A0A087YQC6_POEFO Loading...

G protein-coupled receptor 45

AlphaFold DB , UniProt , Accession A0A087YQC6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 389 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	32.1	Very low	250 Å²	250	157.6 Å²	157.6	100%	1.232	89%	0.889	S	S	*	*				0	91	0	-155	162.8	97.8	0	0	108
2	K	31.6	Very low	32	Very low	211 Å²	211	159.2 Å²	159.2	92%	0.917	89%	0.891	S	S	*	*			trans	-129.5	122.6	176.4	-95.4	-179.4	175.3	-179.8	0	107.3
3	A	30.7	Very low	32.4	Very low	101 Å²	101	160.2 Å²	160.2	84%	0.835	89%	0.893	S	S	*	*			trans	-71.1	141.9	-174.5	0	0	0	0	0	111.6
4	A	32.4	Very low	32.4	Very low	102 Å²	102	160 Å²	160	84%	0.843	89%	0.889	S	S	*	*			trans	-80.3	130.2	163.8	0	0	0	0	0	108.9
5	M	30.6	Very low	32.2	Very low	182 Å²	182	158.7 Å²	158.7	90%	0.897	88%	0.879	S	S	*	*			trans	-107.2	113.8	160.1	-82.9	-171.5	-169.7	0	0	107.4
6	A	33.3	Very low	32	Very low	95 Å²	95	157.6 Å²	157.6	79%	0.785	88%	0.884	S	S	*	*			trans	-87.5	132.3	167.1	0	0	0	0	0	108.7
7	F	30.3	Very low	31.9	Very low	203 Å²	203	156.2 Å²	156.2	89%	0.89	87%	0.874	S	S	*	*			trans	-114.9	102.9	161.5	-105.7	-85.4	0	0	0	106.8
8	C	30.1	Very low	31.9	Very low	128 Å²	128	157.7 Å²	157.7	87%	0.865	88%	0.879	S	S	*	*			trans	-91.3	135.2	160.1	-87.7	0	0	0	0	107.8
9	N	27.3	Very low	31.8	Very low	166 Å²	166	157.7 Å²	157.7	89%	0.888	88%	0.876	S	S	*	*			trans	-114.7	129.1	165.1	-155.7	17.5	0	0	0	108	S11	N9-S11 PolarHBondContact O-N 3.47Å
10	E	36.8	Very low	31.8	Very low	192 Å²	192	158.3 Å²	158.3	90%	0.897	87%	0.872	S	S	*	*			trans	-70.3	119.9	-175.3	-76.1	-168.4	114.4	0	0	112.1
11	S	33.3	Very low	31.7	Very low	104 Å²	104	156.6 Å²	156.6	73%	0.727	87%	0.869	S	S	*	*			trans	-174.6	125.4	135.9	56	0	0	0	0	110.1	N9	N9-S11 PolarHBondContact O-N 3.47Å
12	L	31.2	Very low	31.5	Very low	176 Å²	176	151.8 Å²	151.8	92%	0.921	85%	0.848	S	S	*	*			trans	89.9	98.6	176	-72.3	144.8	0	0	0	116.7
13	L	36.8	Very low	31.4	Very low	173 Å²	173	146.5 Å²	146.5	91%	0.906	84%	0.843	S	S	*	*			trans	-68.4	110.7	161.4	-90.9	138	0	0	0	110.2
14	D	32.6	Very low	31.5	Very low	157 Å²	157	150.7 Å²	150.7	84%	0.84	85%	0.846	S	S	*	*				-169.5	146.1	127.7	-116.3	-15.8	0	0	0	108.8
15	D	28.8	Very low	31.3	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	85%	0.846	S	S	*	*			trans	80.1	85.9	-176.1	-72.9	-23.6	0	0	0	118.6
16	C	29.4	Very low	31.3	Very low	141 Å²	141	151.8 Å²	151.8	95%	0.953	84%	0.842	S	S	*	*			trans	-95.9	85.4	148.3	-80.7	0	0	0	0	109.2
17	D	30.7	Very low	31.3	Very low	134 Å²	134	151.3 Å²	151.3	72%	0.717	84%	0.838	S	S	*	*			trans	-87.8	125.3	163.3	-96.5	-27.3	0	0	0	110.3	L19	D17-L19 PolarHBondContact O-N 3.26Å
18	L	32.3	Very low	31.4	Very low	183 Å²	183	150.9 Å²	150.9	96%	0.958	84%	0.839	S	S	*	*			trans	-63.4	108.1	167.7	-100.1	137.8	0	0	0	109
19	L	29.1	Very low	31.4	Very low	159 Å²	159	151.3 Å²	151.3	83%	0.832	84%	0.838	S	S	*	*			trans	-112.5	113.1	171.8	-114.1	139.8	0	0	0	110	D17	D17-L19 PolarHBondContact O-N 3.26Å
20	E	31.4	Very low	31.8	Very low	169 Å²	169	151 Å²	151	79%	0.79	84%	0.836	S	S	*	*			trans	-52.7	141.7	167.6	-68.8	173.9	119.2	0	0	110.9	D22	E20-D22 PolarHBondContact O-N 3.34Å
21	P	31.2	Very low	31.8	Very low	123 Å²	123	147 Å²	147	80%	0.799	83%	0.826	S	S	*	*	S	Bend	trans	-92.4	73.7	173.3	36.7	-29.3	0	0	0	109.6
