2-CD1 4.37Å; L267-L276 HydrophobicContact CD2-CD2 4.19Å; L267-L276 HydrophobicContact CD2-CG 4.33Å
268	S	57.7	Low	64.5	Low	83 Å²	83	47.8 Å²	47.8	58%	0.58	30%	0.303	S	S	*	.	H	α-helix	trans	-62.8	-40.2	175.1	-60.8	0	0	0	0	112.5	N264 V265 V270 N271	N264-S268 VanDerWaalsContact O-CB 3.22Å; N264-S268 WeakPolarHBondContact O-CB 3.47Å; N264-S268 PolarHBondContact O-N 2.99Å; N264-S268 PolarHBondContact O-OG 3.17Å; V265-S268 PolarHBondContact O-N 3.24Å; S268-V270 PolarHBondContact O-N 3.45Å; S268-N271 PolarHBondContact O-N 3.37Å; S268-N271 VanDerWaalsContact O-N 3.16Å
269	S	58.8	Low	64.5	Low	81 Å²	81	49.5 Å²	49.5	57%	0.566	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-20	179	63.4	0	0	0	0	113.6	V265 A266 L289	V265-S269 WeakPolarHBondContact O-CB 3.1Å; V265-S269 PolarHBondContact O-N 3.19Å; V265-S269 PolarHBondContact O-OG 3.39Å; A266-S269 PolarHBondContact O-OG 3.42Å; S269-L289 VanDerWaalsContact OG-CD2 3.23Å; S269-L289 WeakPolarHBondContact OG-CD2 3.46Å
270	V	60.3	Low	64.6	Low	24 Å²	24	53.1 Å²	53.1	15%	0.145	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.7	178	-166.2	0	0	0	0	111.6	A266 L267 S268 I272 T285 R288 L289	A266-V270 WeakPolarHBondContact O-CG2 3.47Å; L267-V270 PolarHBondContact O-N 2.88Å; S268-V270 PolarHBondContact O-N 3.45Å; V270-I272 HydrophobicContact CB-CD1 4.49Å; V270-I272 HydrophobicContact CB-CG1 4.33Å; V270-I272 HydrophobicContact CG1-CD1 4.29Å; V270-I272 HydrophobicContact CG1-CG1 4.32Å; V270-I272 PolarHBondContact O-N 3.23Å; V270-T285 HydrophobicContact CG2-CG2 4.48Å; V270-R288 HydrophobicContact CG1-CB 4.14Å; V270-L289 HydrophobicContact CG2-CD2 3.55Å; V270-L289 HydrophobicContact CG2-CG 3.87Å
271	N	61.3	Low	65.1	Low	158 Å²	158	57 Å²	57	85%	0.845	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	29.9	-179.3	-113.6	4.3	0	0	0	113.5	L267 S268 S273	L267-N271 PolarHBondContact O-N 2.87Å; S268-N271 PolarHBondContact O-N 3.37Å; S268-N271 VanDerWaalsContact O-N 3.16Å; N271-S273 PolarHBondContact O-N 3.03Å
272	I	61.3	Low	65.8	Low	53 Å²	53	56.3 Å²	56.3	27%	0.272	36%	0.358	S	S	.	.			trans	-89.4	105.5	174.4	-61.2	-176.8	0	0	0	107.6	L267 V270 L276	L267-I272 PolarHBondContact O-N 3.09Å; V270-I272 HydrophobicContact CB-CD1 4.49Å; V270-I272 HydrophobicContact CB-CG1 4.33Å; V270-I272 HydrophobicContact CG1-CD1 4.29Å; V270-I272 HydrophobicContact CG1-CG1 4.32Å; V270-I272 PolarHBondContact O-N 3.23Å; I272-L276 HydrophobicContact CD1-CD1 4.4Å
273	S	51	Low	66.7	Low	124 Å²	124	59.4 Å²	59.4	87%	0.867	37%	0.371	S	S	*	.			trans	-80.3	114.3	169.2	48.8	0	0	0	0	109.8	N271	N271-S273 PolarHBondContact O-N 3.03Å
274	G	61.8	Low	67.6	Low	47 Å²	47	66.1 Å²	66.1	49%	0.485	40%	0.396	S	S	.	.	S	Bend	trans	116	-171.2	173.9	0	0	0	0	0	114.9
275	H	63.8	Low	68.6	Low	91 Å²	91	61 Å²	61	42%	0.421	37%	0.37	S	S	.	.			trans	-83	126.7	-175.9	-61.2	97.9	0	0	0	111.2	E189 S277	E189-H275 WeakPolarHBondContact CG-NE2 3.39Å; E189-H275 IonicContact OE2-CD2 3.69Å; H275-S277 PolarHBondContact O-N 2.79Å
276	L	69.9	Low	70.1	Confident	7 Å²	7	56.8 Å²	56.8	4%	0.037	34%	0.344	C	S	.	.			trans	-74	118.7	178.2	-176.5	76	0	0	0	109.7	R196 L258 L259 Q262 L267 I272 N281 A282	R196-L276 WeakPolarHBondContact CD-O 3.14Å; L258-L276 HydrophobicContact CD2-CD2 3.78Å; L258-L276 HydrophobicContact CG-CD2 3.8Å; L259-L276 HydrophobicContact CD2-CD2 3.99Å; L259-L276 HydrophobicContact CD2-CG 3.96Å; L259-L276 WeakPolarHBondContact CD2-O 3.43Å; Q262-L276 PolarHBondContact NE2-O 3.45Å; L267-L276 HydrophobicContact CD1-CB 4.47Å; L267-L276 HydrophobicContact CD2-CB 3.73Å; L267-L276 HydrophobicContact CD2-CD1 4.37Å; L267-L276 HydrophobicContact CD2-CD2 4.19Å; L267-L276 HydrophobicContact CD2-CG 4.33Å; I272-L276 HydrophobicContact CD1-CD1 4.4Å; L276-N281 HydrophobicContact CD1-CB 3.75Å; L276-A282 HydrophobicContact CD2-CB 4.33Å
277	S	69.3	Low	71.5	Confident	70 Å²	70	63 Å²	63	49%	0.49	37%	0.367	S	S	.	.			trans	-123.8	141.8	175.1	-173.8	0	0	0	0	111.2	H275 N281	H275-S277 PolarHBondContact O-N 2.79Å; S277-N281 PolarHBondContact O-ND2 3.28Å
278	G	75.1	Confident	72.4	Confident	29 Å²	29	69.5 Å²	69.5	30%	0.299	39%	0.391	S	S	.	.	S	Bend	trans	92.8	143.4	173.6	0	0	0	0	0	114.9	N281 A282	G278-N281 PolarHBondContact O-N 2.96Å; G278-A282 PolarHBondContact O-N 3.02Å; G278-A282 VanDerWaalsContact O-N 3.08Å
279	M	79.9	Confident	73.4	Confident	37 Å²	37	68.4 Å²	68.4	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-47.8	-177.5	-176.4	72.6	-78.5	0	0	112.2	T200 L252 C255 N281 A282 F283	T200-M279 HydrophobicContact CG2-CE 3.79Å; T200-M279 HydrophobicContact CG2-SD 3.26Å; T200-M279 WeakPolarHBondContact CG2-SD 3.34Å; L252-M279 HydrophobicContact CD2-SD 4.25Å; C255-M279 HydrophobicContact CB-CE 3.09Å; M279-N281 VanDerWaalsContact C-N 3.27Å; M279-N281 PolarHBondContact O-N 3.03Å; M279-A282 HydrophobicContact CE-CB 3.84Å; M279-A282 WeakPolarHBondContact O-CB 3.35Å; M279-A282 PolarHBondContact O-N 2.65Å; M279-F283 HydrophobicContact CE-CD2 3.38Å; M279-F283 HydrophobicContact CE-CE2 3.36Å; M279-F283 HydrophobicContact CE-CG 4.41Å; M279-F283 HydrophobicContact CE-CZ 4.37Å; M279-F283 HydrophobicContact CG-CD2 3.84Å; M279-F283 HydrophobicContact CG-CE2 3.71Å; M279-F283 WeakPolarHBondContact O-CD2 3.23Å; M279-F283 PolarHBondContact O-N 3.4Å; M279-F283 HydrophobicContact SD-CD2 4.03Å; M279-F283 HydrophobicContact SD-CE2 3.56Å; M279-F283 VanDerWaalsContact SD-CE2 3.56Å
280	A	80.4	Confident	74.3	Confident	77 Å²	77	66.5 Å²	66.5	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-59.2	-38.5	-179.6	0	0	0	0	0	112.8	R284	A280-R284 WeakPolarHBondContact O-CB 3.33Å; A280-R284 PolarHBondContact O-N 3.48Å