22	D	32.8	Very low	32.1	Very low	148 Å²	148	147.7 Å²	147.7	79%	0.791	83%	0.828	S	S	*	*			trans	-137.7	83.7	167.1	-81.3	-41.1	0	0	0	110.1	E20	E20-D22 PolarHBondContact O-N 3.34Å
23	A	29.5	Very low	32.5	Very low	100 Å²	100	148.7 Å²	148.7	83%	0.826	83%	0.828	S	S	*	*			trans	-141.2	77.9	157.6	0	0	0	0	0	107.5	E25	A23-E25 PolarHBondContact O-N 3.19Å
24	E	31.5	Very low	32.6	Very low	190 Å²	190	143.9 Å²	143.9	89%	0.888	81%	0.813	S	S	*	*			trans	-51.4	123.3	157.4	-85.6	179.7	142.6	0	0	108.3
25	E	29.4	Very low	33.2	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	81%	0.808	S	S	*	*			trans	-46	137.4	158.2	-83.2	-175.7	134.3	0	0	108.6	A23 A27	A23-E25 PolarHBondContact O-N 3.19Å; E25-A27 PolarHBondContact O-N 3.44Å
26	P	30.5	Very low	34.4	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	80%	0.799	S	S	*	*			trans	-63.4	107.2	173.7	26	-30.2	0	0	0	107.5	E28	P26-E28 PolarHBondContact O-N 3.47Å; P26-E28 VanDerWaalsContact O-N 3.12Å
27	A	32	Very low	35.6	Very low	86 Å²	86	134.1 Å²	134.1	71%	0.711	77%	0.767	S	S	*	*			trans	-42.3	121.8	166.3	0	0	0	0	0	108	E25 T29	E25-A27 PolarHBondContact O-N 3.44Å; A27-T29 PolarHBondContact O-N 3.26Å
28	E	32.5	Very low	37	Very low	194 Å²	194	135.4 Å²	135.4	91%	0.907	77%	0.773	S	S	*	*			trans	-44.4	111.5	168.6	-88.1	-174.1	143.5	0	0	107.6	P26 L30	P26-E28 PolarHBondContact O-N 3.47Å; P26-E28 VanDerWaalsContact O-N 3.12Å; E28-L30 PolarHBondContact O-N 2.92Å
29	T	31.1	Very low	39	Very low	137 Å²	137	128.2 Å²	128.2	84%	0.84	74%	0.735	S	S	*	*			trans	-59.3	107.3	178.4	25	0	0	0	0	107.2	A27	A27-T29 PolarHBondContact O-N 3.26Å
30	L	36.3	Very low	41.7	Very low	160 Å²	160	123.7 Å²	123.7	84%	0.838	72%	0.717	S	S	*	*			trans	-42.8	127.5	160	-86.4	151.4	0	0	0	107.1	E28	E28-L30 PolarHBondContact O-N 2.92Å
31	P	36.2	Very low	44.4	Very low	108 Å²	108	120.7 Å²	120.7	70%	0.701	71%	0.71	S	S	*	*			trans	-55.5	143.5	177.8	22.8	-31	0	0	0	108.5	E33	P31-E33 PolarHBondContact O-N 3.49Å
32	P	38.2	Very low	47.1	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	70%	0.702	S	S	*	*			trans	-51.1	136.8	-178.9	22.5	-32.7	0	0	0	108.4	A34	P32-A34 VanDerWaalsContact C-N 3.26Å; P32-A34 PolarHBondContact O-N 3.44Å
33	E	40	Very low	49.8	Very low	197 Å²	197	116.7 Å²	116.7	92%	0.921	69%	0.685	S	S	*	*			trans	-44.9	95.6	172.4	-82.8	-175.2	142.2	0	0	108.7	P31 S35	P31-E33 PolarHBondContact O-N 3.49Å; E33-S35 PolarHBondContact O-N 3.06Å
34	A	39.4	Very low	52.7	Low	73 Å²	73	113.9 Å²	113.9	60%	0.603	65%	0.653	S	S	*	*			trans	-68.8	103.7	176.3	0	0	0	0	0	104.5	P32 P36	P32-A34 VanDerWaalsContact C-N 3.26Å; P32-A34 PolarHBondContact O-N 3.44Å; A34-P36 VanDerWaalsContact O-N 3.17Å
35	S	45.8	Very low	55.4	Low	105 Å²	105	108.9 Å²	108.9	73%	0.734	64%	0.635	S	S	*	*			trans	-48.1	125.9	171.8	45.7	0	0	0	0	107.8	E33	E33-S35 PolarHBondContact O-N 3.06Å
36	P	53.5	Low	58.4	Low	85 Å²	85	103.3 Å²	103.3	55%	0.552	61%	0.613	S	S	*	*			trans	-57	141.9	-176	21.1	-31.2	0	0	0	108.6	A34 L38	A34-P36 VanDerWaalsContact O-N 3.17Å; P36-L38 PolarHBondContact O-N 3.27Å
37	P	54.2	Low	61.3	Low	42 Å²	42	99.2 Å²	99.2	27%	0.273	59%	0.585	S	S	.	*			trans	-50.1	115.2	-176.8	22.2	-35.1	0	0	0	109.2	I39 P317 Y320	P37-I39 PolarHBondContact O-N 3.1Å; P37-P317 WeakPolarHBondContact CG-O 2.97Å; P37-Y320 HydrophobicContact CG-CD1 4.44Å
38	L	59.9	Low	64.1	Low	162 Å²	162	95.5 Å²	95.5	85%	0.848	55%	0.554	S	S	*	*			trans	-75.6	72.7	-171.9	-161.9	76.7	0	0	0	109.6	P36 S40	P36-L38 PolarHBondContact O-N 3.27Å; L38-S40 PolarHBondContact O-N 3.17Å
39	I	73.9	Confident	67	Low	31 Å²	31	88.9 Å²	88.9	16%	0.159	53%	0.532	C	S	.	.			trans	-55.9	124.1	164.8	-58.3	-174.5	0	0	0	106.4	P37 L43 R44 Y320	P37-I39 PolarHBondContact O-N 3.1Å; I39-L43 HydrophobicContact CG2-CB 3.92Å; I39-L43 HydrophobicContact CG2-CD2 3.68Å; I39-L43 HydrophobicContact CG2-CG 3.74Å; I39-R44 HydrophobicContact CB-CG 4.09Å; I39-R44 HydrophobicContact CG2-CG 3.65Å; I39-R44 PolarHBondContact O-NE 3.45Å; I39-R44 PolarHBondContact O-NH2 3.3Å; I39-Y320 HydrophobicContact CD1-CD1 3.87Å; I39-Y320 HydrophobicContact CD1-CE1 3.62Å
40	S	86.4	Confident	70.1	Confident	64 Å²	64	86.2 Å²	86.2	45%	0.448	51%	0.512	S	S	.	.			trans	-57	145.5	-177.9	69.5	0	0	0	0	111.2	L38 T42 L43 R44	L38-S40 PolarHBondContact O-N 3.17Å; S40-T42 PolarHBondContact O-N 2.9Å; S40-L43 WeakPolarHBondContact O-CB 3.34Å; S40-L43 PolarHBondContact O-N 3.28Å; S40-L43 VanDerWaalsContact OG-CB 3.25Å; S40-L43 WeakPolarHBondContact OG-CB 3.46Å; S40-L43 PolarHBondContact OG-N 3.12Å; S40-R44 PolarHBondContact O-N 3.26Å
41	V	87.3	Confident	72.8	Confident	107 Å²	107	78.6 Å²	78.6	65%	0.648	47%	0.472	S	S	*	.	H	α-helix	trans	-55.6	-42.3	179.5	176.8	0	0	0	0	110.6	L43 R44 V45	V41-L43 VanDerWaalsContact C-N 3.31Å; V41-L43 PolarHBondContact O-N 3.39Å; V41-R44 PolarHBondContact O-N 3.22Å; V41-V45 HydrophobicContact CG1-CG2 4.26Å; V41-V45 WeakPolarHBondContact O-CG2 3.35Å; V41-V45 PolarHBondContact O-N 2.93Å
42	T	89.3	Confident	75.6	Confident	105 Å²	105	78.2 Å²	78.2	64%	0.644	46%	0.463	S	S	*	.	H	α-helix	trans	-55.7	-45.5	174.8	-49.8	0	0	0	0	111.8	S40 V45 T46	S40-T42 PolarHBondContact O-N 2.9Å; T42-V45 PolarHBondContact O-N 3.2Å; T42-T46 HydrophobicContact CG2-CG2 4.49Å; T42-T46 WeakPolarHBondContact O-CB 3.38Å; T42-T46 VanDerWaalsContact O-CG2 3.22Å; T42-T46 WeakPolarHBondContact O-CG2 3.31Å; T42-T46 PolarHBondContact O-N 3.49Å; T42-T46 PolarHBondContact O-OG1 3.44Å; T42-T46 VanDerWaalsContact O-OG1 3.06Å
43	L	89.4	Confident	78.3	Confident	81 Å²	81	78.8 Å²	78.8	42%	0.424	45%	0.454	S	S	.	.	H	α-helix	trans	-67.4	-38.8	178.8	-179.7	57.7	0	0	0	112.1	I39 S40 V41 T46 L47	I39-L43 HydrophobicContact CG2-CB 3.92Å; I39-L43 HydrophobicContact CG2-CD2 3.68Å; I39-L43 HydrophobicContact CG2-CG 3.74Å; S40-L43 WeakPolarHBondContact O-CB 3.34Å; S40-L43 PolarHBondContact O-N 3.28Å; S40-L43 VanDerWaalsContact OG-CB 3.25Å; S40-L43 WeakPolarHBondContact OG-CB 3.46Å; S40-L43 PolarHBondContact OG-N 3.12Å; V41-L43 VanDerWaalsContact C-N 3.31Å; V41-L43 PolarHBondContact O-N 3.39Å; L43-T46 WeakPolarHBondContact CA-OG1 3.24Å; L43-T46 PolarHBondContact O-OG1 2.9Å; L43-L47 HydrophobicContact CD1-CD1 4.04Å; L43-L47 HydrophobicContact CD1-CG 4.01Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 HydrophobicContact CG-CG 4.42Å; L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.37Å; L43-L47 PolarHBondContact O-N 2.88Å
44	R	89.3	Confident	80.9	Confident	42 Å²	42	70 Å²	70	16%	0.158	41%	0.413	C	S	.	.	H	α-helix	trans	-63	-46.2	175.7	-65.4	179.4	-165.1	-172.6	-4.6	111.9	I39 S40 V41 L47 A48 V105	I39-R44 HydrophobicContact CB-CG 4.09Å; I39-R44 HydrophobicContact CG2-CG 3.65Å; I39-R44 PolarHBondContact O-NE 3.45Å; I39-R44 PolarHBondContact O-NH2 3.3Å; S40-R44 PolarHBondContact O-N 3.26Å; V41-R44 PolarHBondContact O-N 3.22Å; R44-L47 PolarHBondContact O-N 3.43Å; R44-A48 WeakPolarHBondContact O-CB 3.43Å; R44-A48 PolarHBondContact O-N 2.96Å; R44-V105 WeakPolarHBondContact CB-O 3.39Å