281	N	80.8	Confident	75.5	Confident	83 Å²	83	66.5 Å²	66.5	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-38.8	176	-70.6	-26.6	0	0	0	111.5	L276 S277 G278 M279 R284 T285	L276-N281 HydrophobicContact CD1-CB 3.75Å; S277-N281 PolarHBondContact O-ND2 3.28Å; G278-N281 PolarHBondContact O-N 2.96Å; M279-N281 VanDerWaalsContact C-N 3.27Å; M279-N281 PolarHBondContact O-N 3.03Å; N281-R284 PolarHBondContact O-N 3.1Å; N281-T285 WeakPolarHBondContact O-CB 3.33Å; N281-T285 PolarHBondContact O-N 2.93Å; N281-T285 PolarHBondContact O-OG1 3.39Å
282	A	81.9	Confident	76.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-47.1	173.7	0	0	0	0	0	112.3	C255 L259 L276 G278 M279 R284 T285 V286	C255-A282 HydrophobicContact CB-CB 3.91Å; L259-A282 HydrophobicContact CD1-CB 3.95Å; L259-A282 HydrophobicContact CD2-CB 4.12Å; L259-A282 HydrophobicContact CG-CB 3.83Å; L276-A282 HydrophobicContact CD2-CB 4.33Å; G278-A282 PolarHBondContact O-N 3.02Å; G278-A282 VanDerWaalsContact O-N 3.08Å; M279-A282 HydrophobicContact CE-CB 3.84Å; M279-A282 WeakPolarHBondContact O-CB 3.35Å; M279-A282 PolarHBondContact O-N 2.65Å; A282-R284 VanDerWaalsContact C-N 3.34Å; A282-R284 PolarHBondContact O-N 3.02Å; A282-T285 PolarHBondContact O-N 2.9Å; A282-V286 WeakPolarHBondContact O-CG2 3.43Å; A282-V286 PolarHBondContact O-N 3.38Å
283	F	86.8	Confident	77.8	Confident	70 Å²	70	66.2 Å²	66.2	31%	0.307	39%	0.386	S	S	.	.	H	α-helix	trans	-56.8	-47.4	174.1	-88.9	-79.7	0	0	0	111.8	L252 M279 T285 V286 Y287 F295	L252-F283 HydrophobicContact CD2-CE2 3.98Å; L252-F283 HydrophobicContact CD2-CZ 3.7Å; M279-F283 HydrophobicContact CE-CD2 3.38Å; M279-F283 HydrophobicContact CE-CE2 3.36Å; M279-F283 HydrophobicContact CE-CG 4.41Å; M279-F283 HydrophobicContact CE-CZ 4.37Å; M279-F283 HydrophobicContact CG-CD2 3.84Å; M279-F283 HydrophobicContact CG-CE2 3.71Å; M279-F283 WeakPolarHBondContact O-CD2 3.23Å; M279-F283 PolarHBondContact O-N 3.4Å; M279-F283 HydrophobicContact SD-CD2 4.03Å; M279-F283 HydrophobicContact SD-CE2 3.56Å; M279-F283 VanDerWaalsContact SD-CE2 3.56Å; F283-T285 VanDerWaalsContact C-N 3.33Å; F283-T285 PolarHBondContact O-N 3.21Å; F283-V286 PolarHBondContact O-N 2.99Å; F283-Y287 WeakPolarHBondContact O-CB 3.38Å; F283-Y287 PolarHBondContact O-N 2.95Å; F283-F295 HydrophobicContact CD1-CD1 4.21Å; F283-F295 AromaticContact CD1-CE1 3.26Å; F283-F295 HydrophobicContact CD1-CE1 3.26Å; F283-F295 AromaticContact CD1-CZ 3.67Å; F283-F295 HydrophobicContact CD1-CZ 3.67Å; F283-F295 HydrophobicContact CE1-CD1 4.2Å; F283-F295 AromaticContact CE1-CE1 3.68Å; F283-F295 HydrophobicContact CE1-CE1 3.68Å; F283-F295 HydrophobicContact CE1-CZ 4.4Å; F283-F295 HydrophobicContact CG-CE1 4.19Å; F283-F295 WeakPolarHBondContact O-CZ 3.31Å
284	R	85.5	Confident	79.3	Confident	145 Å²	145	61 Å²	61	55%	0.547	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-41.7	178.9	-171.8	178.5	-175.1	171.5	3.3	112.2	A280 N281 A282 R288	A280-R284 WeakPolarHBondContact O-CB 3.33Å; A280-R284 PolarHBondContact O-N 3.48Å; N281-R284 PolarHBondContact O-N 3.1Å; A282-R284 VanDerWaalsContact C-N 3.34Å; A282-R284 PolarHBondContact O-N 3.02Å; R284-R288 WeakPolarHBondContact O-CB 3.31Å; R284-R288 WeakPolarHBondContact O-CG 3.48Å; R284-R288 PolarHBondContact O-N 3.1Å
285	T	81.9	Confident	80.4	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.025	33%	0.33	C	S	.	.	H	α-helix	trans	-68.3	-46	179.8	-61.7	0	0	0	0	111.4	L258 V270 N281 A282 F283 Y287 R288 L289	L258-T285 HydrophobicContact CD2-CG2 3.93Å; V270-T285 HydrophobicContact CG2-CG2 4.48Å; N281-T285 WeakPolarHBondContact O-CB 3.33Å; N281-T285 PolarHBondContact O-N 2.93Å; N281-T285 PolarHBondContact O-OG1 3.39Å; A282-T285 PolarHBondContact O-N 2.9Å; F283-T285 VanDerWaalsContact C-N 3.33Å; F283-T285 PolarHBondContact O-N 3.21Å; T285-Y287 VanDerWaalsContact C-N 3.33Å; T285-Y287 PolarHBondContact O-N 3.19Å; T285-R288 PolarHBondContact O-N 2.95Å; T285-L289 HydrophobicContact CG2-CD1 3.87Å; T285-L289 HydrophobicContact CG2-CG 4.42Å; T285-L289 VanDerWaalsContact O-CG 3.29Å; T285-L289 WeakPolarHBondContact O-CG 3.41Å; T285-L289 PolarHBondContact O-N 2.89Å
286	V	84.9	Confident	81.5	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-45.1	176.7	174.1	0	0	0	0	110.9	V254 L258 A282 F283 R288 L289 G290 A294 F295	V254-V286 HydrophobicContact CG1-CG1 4.09Å; V254-V286 HydrophobicContact CG1-CG2 4.09Å; L258-V286 HydrophobicContact CD2-CG2 3.69Å; A282-V286 WeakPolarHBondContact O-CG2 3.43Å; A282-V286 PolarHBondContact O-N 3.38Å; F283-V286 PolarHBondContact O-N 2.99Å; V286-R288 VanDerWaalsContact C-N 3.34Å; V286-R288 PolarHBondContact O-N 3.42Å; V286-L289 PolarHBondContact O-N 3.02Å; V286-G290 PolarHBondContact O-N 3.4Å; V286-A294 HydrophobicContact CG1-CB 3.74Å; V286-A294 WeakPolarHBondContact O-CB 3.42Å; V286-F295 HydrophobicContact CB-CD1 4.3Å; V286-F295 HydrophobicContact CB-CE1 3.76Å; V286-F295 HydrophobicContact CB-CZ 3.9Å; V286-F295 HydrophobicContact CG1-CD1 3.62Å; V286-F295 HydrophobicContact CG1-CD2 4.08Å; V286-F295 HydrophobicContact CG1-CE1 3.57Å; V286-F295 HydrophobicContact CG1-CE2 4.05Å; V286-F295 HydrophobicContact CG1-CG 3.89Å; V286-F295 HydrophobicContact CG1-CZ 3.81Å
287	Y	86.2	Confident	82	Confident	137 Å²	137	63.7 Å²	63.7	54%	0.537	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-39.9	176.8	-174.8	-99	0	0	0	112.4	F283 T285 L289 G291 L292 F295	F283-Y287 WeakPolarHBondContact O-CB 3.38Å; F283-Y287 PolarHBondContact O-N 2.95Å; T285-Y287 VanDerWaalsContact C-N 3.33Å; T285-Y287 PolarHBondContact O-N 3.19Å; Y287-L289 VanDerWaalsContact C-N 3.34Å; Y287-L289 PolarHBondContact O-N 3.17Å; Y287-G291 WeakPolarHBondContact O-CA 3.48Å; Y287-G291 PolarHBondContact O-N 2.94Å; Y287-L292 HydrophobicContact CD2-CD2 4.38Å; Y287-L292 HydrophobicContact CE2-CD2 4.16Å; Y287-L292 HydrophobicContact CE2-CG 4.2Å; Y287-F295 HydrophobicContact CD2-CE2 4.13Å
288	R	82.3	Confident	82.2	Confident	139 Å²	139	61.1 Å²	61.1	53%	0.525	33%	0.331	S	S	.	.	H	α-helix	trans	-67.9	-31.6	176.9	-79.6	-179.6	170.7	-173	-7	113.6	V270 R284 T285 V286	V270-R288 HydrophobicContact CG1-CB 4.14Å; R284-R288 WeakPolarHBondContact O-CB 3.31Å; R284-R288 WeakPolarHBondContact O-CG 3.48Å; R284-R288 PolarHBondContact O-N 3.1Å; T285-R288 PolarHBondContact O-N 2.95Å; V286-R288 VanDerWaalsContact C-N 3.34Å; V286-R288 PolarHBondContact O-N 3.42Å
289	L	79.1	Confident	82.6	Confident	61 Å²	61	61.7 Å²	61.7	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-76.2	-33.5	-177.4	-74.9	168.1	0	0	0	113.6	L73 A266 S269 V270 T285 V286 Y287	L73-L289 HydrophobicContact CD1-CD1 3.93Å; A266-L289 HydrophobicContact CB-CD1 3.83Å; A266-L289 HydrophobicContact CB-CD2 4.37Å; S269-L289 VanDerWaalsContact OG-CD2 3.23Å; S269-L289 WeakPolarHBondContact OG-CD2 3.46Å; V270-L289 HydrophobicContact CG2-CD2 3.55Å; V270-L289 HydrophobicContact CG2-CG 3.87Å; T285-L289 HydrophobicContact CG2-CD1 3.87Å; T285-L289 HydrophobicContact CG2-CG 4.42Å; T285-L289 VanDerWaalsContact O-CG 3.29Å; T285-L289 WeakPolarHBondContact O-CG 3.41Å; T285-L289 PolarHBondContact O-N 2.89Å; V286-L289 PolarHBondContact O-N 3.02Å; Y287-L289 VanDerWaalsContact C-N 3.34Å; Y287-L289 PolarHBondContact O-N 3.17Å
290	G	75.9	Confident	82.6	Confident	41 Å²	41	65.8 Å²	65.8	42%	0.423	35%	0.347	S	S	.	.	H	α-helix	trans	-161.9	24.2	-176.1	0	0	0	0	0	115.1	V286 A294	V286-G290 PolarHBondContact O-N 3.4Å; G290-A294 PolarHBondContact O-N 2.89Å
291	G	85.6	Confident	82.2	Confident	24 Å²	24	62.2 Å²	62.2	25%	0.247	32%	0.318	C	S	.	.	H	α-helix	trans	62.2	-147.5	177.2	0	0	0	0	0	113.3	Y287 A293 A294	Y287-G291 WeakPolarHBondContact O-CA 3.48Å; Y287-G291 PolarHBondContact O-N 2.94Å; G291-A293 VanDerWaalsContact C-N 3.34Å; G291-A293 PolarHBondContact O-N 3.33Å; G291-A294 PolarHBondContact O-N 3.49Å
292	L	87.1	Confident	81.9	Confident	128 Å²	128	59 Å²	59	67%	0.67	30%	0.3	S	S	*	.	H	α-helix	trans	-67.9	-31.9	-179.9	-68.8	174	0	0	0	112.9	Y287 A294 F295	Y287-L292 HydrophobicContact CD2-CD2 4.38Å; Y287-L292 HydrophobicContact CE2-CD2 4.16Å; Y287-L292 HydrophobicContact CE2-CG 4.2Å; L292-A294 VanDerWaalsContact C-N 3.27Å; L292-A294 PolarHBondContact O-N 2.91Å; L292-F295 PolarHBondContact O-N 3.32Å
293	A	84.3	Confident	81.8	Confident	77 Å²	77	61.2 Å²	61.2	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-66.1	-29.9	-179.7	0	0	0	0	0	112.6	G291 F295 F296 K297	G291-A293 VanDerWaalsContact C-N 3.34Å; G291-A293 PolarHBondContact O-N 3.33Å; A293-F295 VanDerWaalsContact C-N 3.25Å; A293-F295 PolarHBondContact O-N 3.5Å; A293-F296 PolarHBondContact O-N 3.4Å; A293-F296 VanDerWaalsContact O-N 3.15Å; A293-K297 PolarHBondContact O-N 3.04Å
294	A	82.3	Confident	81.3	Confident	13 Å²	13	61.2 Å²	61.2	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-32.1	178.1	0	0	0	0	0	113.1	V286 G290 G291 L292 F296 K297	V286-A294 HydrophobicContact CG1-CB 3.74Å; V286-A294 WeakPolarHBondContact O-CB 3.42Å; G290-A294 PolarHBondContact O-N 2.89Å; G291-A294 PolarHBondContact O-N 3.49Å; L292-A294 VanDerWaalsContact C-N 3.27Å; L292-A294 PolarHBondContact O-N 2.91Å; A294-F296 PolarHBondContact O-N 2.87Å; A294-K297 WeakPolarHBondContact O-CB 3.21Å; A294-K297 PolarHBondContact O-N 3.15Å
295	F	85.9	Confident	80.6	Confident	17 Å²	17	55 Å²	55	8%	0.075	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-20.1	177.9	-71.7	-75.9	0	0	0	114.1	T250 P251 V254 F283 V286 Y287 L292 A293	T250-F295 CarbonylContact C-O 3.55Å; T250-F295 WeakPolarHBondContact CG2-O 3.27Å; P251-F295 WeakPolarHBondContact CA-O 3.09Å; P251-F295 HydrophobicContact CB-CB 3.99Å; P251-F295 HydrophobicContact CB-CD1 3.96Å; P251-F295 HydrophobicContact CB-CG 4.32Å; P251-F295 HydrophobicContact CG-CB 4.18Å; V254-F295 WeakPolarHBondContact CG2-O 3.28Å; F283-F295 HydrophobicContact CD1-CD1 4.21Å; F283-F295 AromaticContact CD1-CE1 3.26Å; F283-F295 HydrophobicContact CD1-CE1 3.26Å; F283-F295 AromaticContact CD1-CZ 3.67Å; F283-F295 HydrophobicContact CD1-CZ 3.67Å; F283-F295 HydrophobicContact CE1-CD1 4.2Å; F283-F295 AromaticContact CE1-CE1 3.68Å; F283-F295 HydrophobicContact CE1-CE1 3.68Å; F283-F295 HydrophobicContact CE1-CZ 4.4Å; F283-F295 HydrophobicContact CG-CE1 4.19Å; F283-F295 WeakPolarHBondContact O-CZ 3.31Å; V286-F295 HydrophobicContact CB-CD1 4.3Å; V286-F295 HydrophobicContact CB-CE1 3.76Å; V286-F295 HydrophobicContact CB-CZ 3.9Å; V286-F295 HydrophobicContact CG1-CD1 3.62Å; V286-F295 HydrophobicContact CG1-CD2 4.08Å; V286-F295 HydrophobicContact CG1-CE1 3.57Å; V286-F295 HydrophobicContact CG1-CE2 4.05Å; V286-F295 HydrophobicContact CG1-CG 3.89Å; V286-F295 HydrophobicContact CG1-CZ 3.81Å; Y287-F295 HydrophobicContact CD2-CE2 4.13Å; L292-F295 PolarHBondContact O-N 3.32Å; A293-F295 VanDerWaalsContact C-N 3.25Å; A293-F295 PolarHBondContact O-N 3.5Å
296	F	86.5	Confident	80	Confident	105 Å²	105	56.4 Å²	56.4	46%	0.461	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	9.3	179	-64.6	-84.5	0	0	0	112.1	P251 A293 A294 G298 V299	P251-F296 HydrophobicContact CG-CE1 4.12Å; P251-F296 HydrophobicContact CG-CE2 4.5Å; P251-F296 HydrophobicContact CG-CZ 4.02Å; A293-F296 PolarHBondContact O-N 3.4Å; A293-F296 VanDerWaalsContact O-N 3.15Å; A294-F296 PolarHBondContact O-N 2.87Å; F296-G298 PolarHBondContact O-N 2.93Å; F296-G298 VanDerWaalsContact O-N 3.14Å; F296-V299 HydrophobicContact CB-CB 4.42Å; F296-V299 HydrophobicContact CB-CG1 4.3Å; F296-V299 WeakPolarHBondContact O-CB 3.37Å; F296-V299 VanDerWaalsContact O-CG1 3.28Å; F296-V299 WeakPolarHBondContact O-CG1 3.44Å; F296-V299 PolarHBondContact O-N 2.87Å