45	V	89.1	Confident	83.6	Confident	84 Å²	84	67.7 Å²	67.7	51%	0.509	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-42.2	179.5	173.9	0	0	0	0	111.1	V41 T42 A48 A49	V41-V45 HydrophobicContact CG1-CG2 4.26Å; V41-V45 WeakPolarHBondContact O-CG2 3.35Å; V41-V45 PolarHBondContact O-N 2.93Å; T42-V45 PolarHBondContact O-N 3.2Å; V45-A48 PolarHBondContact O-N 2.83Å; V45-A49 WeakPolarHBondContact O-CB 3.15Å; V45-A49 PolarHBondContact O-N 3.34Å
46	T	91.4	Very high	85.9	Confident	63 Å²	63	65.8 Å²	65.8	39%	0.387	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-41.3	176.4	55.9	0	0	0	0	111.7	T42 L43 A49 I50	T42-T46 HydrophobicContact CG2-CG2 4.49Å; T42-T46 WeakPolarHBondContact O-CB 3.38Å; T42-T46 VanDerWaalsContact O-CG2 3.22Å; T42-T46 WeakPolarHBondContact O-CG2 3.31Å; T42-T46 PolarHBondContact O-N 3.49Å; T42-T46 PolarHBondContact O-OG1 3.44Å; T42-T46 VanDerWaalsContact O-OG1 3.06Å; L43-T46 WeakPolarHBondContact CA-OG1 3.24Å; L43-T46 PolarHBondContact O-OG1 2.9Å; T46-A49 PolarHBondContact O-N 2.89Å; T46-I50 VanDerWaalsContact O-CG1 3.28Å; T46-I50 WeakPolarHBondContact O-CG1 3.41Å; T46-I50 PolarHBondContact O-N 2.92Å
47	L	91.8	Very high	87.8	Confident	41 Å²	41	64.4 Å²	64.4	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-46.2	175.3	-72.9	173.8	0	0	0	111.4	L43 R44 A49 I50 M51 V105 W328	L43-L47 HydrophobicContact CD1-CD1 4.04Å; L43-L47 HydrophobicContact CD1-CG 4.01Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 HydrophobicContact CG-CG 4.42Å; L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.37Å; L43-L47 PolarHBondContact O-N 2.88Å; R44-L47 PolarHBondContact O-N 3.43Å; L47-A49 VanDerWaalsContact C-N 3.33Å; L47-A49 PolarHBondContact O-N 3.18Å; L47-I50 PolarHBondContact O-N 3.44Å; L47-M51 WeakPolarHBondContact O-CG 3.4Å; L47-M51 PolarHBondContact O-N 3.31Å; L47-V105 HydrophobicContact CB-CG1 3.8Å; L47-W328 HydrophobicContact CB-CH2 3.86Å; L47-W328 HydrophobicContact CB-CZ2 3.64Å; L47-W328 HydrophobicContact CD2-CH2 3.47Å; L47-W328 VanDerWaalsContact CD2-CH2 3.47Å; L47-W328 HydrophobicContact CD2-CZ2 3.77Å; L47-W328 HydrophobicContact CD2-CZ3 4.01Å; L47-W328 HydrophobicContact CG-CH2 4.27Å; L47-W328 HydrophobicContact CG-CZ2 4.26Å; L47-W328 WeakPolarHBondContact O-CH2 3.36Å; L47-W328 WeakPolarHBondContact O-CZ2 2.99Å
48	A	92	Very high	89.7	Confident	8 Å²	8	62.4 Å²	62.4	7%	0.066	35%	0.349	C	S	.	.	H	α-helix	trans	-60.9	-41.6	175.7	0	0	0	0	0	112.2	R44 V45 I50 M51 I52 A106	R44-A48 WeakPolarHBondContact O-CB 3.43Å; R44-A48 PolarHBondContact O-N 2.96Å; V45-A48 PolarHBondContact O-N 2.83Å; A48-I50 PolarHBondContact O-N 3.36Å; A48-M51 WeakPolarHBondContact O-CB 3.3Å; A48-M51 PolarHBondContact O-N 3.09Å; A48-I52 WeakPolarHBondContact O-CG1 3.45Å; A48-I52 PolarHBondContact O-N 3.29Å; A48-A106 HydrophobicContact CB-CB 3.85Å