297	K	79.6	Confident	79.2	Confident	80 Å²	80	62.5 Å²	62.5	35%	0.348	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	117.7	176.5	-161.9	-178.7	-177.4	-168.3	0	109.1	L73 A293 A294	L73-K297 HydrophobicContact CD2-CD 4.32Å; L73-K297 PolarHBondContact O-NZ 3.23Å; A293-K297 PolarHBondContact O-N 3.04Å; A294-K297 WeakPolarHBondContact O-CB 3.21Å; A294-K297 PolarHBondContact O-N 3.15Å
298	G	75.3	Confident	78.3	Confident	16 Å²	16	58.8 Å²	58.8	17%	0.165	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	6.3	-176.1	0	0	0	0	0	115.2	F296 Q300 A301 R302	F296-G298 PolarHBondContact O-N 2.93Å; F296-G298 VanDerWaalsContact O-N 3.14Å; G298-Q300 VanDerWaalsContact C-N 3.31Å; G298-Q300 PolarHBondContact O-N 3.16Å; G298-A301 VanDerWaalsContact O-CB 3.3Å; G298-A301 WeakPolarHBondContact O-CB 3.16Å; G298-A301 PolarHBondContact O-N 2.73Å; G298-A301 VanDerWaalsContact O-N 3.15Å; G298-R302 PolarHBondContact O-N 2.76Å
299	V	83	Confident	77.4	Confident	42 Å²	42	53.6 Å²	53.6	26%	0.255	31%	0.306	S	S	.	.	H	α-helix	trans	-55.9	-45.5	176.3	67.9	0	0	0	0	111.9	A247 T250 F296 A301 R302 V303	A247-V299 HydrophobicContact CB-CG2 4.17Å; T250-V299 HydrophobicContact CG2-CB 3.95Å; T250-V299 HydrophobicContact CG2-CG2 4.37Å; F296-V299 HydrophobicContact CB-CB 4.42Å; F296-V299 HydrophobicContact CB-CG1 4.3Å; F296-V299 WeakPolarHBondContact O-CB 3.37Å; F296-V299 VanDerWaalsContact O-CG1 3.28Å; F296-V299 WeakPolarHBondContact O-CG1 3.44Å; F296-V299 PolarHBondContact O-N 2.87Å; V299-A301 VanDerWaalsContact C-N 3.29Å; V299-A301 PolarHBondContact O-N 3.32Å; V299-R302 PolarHBondContact O-N 2.98Å; V299-R302 VanDerWaalsContact O-N 3.14Å; V299-V303 HydrophobicContact CG2-CG2 4.37Å; V299-V303 WeakPolarHBondContact O-CG2 3.26Å; V299-V303 PolarHBondContact O-N 3.39Å
300	Q	79	Confident	76.7	Confident	122 Å²	122	51.6 Å²	51.6	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-61.8	-40.7	179.4	-176.7	-175.6	-5.3	0	0	111.2	G298 I304	G298-Q300 VanDerWaalsContact C-N 3.31Å; G298-Q300 PolarHBondContact O-N 3.16Å; Q300-I304 HydrophobicContact CG-CD1 3.67Å; Q300-I304 HydrophobicContact CG-CG1 4.4Å; Q300-I304 WeakPolarHBondContact O-CB 3.28Å; Q300-I304 WeakPolarHBondContact O-CG1 3.27Å; Q300-I304 PolarHBondContact O-N 3.48Å
301	A	71.6	Confident	76.1	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-58.5	-53.4	175	0	0	0	0	0	109.2	M70 G298 V299 V303 I304 Y305	M70-A301 HydrophobicContact CB-CB 4.07Å; M70-A301 HydrophobicContact CE-CB 3.5Å; M70-A301 HydrophobicContact CG-CB 4.46Å; M70-A301 HydrophobicContact SD-CB 3.56Å; M70-A301 VanDerWaalsContact SD-CB 3.56Å; G298-A301 VanDerWaalsContact O-CB 3.3Å; G298-A301 WeakPolarHBondContact O-CB 3.16Å; G298-A301 PolarHBondContact O-N 2.73Å; G298-A301 VanDerWaalsContact O-N 3.15Å; V299-A301 VanDerWaalsContact C-N 3.29Å; V299-A301 PolarHBondContact O-N 3.32Å; A301-V303 PolarHBondContact O-N 2.8Å; A301-I304 PolarHBondContact O-N 2.9Å; A301-Y305 HydrophobicContact CB-CD2 4.21Å; A301-Y305 HydrophobicContact CB-CE2 3.77Å; A301-Y305 WeakPolarHBondContact O-CD2 3.43Å; A301-Y305 WeakPolarHBondContact O-CE2 3.25Å; A301-Y305 PolarHBondContact O-N 3.1Å
302	R	75	Confident	75.1	Confident	15 Å²	15	52 Å²	52	6%	0.057	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-41.5	-177.3	-156.9	-174.6	171.5	170.4	1	113.5	A246 T249 D253 G298 V299 Y305	A246-R302 HydrophobicContact CB-CB 4.28Å; A246-R302 HydrophobicContact CB-CG 3.71Å; T249-R302 PolarHBondContact O-NH1 2.84Å; T249-R302 PolarHBondContact OG1-NH1 3.4Å; T249-R302 PolarHBondContact OG1-NH2 2.66Å; D253-R302 IonicContact OD2-CZ 2.65Å; D253-R302 IonicContact OD2-NE 3.53Å; D253-R302 IonicContact OD2-NH1 3.07Å; D253-R302 PolarHBondContact OD2-NH1 3.08Å; G298-R302 PolarHBondContact O-N 2.76Å; V299-R302 PolarHBondContact O-N 2.98Å; V299-R302 VanDerWaalsContact O-N 3.14Å; R302-Y305 PolarHBondContact O-N 3.15Å
303	V	80.1	Confident	73.9	Confident	47 Å²	47	47.6 Å²	47.6	29%	0.285	27%	0.269	S	S	.	.	H	α-helix	trans	-65.6	-48	176.1	169.2	0	0	0	0	111.2	A243 A247 V299 A301 Y305 Q306	A243-V303 HydrophobicContact CB-CG1 3.83Å; A247-V303 HydrophobicContact CB-CG2 4.19Å; V299-V303 HydrophobicContact CG2-CG2 4.37Å; V299-V303 WeakPolarHBondContact O-CG2 3.26Å; V299-V303 PolarHBondContact O-N 3.39Å; A301-V303 PolarHBondContact O-N 2.8Å; V303-Y305 PolarHBondContact O-N 3.25Å; V303-Q306 WeakPolarHBondContact O-CB 3.46Å; V303-Q306 PolarHBondContact O-N 3.48Å; V303-Q306 VanDerWaalsContact O-N 3.15Å
304	I	77.1	Confident	72.8	Confident	71 Å²	71	45.2 Å²	45.2	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-32.1	179.5	-69.5	171.9	0	0	0	111.1	V84 Q300 A301 Q306 P308	V84-I304 HydrophobicContact CG2-CB 4.38Å; V84-I304 HydrophobicContact CG2-CG2 3.78Å; Q300-I304 HydrophobicContact CG-CD1 3.67Å; Q300-I304 HydrophobicContact CG-CG1 4.4Å; Q300-I304 WeakPolarHBondContact O-CB 3.28Å; Q300-I304 WeakPolarHBondContact O-CG1 3.27Å; Q300-I304 PolarHBondContact O-N 3.48Å; A301-I304 PolarHBondContact O-N 2.9Å; I304-Q306 VanDerWaalsContact C-N 3.26Å; I304-Q306 PolarHBondContact O-N 3.28Å; I304-P308 WeakPolarHBondContact O-CD 3.28Å