49	A	93.4	Very high	91.4	Very high	54 Å²	54	58.5 Å²	58.5	45%	0.446	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-42	176	0	0	0	0	0	112.3	V45 T46 L47 M51 I52 F53	V45-A49 WeakPolarHBondContact O-CB 3.15Å; V45-A49 PolarHBondContact O-N 3.34Å; T46-A49 PolarHBondContact O-N 2.89Å; L47-A49 VanDerWaalsContact C-N 3.33Å; L47-A49 PolarHBondContact O-N 3.18Å; A49-M51 VanDerWaalsContact C-N 3.33Å; A49-M51 PolarHBondContact O-N 3.31Å; A49-I52 PolarHBondContact O-N 3.5Å; A49-F53 PolarHBondContact O-N 2.91Å
50	I	94.4	Very high	92.3	Very high	81 Å²	81	61.8 Å²	61.8	42%	0.415	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-38.7	174.7	-65.8	161.2	0	0	0	110.6	T46 L47 A48 F53 M54 W328	T46-I50 VanDerWaalsContact O-CG1 3.28Å; T46-I50 WeakPolarHBondContact O-CG1 3.41Å; T46-I50 PolarHBondContact O-N 2.92Å; L47-I50 PolarHBondContact O-N 3.44Å; A48-I50 PolarHBondContact O-N 3.36Å; I50-F53 WeakPolarHBondContact O-CB 3.38Å; I50-F53 PolarHBondContact O-N 3.34Å; I50-M54 HydrophobicContact CG2-CE 4.41Å; I50-M54 HydrophobicContact CG2-CG 4.42Å; I50-M54 WeakPolarHBondContact O-CG 3.4Å; I50-M54 PolarHBondContact O-N 3.48Å; I50-W328 HydrophobicContact CB-CH2 3.78Å; I50-W328 HydrophobicContact CB-CZ3 4.02Å; I50-W328 HydrophobicContact CG2-CH2 3.81Å; I50-W328 HydrophobicContact CG2-CZ3 3.51Å
51	M	93.6	Very high	92.6	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-62.7	-43.3	174.4	-72.9	-115.8	-72.7	0	0	112.6	L47 A48 A49 F53 M54 I55 T101 A102 V105 W328 Y331	L47-M51 WeakPolarHBondContact O-CG 3.4Å; L47-M51 PolarHBondContact O-N 3.31Å; A48-M51 WeakPolarHBondContact O-CB 3.3Å; A48-M51 PolarHBondContact O-N 3.09Å; A49-M51 VanDerWaalsContact C-N 3.33Å; A49-M51 PolarHBondContact O-N 3.31Å; M51-F53 VanDerWaalsContact C-N 3.26Å; M51-F53 PolarHBondContact O-N 3.43Å; M51-M54 HydrophobicContact CB-CE 4.3Å; M51-M54 HydrophobicContact CG-CE 3.75Å; M51-M54 PolarHBondContact O-N 3.42Å; M51-M54 VanDerWaalsContact O-N 3.16Å; M51-M54 HydrophobicContact SD-CE 3.96Å; M51-I55 WeakPolarHBondContact O-CB 3.45Å; M51-I55 WeakPolarHBondContact O-CD1 3.39Å; M51-I55 WeakPolarHBondContact O-CG1 3.5Å; M51-I55 PolarHBondContact O-N 3.44Å; M51-T101 HydrophobicContact CE-CG2 3.68Å; M51-A102 HydrophobicContact CB-CB 3.94Å; M51-A102 HydrophobicContact CE-CB 3.71Å; M51-V105 HydrophobicContact CE-CG2 4.38Å; M51-W328 HydrophobicContact CB-CZ2 4.38Å; M51-W328 HydrophobicContact CG-CD2 4.23Å; M51-W328 HydrophobicContact CG-CH2 3.7Å; M51-W328 HydrophobicContact CG-CZ2 3.08Å; M51-W328 HydrophobicContact CG-CZ3 4.46Å; M51-W328 HydrophobicContact SD-CD2 4.18Å; M51-W328 VanDerWaalsContact SD-CE2 3.54Å; M51-W328 HydrophobicContact SD-CG 4.42Å; M51-W328 HydrophobicContact SD-CZ2 3.91Å; M51-W328 PolarHBondContact SD-NE1 3.19Å; M51-Y331 HydrophobicContact SD-CD2 4.25Å
52	I	94.6	Very high	93	Very high	100 Å²	100	54.4 Å²	54.4	51%	0.513	30%	0.298	S	S	.	.	H	α-helix	trans	-59.4	-42	174.5	-66.5	165.3	0	0	0	110.1	A48 A49 I55 T56	A48-I52 WeakPolarHBondContact O-CG1 3.45Å; A48-I52 PolarHBondContact O-N 3.29Å; A49-I52 PolarHBondContact O-N 3.5Å; I52-I55 PolarHBondContact O-N 2.95Å; I52-T56 WeakPolarHBondContact O-CG2 3.2Å; I52-T56 PolarHBondContact O-N 3.43Å; I52-T56 PolarHBondContact O-OG1 3.2Å