305	Y	69.6	Low	72	Confident	15 Å²	15	48.3 Å²	48.3	6%	0.059	27%	0.265	C	S	.	.	H	α-helix	trans	-67.6	-24.2	178.3	-77.6	-55.9	0	0	0	114.4	V63 V66 K67 V84 A301 R302 V303 M307 S309	V63-Y305 HydrophobicContact CB-CD1 4.44Å; V63-Y305 HydrophobicContact CB-CE1 4.27Å; V63-Y305 HydrophobicContact CG1-CD1 3.06Å; V63-Y305 HydrophobicContact CG1-CE1 3.21Å; V63-Y305 HydrophobicContact CG1-CG 4.21Å; V63-Y305 WeakPolarHBondContact O-CE1 3.46Å; V66-Y305 WeakPolarHBondContact CB-OH 3.42Å; V66-Y305 WeakPolarHBondContact CG1-OH 3.46Å; K67-Y305 HydrophobicContact CB-CD2 3.83Å; K67-Y305 HydrophobicContact CB-CE2 3.55Å; K67-Y305 HydrophobicContact CD-CD2 4.45Å; K67-Y305 HydrophobicContact CG-CD2 4.04Å; K67-Y305 HydrophobicContact CG-CE2 4.11Å; K67-Y305 PolarHBondContact N-OH 3.15Å; V84-Y305 HydrophobicContact CB-CE1 4.05Å; V84-Y305 HydrophobicContact CG1-CD1 4.28Å; V84-Y305 HydrophobicContact CG1-CE1 3.34Å; V84-Y305 WeakPolarHBondContact CG1-OH 3.48Å; V84-Y305 HydrophobicContact CG2-CD1 4.11Å; V84-Y305 HydrophobicContact CG2-CD2 4.49Å; V84-Y305 HydrophobicContact CG2-CE1 3.53Å; V84-Y305 HydrophobicContact CG2-CE2 3.88Å; V84-Y305 WeakPolarHBondContact CG2-OH 3.36Å; A301-Y305 HydrophobicContact CB-CD2 4.21Å; A301-Y305 HydrophobicContact CB-CE2 3.77Å; A301-Y305 WeakPolarHBondContact O-CD2 3.43Å; A301-Y305 WeakPolarHBondContact O-CE2 3.25Å; A301-Y305 PolarHBondContact O-N 3.1Å; R302-Y305 PolarHBondContact O-N 3.15Å; V303-Y305 PolarHBondContact O-N 3.25Å; Y305-M307 PolarHBondContact O-N 2.84Å; Y305-S309 WeakPolarHBondContact O-CB 3.35Å; Y305-S309 PolarHBondContact O-N 3.15Å
306	Q	69.7	Low	70.8	Confident	33 Å²	33	48.7 Å²	48.7	15%	0.154	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-43.3	-175.5	-169.6	66.8	40.8	0	0	111.9	G242 V303 I304 S309 T310	G242-Q306 VanDerWaalsContact CA-CG 3.48Å; V303-Q306 WeakPolarHBondContact O-CB 3.46Å; V303-Q306 PolarHBondContact O-N 3.48Å; V303-Q306 VanDerWaalsContact O-N 3.15Å; I304-Q306 VanDerWaalsContact C-N 3.26Å; I304-Q306 PolarHBondContact O-N 3.28Å; Q306-S309 PolarHBondContact O-N 2.84Å; Q306-T310 PolarHBondContact NE2-OG1 3.11Å; Q306-T310 WeakPolarHBondContact O-CB 3.45Å; Q306-T310 PolarHBondContact O-N 2.98Å; Q306-T310 PolarHBondContact O-OG1 3.43Å; Q306-T310 VanDerWaalsContact O-OG1 3.07Å
307	M	67.7	Low	69.5	Low	127 Å²	127	46.9 Å²	46.9	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-60.2	-53.2	-175.4	-84.4	-179.7	75.5	0	0	113.1	A239 Y305 S309 A311	A239-M307 HydrophobicContact CB-CG 3.57Å; Y305-M307 PolarHBondContact O-N 2.84Å; M307-S309 VanDerWaalsContact C-N 3.34Å; M307-S309 PolarHBondContact O-N 3.28Å; M307-A311 WeakPolarHBondContact O-CB 3.28Å; M307-A311 PolarHBondContact O-N 3.38Å
308	P	67.3	Low	68.7	Low	60 Å²	60	45.9 Å²	45.9	39%	0.39	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-37.5	175.3	-21.4	33.3	0	0	0	112.7	I304 A311 I312	I304-P308 WeakPolarHBondContact O-CD 3.28Å; P308-A311 PolarHBondContact O-N 3.06Å; P308-I312 WeakPolarHBondContact O-CB 3.46Å; P308-I312 WeakPolarHBondContact O-CD1 3.32Å; P308-I312 VanDerWaalsContact O-CG1 3.23Å; P308-I312 WeakPolarHBondContact O-CG1 3.18Å; P308-I312 PolarHBondContact O-N 3.34Å
309	S	63.7	Low	68.3	Low	29 Å²	29	50.7 Å²	50.7	20%	0.203	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-50.4	178.5	-167.2	0	0	0	0	111.5	M60 Y305 Q306 M307 A311 I312 A313	M60-S309 VanDerWaalsContact CE-CB 3.46Å; M60-S309 WeakPolarHBondContact CE-OG 3.38Å; Y305-S309 WeakPolarHBondContact O-CB 3.35Å; Y305-S309 PolarHBondContact O-N 3.15Å; Q306-S309 PolarHBondContact O-N 2.84Å; M307-S309 VanDerWaalsContact C-N 3.34Å; M307-S309 PolarHBondContact O-N 3.28Å; S309-A311 PolarHBondContact O-N 2.86Å; S309-I312 PolarHBondContact O-N 3.47Å; S309-A313 WeakPolarHBondContact O-CB 3.2Å; S309-A313 PolarHBondContact O-N 3.35Å
310	T	64	Low	67.3	Low	20 Å²	20	50.5 Å²	50.5	12%	0.123	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-45.2	177.1	-61.7	0	0	0	0	110.4	Q306 I312 A313 W314	Q306-T310 PolarHBondContact NE2-OG1 3.11Å; Q306-T310 WeakPolarHBondContact O-CB 3.45Å; Q306-T310 PolarHBondContact O-N 2.98Å; Q306-T310 PolarHBondContact O-OG1 3.43Å; Q306-T310 VanDerWaalsContact O-OG1 3.07Å; T310-I312 PolarHBondContact O-N 3.19Å; T310-A313 PolarHBondContact O-N 3.41Å; T310-W314 WeakPolarHBondContact O-CB 3.34Å; T310-W314 PolarHBondContact O-N 2.9Å
311	A	63	Low	66.5	Low	33 Å²	33	48.5 Å²	48.5	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-40.2	179.4	0	0	0	0	0	113.2	M307 P308 S309 S315	M307-A311 WeakPolarHBondContact O-CB 3.28Å; M307-A311 PolarHBondContact O-N 3.38Å; P308-A311 PolarHBondContact O-N 3.06Å; S309-A311 PolarHBondContact O-N 2.86Å; A311-S315 WeakPolarHBondContact O-CB 3.48Å; A311-S315 PolarHBondContact O-N 3.48Å; A311-S315 PolarHBondContact O-OG 3.4Å
312	I	65.1	Low	66.4	Low	41 Å²	41	55.4 Å²	55.4	21%	0.21	28%	0.284	C	S	.	.	H	α-helix	trans	-67.5	-48.8	176.8	-73.4	163.4	0	0	0	110.2	V59 M60 P308 S309 T310 W314 S315 V316	V59-I312 HydrophobicContact CB-CG2 4.06Å; V59-I312 HydrophobicContact CG1-CD1 4.11Å; V59-I312 HydrophobicContact CG1-CG1 4.38Å; V59-I312 HydrophobicContact CG1-CG2 3.53Å; M60-I312 HydrophobicContact CG-CG2 4.36Å; M60-I312 HydrophobicContact SD-CB 4.1Å; M60-I312 HydrophobicContact SD-CD1 3.5Å; M60-I312 VanDerWaalsContact SD-CD1 3.5Å; M60-I312 HydrophobicContact SD-CG1 4.39Å; M60-I312 HydrophobicContact SD-CG2 4.12Å; P308-I312 WeakPolarHBondContact O-CB 3.46Å; P308-I312 WeakPolarHBondContact O-CD1 3.32Å; P308-I312 VanDerWaalsContact O-CG1 3.23Å; P308-I312 WeakPolarHBondContact O-CG1 3.18Å; P308-I312 PolarHBondContact O-N 3.34Å; S309-I312 PolarHBondContact O-N 3.47Å; T310-I312 PolarHBondContact O-N 3.19Å; I312-W314 VanDerWaalsContact C-N 3.28Å; I312-W314 PolarHBondContact O-N 3.33Å; I312-S315 PolarHBondContact O-N 3.09Å; I312-S315 VanDerWaalsContact O-N 3.15Å; I312-V316 HydrophobicContact CG2-CG2 4.33Å; I312-V316 WeakPolarHBondContact O-CB 3.3Å; I312-V316 VanDerWaalsContact O-CG2 3.28Å; I312-V316 WeakPolarHBondContact O-CG2 3.23Å; I312-V316 PolarHBondContact O-N 3Å
313	A	62.2	Low	65.9	Low	34 Å²	34	59 Å²	59	28%	0.281	30%	0.3	S	S	.	.	H	α-helix	trans	-56.5	-44.3	177	0	0	0	0	0	111.3	S309 T310 V316 Y317	S309-A313 WeakPolarHBondContact O-CB 3.2Å; S309-A313 PolarHBondContact O-N 3.35Å; T310-A313 PolarHBondContact O-N 3.41Å; A313-V316 PolarHBondContact O-N 3.19Å; A313-Y317 WeakPolarHBondContact O-CB 3.36Å; A313-Y317 PolarHBondContact O-N 2.98Å
314	W	61.9	Low	65.1	Low	28 Å²	28	59 Å²	59	11%	0.106	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-42.4	176.8	-133.9	83.9	0	0	0	112.5	Y229 P231 H234 I235 T310 I312 V316 Y317 E318	Y229-W314 HydrophobicContact CE2-CH2 4.36Å; Y229-W314 WeakPolarHBondContact OH-CH2 3.47Å; P231-W314 HydrophobicContact CB-CH2 3.5Å; P231-W314 VanDerWaalsContact CB-CH2 3.5Å; P231-W314 HydrophobicContact CB-CZ2 4.35Å; P231-W314 HydrophobicContact CB-CZ3 3.64Å; P231-W314 HydrophobicContact CG-CH2 3.8Å; P231-W314 HydrophobicContact CG-CZ3 4.16Å; H234-W314 HydrophobicContact CB-CZ2 4.11Å; I235-W314 HydrophobicContact CG1-CD2 4.38Å; I235-W314 HydrophobicContact CG1-CG 4.33Å; T310-W314 WeakPolarHBondContact O-CB 3.34Å; T310-W314 PolarHBondContact O-N 2.9Å; I312-W314 VanDerWaalsContact C-N 3.28Å; I312-W314 PolarHBondContact O-N 3.33Å; W314-V316 PolarHBondContact O-N 2.95Å; W314-Y317 PolarHBondContact O-N 3.4Å; W314-E318 HydrophobicContact CD2-CG 4.4Å; W314-E318 HydrophobicContact CE3-CG 3.46Å; W314-E318 VanDerWaalsContact CE3-CG 3.46Å; W314-E318 HydrophobicContact CH2-CG 4.18Å; W314-E318 HydrophobicContact CZ3-CG 3.32Å; W314-E318 WeakPolarHBondContact O-CG 3.47Å; W314-E318 PolarHBondContact O-N 2.91Å
315	S	64	Low	64.5	Low	78 Å²	78	59 Å²	59	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-40.8	177.8	-59.7	0	0	0	0	111.9	A311 I312 F319	A311-S315 WeakPolarHBondContact O-CB 3.48Å; A311-S315 PolarHBondContact O-N 3.48Å; A311-S315 PolarHBondContact O-OG 3.4Å; I312-S315 PolarHBondContact O-N 3.09Å; I312-S315 VanDerWaalsContact O-N 3.15Å; S315-F319 VanDerWaalsContact O-CB 3.28Å; S315-F319 WeakPolarHBondContact O-CB 3.34Å; S315-F319 PolarHBondContact O-N 3.5Å
316	V	61.1	Low	64.6	Low	25 Å²	25	62.4 Å²	62.4	15%	0.152	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-45.8	175.4	171.4	0	0	0	0	109.8	I312 A313 W314 F319 F320	I312-V316 HydrophobicContact CG2-CG2 4.33Å; I312-V316 WeakPolarHBondContact O-CB 3.3Å; I312-V316 VanDerWaalsContact O-CG2 3.28Å; I312-V316 WeakPolarHBondContact O-CG2 3.23Å; I312-V316 PolarHBondContact O-N 3Å; A313-V316 PolarHBondContact O-N 3.19Å; W314-V316 PolarHBondContact O-N 2.95Å; V316-F319 WeakPolarHBondContact O-CB 3.44Å; V316-F319 PolarHBondContact O-N 3.42Å; V316-F320 HydrophobicContact CG1-CD2 3.72Å; V316-F320 HydrophobicContact CG1-CE2 3.74Å; V316-F320 VanDerWaalsContact O-CD2 3.25Å; V316-F320 WeakPolarHBondContact O-CD2 3.43Å; V316-F320 PolarHBondContact O-N 2.99Å
317	Y	59.6	Low	64.5	Low	66 Å²	66	66.1 Å²	66.1	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-51.2	176.9	176.9	-92.7	0	0	0	112.6	A313 W314 F319 F320 K321	A313-Y317 WeakPolarHBondContact O-CB 3.36Å; A313-Y317 PolarHBondContact O-N 2.98Å; W314-Y317 PolarHBondContact O-N 3.4Å; Y317-F319 VanDerWaalsContact C-N 3.28Å; Y317-F319 PolarHBondContact O-N 3.43Å; Y317-F320 PolarHBondContact O-N 3.12Å; Y317-F320 VanDerWaalsContact O-N 3.11Å; Y317-K321 HydrophobicContact CE1-CD 4.05Å; Y317-K321 WeakPolarHBondContact O-CB 3.45Å; Y317-K321 PolarHBondContact O-N 2.95Å
318	E	63.6	Low	64.3	Low	60 Å²	60	64 Å²	64	28%	0.28	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-39.1	179.3	-76.3	-67.5	104.1	0	0	111.8	Y229 W314 K321 Y322	Y229-E318 PolarHBondContact OH-OE1 2.91Å; Y229-E318 PolarHBondContact OH-OE2 3Å; W314-E318 HydrophobicContact CD2-CG 4.4Å; W314-E318 HydrophobicContact CE3-CG 3.46Å; W314-E318 VanDerWaalsContact CE3-CG 3.46Å; W314-E318 HydrophobicContact CH2-CG 4.18Å; W314-E318 HydrophobicContact CZ3-CG 3.32Å; W314-E318 WeakPolarHBondContact O-CG 3.47Å; W314-E318 PolarHBondContact O-N 2.91Å; E318-K321 PolarHBondContact O-N 3.47Å; E318-Y322 VanDerWaalsContact O-CB 3.3Å; E318-Y322 WeakPolarHBondContact O-CB 3.34Å; E318-Y322 PolarHBondContact O-N 2.91Å
319	F	66.4	Low	64.3	Low	116 Å²	116	65.7 Å²	65.7	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-47.7	173.9	-177.4	-92.8	0	0	0	111.1	S315 V316 Y317 Y322 F323	S315-F319 VanDerWaalsContact O-CB 3.28Å; S315-F319 WeakPolarHBondContact O-CB 3.34Å; S315-F319 PolarHBondContact O-N 3.5Å; V316-F319 WeakPolarHBondContact O-CB 3.44Å; V316-F319 PolarHBondContact O-N 3.42Å; Y317-F319 VanDerWaalsContact C-N 3.28Å; Y317-F319 PolarHBondContact O-N 3.43Å; F319-Y322 WeakPolarHBondContact O-CB 3.44Å; F319-Y322 PolarHBondContact O-N 3.31Å; F319-F323 AromaticContact CD1-CD2 3.91Å; F319-F323 HydrophobicContact CD1-CD2 3.91Å; F319-F323 HydrophobicContact CD1-CE2 4.11Å; F319-F323 HydrophobicContact CD2-CD2 4.34Å; F319-F323 HydrophobicContact CD2-CE2 4.01Å; F319-F323 AromaticContact CE1-CD2 3.63Å; F319-F323 HydrophobicContact CE1-CD2 3.63Å; F319-F323 AromaticContact CE1-CE2 3.49Å; F319-F323 HydrophobicContact CE1-CE2 3.49Å; F319-F323 VanDerWaalsContact CE1-CE2 3.49Å; F319-F323 HydrophobicContact CE1-CZ 4.36Å; F319-F323 HydrophobicContact CE2-CD2 4.11Å; F319-F323 AromaticContact CE2-CE2 3.4Å; F319-F323 HydrophobicContact CE2-CE2 3.4Å; F319-F323 HydrophobicContact CE2-CZ 4.32Å; F319-F323 HydrophobicContact CG-CD2 4.27Å; F319-F323 HydrophobicContact CG-CE2 4.35Å; F319-F323 AromaticContact CZ-CD2 3.76Å; F319-F323 HydrophobicContact CZ-CD2 3.76Å; F319-F323 AromaticContact CZ-CE2 3.1Å; F319-F323 HydrophobicContact CZ-CE2 3.1Å; F319-F323 AromaticContact CZ-CZ 3.84Å; F319-F323 HydrophobicContact CZ-CZ 3.84Å; F319-F323 WeakPolarHBondContact O-CD2 2.94Å; F319-F323 PolarHBondContact O-N 2.86Å