53	F	94.6	Very high	93.2	Very high	129 Å²	129	50.5 Å²	50.5	57%	0.566	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-43.5	174.4	-177.9	-105.4	0	0	0	112.6	A49 I50 M51 I55 T56 I57	A49-F53 PolarHBondContact O-N 2.91Å; I50-F53 WeakPolarHBondContact O-CB 3.38Å; I50-F53 PolarHBondContact O-N 3.34Å; M51-F53 VanDerWaalsContact C-N 3.26Å; M51-F53 PolarHBondContact O-N 3.43Å; F53-I55 VanDerWaalsContact C-N 3.34Å; F53-I55 PolarHBondContact O-N 3.35Å; F53-T56 PolarHBondContact O-N 3.1Å; F53-T56 PolarHBondContact O-OG1 2.88Å; F53-I57 HydrophobicContact CD1-CD1 3.9Å; F53-I57 HydrophobicContact CD2-CD1 4.42Å; F53-I57 HydrophobicContact CE1-CD1 3.29Å; F53-I57 HydrophobicContact CE1-CG1 4.45Å; F53-I57 HydrophobicContact CE2-CD1 3.88Å; F53-I57 HydrophobicContact CE2-CG1 4.47Å; F53-I57 HydrophobicContact CG-CD1 4.45Å; F53-I57 HydrophobicContact CZ-CD1 3.3Å; F53-I57 HydrophobicContact CZ-CG1 4.33Å; F53-I57 PolarHBondContact O-N 3.29Å; F53-I57 VanDerWaalsContact O-N 3.08Å
54	M	94.8	Very high	93.3	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.064	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-41.5	174.1	-70	-169.6	-64.8	0	0	112	I50 M51 I57 G58 W328 L332 V335	I50-M54 HydrophobicContact CG2-CE 4.41Å; I50-M54 HydrophobicContact CG2-CG 4.42Å; I50-M54 WeakPolarHBondContact O-CG 3.4Å; I50-M54 PolarHBondContact O-N 3.48Å; M51-M54 HydrophobicContact CB-CE 4.3Å; M51-M54 HydrophobicContact CG-CE 3.75Å; M51-M54 PolarHBondContact O-N 3.42Å; M51-M54 VanDerWaalsContact O-N 3.16Å; M51-M54 HydrophobicContact SD-CE 3.96Å; M54-I57 PolarHBondContact O-N 3.09Å; M54-G58 WeakPolarHBondContact O-CA 3.49Å; M54-G58 PolarHBondContact O-N 3.23Å; M54-W328 HydrophobicContact CE-CD2 3.98Å; M54-W328 HydrophobicContact CE-CE3 3.62Å; M54-W328 HydrophobicContact CE-CH2 4.28Å; M54-W328 HydrophobicContact CE-CZ3 3.79Å; M54-L332 HydrophobicContact SD-CD1 4.04Å; M54-V335 HydrophobicContact CB-CG2 3.87Å; M54-V335 HydrophobicContact CG-CG2 4.1Å
55	I	96.4	Very high	93.4	Very high	24 Å²	24	47.4 Å²	47.4	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-46.5	176.9	-70.6	160.6	0	0	0	110.3	M51 I52 F53 G58 F59 S94 M98 P99	M51-I55 WeakPolarHBondContact O-CB 3.45Å; M51-I55 WeakPolarHBondContact O-CD1 3.39Å; M51-I55 WeakPolarHBondContact O-CG1 3.5Å; M51-I55 PolarHBondContact O-N 3.44Å; I52-I55 PolarHBondContact O-N 2.95Å; F53-I55 VanDerWaalsContact C-N 3.34Å; F53-I55 PolarHBondContact O-N 3.35Å; I55-G58 PolarHBondContact O-N 3.48Å; I55-F59 WeakPolarHBondContact O-CB 3.49Å; I55-F59 PolarHBondContact O-N 2.9Å; I55-S94 WeakPolarHBondContact CG2-O 3.45Å; I55-M98 HydrophobicContact CD1-CB 3.73Å; I55-M98 HydrophobicContact CG1-CB 3.51Å; I55-M98 HydrophobicContact CG1-CG 4.36Å; I55-M98 HydrophobicContact CG1-SD 3.94Å; I55-P99 HydrophobicContact CD1-CB 4.44Å; I55-P99 HydrophobicContact CD1-CG 4.09Å
56	T	94.8	Very high	93.5	Very high	64 Å²	64	44.1 Å²	44.1	39%	0.393	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-47.9	179.9	57.7	0	0	0	0	111.3	I52 F53 F59 L60	I52-T56 WeakPolarHBondContact O-CG2 3.2Å; I52-T56 PolarHBondContact O-N 3.43Å; I52-T56 PolarHBondContact O-OG1 3.2Å; F53-T56 PolarHBondContact O-N 3.1Å; F53-T56 PolarHBondContact O-OG1 2.88Å; T56-F59 PolarHBondContact O-N 3.4Å; T56-L60 WeakPolarHBondContact O-CB 3.26Å; T56-L60 WeakPolarHBondContact O-CD1 3.36Å; T56-L60 PolarHBondContact O-N 3.5Å