320	F	62.8	Low	64.8	Low	38 Å²	38	69.5 Å²	69.5	17%	0.167	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-45.2	177.4	-91.2	-73.2	0	0	0	113.1	V51 A52 L55 V316 Y317 Y322 F323 L324	V51-F320 HydrophobicContact CB-CZ 4.44Å; V51-F320 HydrophobicContact CG1-CE1 4.32Å; V51-F320 HydrophobicContact CG1-CZ 3.91Å; A52-F320 HydrophobicContact CB-CD2 3.83Å; A52-F320 HydrophobicContact CB-CE2 3.66Å; A52-F320 HydrophobicContact CB-CG 4.43Å; A52-F320 HydrophobicContact CB-CZ 4.11Å; L55-F320 HydrophobicContact CD1-CE2 3.74Å; L55-F320 HydrophobicContact CD1-CZ 3.62Å; V316-F320 HydrophobicContact CG1-CD2 3.72Å; V316-F320 HydrophobicContact CG1-CE2 3.74Å; V316-F320 VanDerWaalsContact O-CD2 3.25Å; V316-F320 WeakPolarHBondContact O-CD2 3.43Å; V316-F320 PolarHBondContact O-N 2.99Å; Y317-F320 PolarHBondContact O-N 3.12Å; Y317-F320 VanDerWaalsContact O-N 3.11Å; F320-Y322 VanDerWaalsContact C-N 3.3Å; F320-Y322 PolarHBondContact O-N 3.4Å; F320-F323 PolarHBondContact O-N 3.25Å; F320-L324 WeakPolarHBondContact O-CG 3.23Å; F320-L324 PolarHBondContact O-N 3.38Å
321	K	61.2	Low	64.8	Low	81 Å²	81	75 Å²	75	35%	0.352	37%	0.366	S	S	.	.	H	α-helix	trans	-58.9	-44.8	177	-173.1	177.4	178.7	-179.7	0	110.8	Y317 E318 F323 L324 T325	Y317-K321 HydrophobicContact CE1-CD 4.05Å; Y317-K321 WeakPolarHBondContact O-CB 3.45Å; Y317-K321 PolarHBondContact O-N 2.95Å; E318-K321 PolarHBondContact O-N 3.47Å; K321-F323 PolarHBondContact O-N 3.22Å; K321-L324 PolarHBondContact O-N 3.1Å; K321-T325 WeakPolarHBondContact O-CB 3.28Å; K321-T325 PolarHBondContact O-N 2.66Å; K321-T325 PolarHBondContact O-OG1 2.98Å
322	Y	68.8	Low	65	Low	146 Å²	146	76.3 Å²	76.3	57%	0.573	37%	0.366	S	S	*	.	H	α-helix	trans	-57.7	-45.6	175.2	175.6	-99.5	0	0	0	112.3	E318 F319 F320 K326	E318-Y322 VanDerWaalsContact O-CB 3.3Å; E318-Y322 WeakPolarHBondContact O-CB 3.34Å; E318-Y322 PolarHBondContact O-N 2.91Å; F319-Y322 WeakPolarHBondContact O-CB 3.44Å; F319-Y322 PolarHBondContact O-N 3.31Å; F320-Y322 VanDerWaalsContact C-N 3.3Å; F320-Y322 PolarHBondContact O-N 3.4Å; Y322-K326 HydrophobicContact CE1-CD 4.31Å; Y322-K326 VanDerWaalsContact O-CB 3.23Å; Y322-K326 WeakPolarHBondContact O-CB 3.41Å; Y322-K326 PolarHBondContact O-N 2.97Å
323	F	65.7	Low	65.1	Low	91 Å²	91	77.4 Å²	77.4	40%	0.399	38%	0.381	S	S	.	.	H	α-helix	trans	-65.6	-42.9	179.5	-93.3	-87.7	0	0	0	113.3	F319 F320 K321 K326 Q327	F319-F323 AromaticContact CD1-CD2 3.91Å; F319-F323 HydrophobicContact CD1-CD2 3.91Å; F319-F323 HydrophobicContact CD1-CE2 4.11Å; F319-F323 HydrophobicContact CD2-CD2 4.34Å; F319-F323 HydrophobicContact CD2-CE2 4.01Å; F319-F323 AromaticContact CE1-CD2 3.63Å; F319-F323 HydrophobicContact CE1-CD2 3.63Å; F319-F323 AromaticContact CE1-CE2 3.49Å; F319-F323 HydrophobicContact CE1-CE2 3.49Å; F319-F323 VanDerWaalsContact CE1-CE2 3.49Å; F319-F323 HydrophobicContact CE1-CZ 4.36Å; F319-F323 HydrophobicContact CE2-CD2 4.11Å; F319-F323 AromaticContact CE2-CE2 3.4Å; F319-F323 HydrophobicContact CE2-CE2 3.4Å; F319-F323 HydrophobicContact CE2-CZ 4.32Å; F319-F323 HydrophobicContact CG-CD2 4.27Å; F319-F323 HydrophobicContact CG-CE2 4.35Å; F319-F323 AromaticContact CZ-CD2 3.76Å; F319-F323 HydrophobicContact CZ-CD2 3.76Å; F319-F323 AromaticContact CZ-CE2 3.1Å; F319-F323 HydrophobicContact CZ-CE2 3.1Å; F319-F323 AromaticContact CZ-CZ 3.84Å; F319-F323 HydrophobicContact CZ-CZ 3.84Å; F319-F323 WeakPolarHBondContact O-CD2 2.94Å; F319-F323 PolarHBondContact O-N 2.86Å; F320-F323 PolarHBondContact O-N 3.25Å; K321-F323 PolarHBondContact O-N 3.22Å; F323-K326 PolarHBondContact O-N 3.22Å; F323-Q327 PolarHBondContact O-N 3.22Å
324	L	62.6	Low	65.4	Low	46 Å²	46	80 Å²	80	24%	0.241	40%	0.403	C	S	.	.	H	α-helix	trans	-65.2	-44.7	178.1	-71	173.1	0	0	0	111.6	L36 F320 K321 K326 Q327 K328	L36-L324 HydrophobicContact CD1-CD1 3.75Å; L36-L324 HydrophobicContact CD2-CD1 3.8Å; L36-L324 HydrophobicContact CG-CD1 4.44Å; F320-L324 WeakPolarHBondContact O-CG 3.23Å; F320-L324 PolarHBondContact O-N 3.38Å; K321-L324 PolarHBondContact O-N 3.1Å; L324-K326 VanDerWaalsContact C-N 3.34Å; L324-K326 PolarHBondContact O-N 3.1Å; L324-Q327 PolarHBondContact O-N 3.47Å; L324-K328 PolarHBondContact O-N 3.31Å; L324-K328 VanDerWaalsContact O-N 3.09Å
325	T	65.1	Low	65.8	Low	71 Å²	71	82.2 Å²	82.2	44%	0.436	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-40.4	176.6	-56.9	0	0	0	0	111.4	K321 K328 L329	K321-T325 WeakPolarHBondContact O-CB 3.28Å; K321-T325 PolarHBondContact O-N 2.66Å; K321-T325 PolarHBondContact O-OG1 2.98Å; T325-K328 WeakPolarHBondContact O-CB 3.5Å; T325-K328 PolarHBondContact O-N 3.29Å; T325-L329 HydrophobicContact CG2-CD1 4.28Å; T325-L329 WeakPolarHBondContact O-CG 3.49Å; T325-L329 PolarHBondContact O-N 3.4Å
326	K	71.9	Confident	65.1	Low	88 Å²	88	81.5 Å²	81.5	38%	0.383	43%	0.427	S	S	.	.	H	α-helix	trans	-61.8	-45.7	176.5	-178.7	177.8	171.2	179.7	0	112	Y322 F323 L324 K328 L329 E330	Y322-K326 HydrophobicContact CE1-CD 4.31Å; Y322-K326 VanDerWaalsContact O-CB 3.23Å; Y322-K326 WeakPolarHBondContact O-CB 3.41Å; Y322-K326 PolarHBondContact O-N 2.97Å; F323-K326 PolarHBondContact O-N 3.22Å; L324-K326 VanDerWaalsContact C-N 3.34Å; L324-K326 PolarHBondContact O-N 3.1Å; K326-K328 VanDerWaalsContact C-N 3.27Å; K326-K328 PolarHBondContact O-N 3.44Å; K326-L329 PolarHBondContact O-N 3.45Å; K326-E330 WeakPolarHBondContact CE-OE1 3.38Å; K326-E330 IonicContact NZ-OE1 3.81Å; K326-E330 WeakPolarHBondContact O-CG 3.42Å; K326-E330 PolarHBondContact O-N 2.97Å