57	I	93.3	Very high	93.5	Very high	57 Å²	57	44.9 Å²	44.9	29%	0.292	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-44.7	178.3	-63.2	175.7	0	0	0	111.4	F53 M54 F59 G61 V335	F53-I57 HydrophobicContact CD1-CD1 3.9Å; F53-I57 HydrophobicContact CD2-CD1 4.42Å; F53-I57 HydrophobicContact CE1-CD1 3.29Å; F53-I57 HydrophobicContact CE1-CG1 4.45Å; F53-I57 HydrophobicContact CE2-CD1 3.88Å; F53-I57 HydrophobicContact CE2-CG1 4.47Å; F53-I57 HydrophobicContact CG-CD1 4.45Å; F53-I57 HydrophobicContact CZ-CD1 3.3Å; F53-I57 HydrophobicContact CZ-CG1 4.33Å; F53-I57 PolarHBondContact O-N 3.29Å; F53-I57 VanDerWaalsContact O-N 3.08Å; M54-I57 PolarHBondContact O-N 3.09Å; I57-F59 PolarHBondContact O-N 2.93Å; I57-G61 WeakPolarHBondContact O-CA 3.45Å; I57-G61 PolarHBondContact O-N 2.87Å; I57-V335 HydrophobicContact CB-CG1 4.35Å; I57-V335 HydrophobicContact CG2-CG1 3.81Å
58	G	94.4	Very high	93.4	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-46.8	178	0	0	0	0	0	111.4	M54 I55 N62	M54-G58 WeakPolarHBondContact O-CA 3.49Å; M54-G58 PolarHBondContact O-N 3.23Å; I55-G58 PolarHBondContact O-N 3.48Å; G58-N62 VanDerWaalsContact O-CB 3.27Å; G58-N62 WeakPolarHBondContact O-CB 3.42Å; G58-N62 PolarHBondContact O-N 3.44Å; G58-N62 VanDerWaalsContact O-N 3.16Å; G58-N62 PolarHBondContact O-ND2 3.12Å
59	F	95.6	Very high	93.3	Very high	80 Å²	80	42.6 Å²	42.6	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-58	176.8	176.2	-105.7	0	0	0	112.1	I55 T56 I57 G61 N62 A63 I91 L95	I55-F59 WeakPolarHBondContact O-CB 3.49Å; I55-F59 PolarHBondContact O-N 2.9Å; T56-F59 PolarHBondContact O-N 3.4Å; I57-F59 PolarHBondContact O-N 2.93Å; F59-G61 PolarHBondContact O-N 2.88Å; F59-N62 PolarHBondContact O-N 3Å; F59-A63 WeakPolarHBondContact O-CB 3.4Å; F59-A63 PolarHBondContact O-N 3.31Å; F59-I91 HydrophobicContact CD2-CG2 3.97Å; F59-I91 HydrophobicContact CE2-CG2 4.07Å; F59-L95 HydrophobicContact CD2-CD1 4.07Å; F59-L95 HydrophobicContact CD2-CD2 3.95Å; F59-L95 HydrophobicContact CD2-CG 4.08Å; F59-L95 HydrophobicContact CE2-CD1 3.93Å; F59-L95 HydrophobicContact CE2-CD2 4.3Å; F59-L95 HydrophobicContact CE2-CG 4.42Å
60	L	93.1	Very high	93	Very high	100 Å²	100	45.9 Å²	45.9	52%	0.524	23%	0.233	S	C	.	.	H	α-helix	trans	-62	-44.6	-175.5	-82.6	89	0	0	0	111.5	T56 A63 I64	T56-L60 WeakPolarHBondContact O-CB 3.26Å; T56-L60 WeakPolarHBondContact O-CD1 3.36Å; T56-L60 PolarHBondContact O-N 3.5Å; L60-A63 PolarHBondContact O-N 3.42Å; L60-I64 VanDerWaalsContact O-CG1 3.29Å; L60-I64 WeakPolarHBondContact O-CG1 3.4Å; L60-I64 PolarHBondContact O-N 2.93Å
61	G	91.9	Very high	92.7	Very high	16 Å²	16	47 Å²	47	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-48.7	-178.7	0	0	0	0	0	112.2	I57 F59 I64 V65 P338	I57-G61 WeakPolarHBondContact O-CA 3.45Å; I57-G61 PolarHBondContact O-N 2.87Å; F59-G61 PolarHBondContact O-N 2.88Å; G61-I64 PolarHBondContact O-N 3.42Å; G61-V65 WeakPolarHBondContact O-CG2 3.27Å; G61-V65 PolarHBondContact O-N 3.41Å; G61-P338 VanDerWaalsContact C-CG 3.44Å
62	N	95.1	Very high	92.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.7	-31.4	179.1	-71.7	-63.8	0	0	0	112.2	G58 F59 I64 V65 C66 A87 I91 T334 P338	G58-N62 VanDerWaalsContact O-CB 3.27Å; G58-N62 WeakPolarHBondContact O-CB 3.42Å; G58-N62 PolarHBondContact O-N 3.44Å; G58-N62 VanDerWaalsContact O-N 3.16Å; G58-N62 PolarHBondContact O-ND2 3.12Å; F59-N62 PolarHBondContact O-N 3Å; N62-I64 PolarHBondContact O-N 3.29Å; N62-V65 WeakPolarHBondContact O-CB 3.36Å; N62-V65 PolarHBondContact O-N 3.12Å; N62-V65 VanDerWaalsContact O-N 3.13Å; N62-C66 