327	Q	67.1	Low	64.6	Low	110 Å²	110	87.9 Å²	87.9	51%	0.514	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-36.8	176.2	-80.4	-172	-21.6	0	0	112.3	F323 L324 E330 Q331	F323-Q327 PolarHBondContact O-N 3.22Å; L324-Q327 PolarHBondContact O-N 3.47Å; Q327-E330 PolarHBondContact O-N 3.07Å; Q327-Q331 WeakPolarHBondContact O-CB 3.27Å; Q327-Q331 WeakPolarHBondContact O-CG 3.27Å; Q327-Q331 PolarHBondContact O-N 3.33Å
328	K	64.6	Low	64	Low	83 Å²	83	93.7 Å²	93.7	36%	0.361	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-48.8	175.9	-174.9	179.6	172.8	-175.3	0	111.6	H39 L324 T325 K326 E330 Q331 E332	H39-K328 PolarHBondContact CD2-NZ 2.9Å; H39-K328 PolarHBondContact NE2-NZ 3.25Å; L324-K328 PolarHBondContact O-N 3.31Å; L324-K328 VanDerWaalsContact O-N 3.09Å; T325-K328 WeakPolarHBondContact O-CB 3.5Å; T325-K328 PolarHBondContact O-N 3.29Å; K326-K328 VanDerWaalsContact C-N 3.27Å; K326-K328 PolarHBondContact O-N 3.44Å; K328-E330 VanDerWaalsContact C-N 3.3Å; K328-E330 PolarHBondContact O-N 3.04Å; K328-Q331 PolarHBondContact O-N 2.82Å; K328-Q331 VanDerWaalsContact O-N 3.12Å; K328-E332 WeakPolarHBondContact CE-OE1 2.91Å; K328-E332 IonicContact NZ-OE1 3.54Å; K328-E332 WeakPolarHBondContact O-CG 3.34Å; K328-E332 PolarHBondContact O-N 3.22Å
329	L	67.3	Low	64	Low	95 Å²	95	95.4 Å²	95.4	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-39.1	177.1	-68.7	170.1	0	0	0	112	T325 K326 A333	T325-L329 HydrophobicContact CG2-CD1 4.28Å; T325-L329 WeakPolarHBondContact O-CG 3.49Å; T325-L329 PolarHBondContact O-N 3.4Å; K326-L329 PolarHBondContact O-N 3.45Å; L329-A333 VanDerWaalsContact O-CB 3.27Å; L329-A333 WeakPolarHBondContact O-CB 3.5Å; L329-A333 PolarHBondContact O-N 3.33Å
330	E	72.6	Confident	63.8	Low	109 Å²	109	94.3 Å²	94.3	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-66.6	-35.4	175	-73.3	175.4	173.1	0	0	112.3	K326 Q327 K328 A334	K326-E330 WeakPolarHBondContact CE-OE1 3.38Å; K326-E330 IonicContact NZ-OE1 3.81Å; K326-E330 WeakPolarHBondContact O-CG 3.42Å; K326-E330 PolarHBondContact O-N 2.97Å; Q327-E330 PolarHBondContact O-N 3.07Å; K328-E330 VanDerWaalsContact C-N 3.3Å; K328-E330 PolarHBondContact O-N 3.04Å; E330-A334 VanDerWaalsContact O-CB 3.27Å; E330-A334 WeakPolarHBondContact O-CB 3.39Å; E330-A334 PolarHBondContact O-N 3.03Å
331	Q	64.7	Low	63.9	Low	136 Å²	136	97.4 Å²	97.4	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-71.9	-42.1	174.9	-78.7	178.9	-10.9	0	0	112.7	Q327 K328 A334 S335	Q327-Q331 WeakPolarHBondContact O-CB 3.27Å; Q327-Q331 WeakPolarHBondContact O-CG 3.27Å; Q327-Q331 PolarHBondContact O-N 3.33Å; K328-Q331 PolarHBondContact O-N 2.82Å; K328-Q331 VanDerWaalsContact O-N 3.12Å; Q331-A334 PolarHBondContact O-N 2.96Å; Q331-S335 WeakPolarHBondContact O-CB 3.48Å; Q331-S335 PolarHBondContact O-N 2.84Å; Q331-S335 PolarHBondContact O-OG 3.13Å
332	E	66.8	Low	64.1	Low	61 Å²	61	98.4 Å²	98.4	29%	0.285	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-44.6	176.2	-73.9	170.6	171	0	0	110.6	K328 A334 S335 G336 Q337 L338	K328-E332 WeakPolarHBondContact CE-OE1 2.91Å; K328-E332 IonicContact NZ-OE1 3.54Å; K328-E332 WeakPolarHBondContact O-CG 3.34Å; K328-E332 PolarHBondContact O-N 3.22Å; E332-A334 PolarHBondContact O-N 2.91Å; E332-S335 WeakPolarHBondContact CA-OG 3.3Å; E332-S335 PolarHBondContact O-N 3.16Å; E332-S335 PolarHBondContact O-OG 3.31Å; E332-G336 PolarHBondContact O-N 3.22Å; E332-Q337 PolarHBondContact O-N 2.87Å; E332-L338 HydrophobicContact CB-CD1 4.44Å
333	A	67.8	Low	63.8	Low	63 Å²	63	95.4 Å²	95.4	52%	0.521	53%	0.526	S	S	.	.	H	α-helix	trans	-62.7	-37.5	173.4	0	0	0	0	0	113	L329 L338	L329-A333 VanDerWaalsContact O-CB 3.27Å; L329-A333 WeakPolarHBondContact O-CB 3.5Å; L329-A333 PolarHBondContact O-N 3.33Å; A333-L338 HydrophobicContact CB-CD1 4.45Å
334	A	67.9	Low	63.6	Low	90 Å²	90	95.7 Å²	95.7	74%	0.744	53%	0.534	S	S	*	.	H	α-helix	trans	-73.4	-25.6	176.4	0	0	0	0	0	113.5	E330 Q331 E332	E330-A334 VanDerWaalsContact O-CB 3.27Å; E330-A334 WeakPolarHBondContact O-CB 3.39Å; E330-A334 PolarHBondContact O-N 3.03Å; Q331-A334 PolarHBondContact O-N 2.96Å; E332-A334 PolarHBondContact O-N 2.91Å
335	S	71.2	Confident	63.7	Low	74 Å²	74	99.2 Å²	99.2	52%	0.517	56%	0.555	S	S	.	*	H	α-helix	trans	-85	-4.8	178	68.1	0	0	0	0	114.5	Q331 E332	Q331-S335 WeakPolarHBondContact O-CB 3.48Å; Q331-S335 PolarHBondContact O-N 2.84Å; Q331-S335 PolarHBondContact O-OG 3.13Å; E332-S335 WeakPolarHBondContact CA-OG 3.3Å; E332-S335 PolarHBondContact O-N 3.16Å; E332-S335 PolarHBondContact O-OG 3.31Å
336	G	48.8	Very low	63.6	Low	62 Å²	62	101.4 Å²	101.4	64%	0.639	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.6	27.3	178.5	0	0	0	0	0	114.3	E332	E332-G336 PolarHBondContact O-N 3.22Å
337	Q	49.3	Very low	62.9	Low	160 Å²	160	102.5 Å²	102.5	75%	0.748	58%	0.579	S	S	*	*			trans	-93.6	12.2	175.9	-71.8	-169.5	-34.1	0	0	113.7	E332	E332-Q337 PolarHBondContact O-N 2.87Å
338	L	47	Very low	62.6	Low	187 Å²	187	101.8 Å²	101.8	98%	0.979	59%	0.585	S	S	*	*			trans	-120.9	0	174.6	-85.3	161	0	0	0	111.1	E332 A333	E332-L338 HydrophobicContact CB-CD1 4.44Å; A333-L338 HydrophobicContact CB-CD1 4.45Å

Retrieved 338 of 338 residues in 1097.3 ms (Link to these results)

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