PolarHBondContact O-N 2.92Å; N62-A87 HydrophobicContact CB-CB 3.88Å; N62-A87 WeakPolarHBondContact CB-O 3.5Å; N62-A87 WeakPolarHBondContact OD1-CA 3.37Å; N62-I91 HydrophobicContact CB-CD1 4.16Å; N62-I91 HydrophobicContact CB-CG1 3.65Å; N62-T334 PolarHBondContact ND2-O 2.9Å; N62-P338 HydrophobicContact CB-CG 4.34Å; N62-P338 VanDerWaalsContact CG-CG 3.47Å; N62-P338 WeakPolarHBondContact OD1-CD 3.41Å; N62-P338 VanDerWaalsContact OD1-CG 3.29Å; N62-P338 WeakPolarHBondContact OD1-CG 3.48Å
63	A	93.9	Very high	91.6	Very high	22 Å²	22	50 Å²	50	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-43.7	173.5	0	0	0	0	0	111.7	F59 L60 V65 C66 L67 I91	F59-A63 WeakPolarHBondContact O-CB 3.4Å; F59-A63 PolarHBondContact O-N 3.31Å; L60-A63 PolarHBondContact O-N 3.42Å; A63-V65 VanDerWaalsContact C-N 3.25Å; A63-V65 PolarHBondContact O-N 3.05Å; A63-C66 PolarHBondContact O-N 3.39Å; A63-L67 WeakPolarHBondContact O-CB 3.31Å; A63-L67 VanDerWaalsContact O-CG 3.27Å; A63-L67 WeakPolarHBondContact O-CG 3.32Å; A63-L67 PolarHBondContact O-N 2.93Å; A63-I91 HydrophobicContact CB-CD1 4.29Å
64	I	91.2	Very high	90.8	Very high	58 Å²	58	48.5 Å²	48.5	30%	0.297	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-40	173.7	-69.3	165.2	0	0	0	110.8	L60 G61 N62 L67 I68	L60-I64 VanDerWaalsContact O-CG1 3.29Å; L60-I64 WeakPolarHBondContact O-CG1 3.4Å; L60-I64 PolarHBondContact O-N 2.93Å; G61-I64 PolarHBondContact O-N 3.42Å; N62-I64 PolarHBondContact O-N 3.29Å; I64-L67 PolarHBondContact O-N 2.76Å; I64-I68 HydrophobicContact CG2-CD1 3.63Å; I64-I68 HydrophobicContact CG2-CG1 4.3Å; I64-I68 VanDerWaalsContact O-CG1 3.29Å; I64-I68 WeakPolarHBondContact O-CG1 3.27Å; I64-I68 PolarHBondContact O-N 3.1Å
65	V	91.2	Very high	90.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-49.4	176.6	174.9	0	0	0	0	111.7	G61 N62 A63 V69 A87 P338 Y341 F348	G61-V65 WeakPolarHBondContact O-CG2 3.27Å; G61-V65 PolarHBondContact O-N 3.41Å; N62-V65 WeakPolarHBondContact O-CB 3.36Å; N62-V65 PolarHBondContact O-N 3.12Å; N62-V65 VanDerWaalsContact O-N 3.13Å; A63-V65 VanDerWaalsContact C-N 3.25Å; A63-V65 PolarHBondContact O-N 3.05Å; V65-V69 WeakPolarHBondContact O-CG2 3.5Å; V65-V69 PolarHBondContact O-N 2.98Å; V65-A87 HydrophobicContact CB-CB 3.89Å; V65-A87 HydrophobicContact CG1-CB 3.66Å; V65-P338 HydrophobicContact CG2-CB 4.42Å; V65-Y341 HydrophobicContact CG1-CD2 4.15Å; V65-Y341 HydrophobicContact CG1-CE2 4.39Å; V65-Y341 HydrophobicContact CG2-CD2 3.83Å; V65-Y341 HydrophobicContact CG2-CE2 4.5Å; V65-F348 HydrophobicContact CB-CE1 3.98Å; V65-F348 HydrophobicContact CB-CZ 4.05Å; V65-F348 HydrophobicContact CG1-CE1 4.01Å; V65-F348 HydrophobicContact CG1-CZ 3.62Å; V65-F348 HydrophobicContact CG2-CE1 3.74Å; V65-F348 HydrophobicContact CG2-CZ 4.24Å
66	C	93.1	Very high	89.6	Confident	15 Å²	15	53.6 Å²	53.6	10%	0.101	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-47.7	174.8	-65.4	0	0	0	0	111.4	N62 A63 I68 V69 Y70	N62-C66 PolarHBondContact O-N 2.92Å; A63-C66 PolarHBondContact O-N 3.39Å; C66-I68 PolarHBondContact O-N 3.45Å; C66-V69 PolarHBondContact O-N 3.23Å; C66-Y70 HydrophobicContact CB-CD2 4.11Å; C66-Y70 HydrophobicContact CB-CE2 4.03Å; C66-Y70 WeakPolarHBondContact O-CD2 3.39Å; C66-Y70 PolarHBondContact O-N 3.43Å
67	L	90.9	Very high	89.3	Confident	79 Å²	79	52.7 Å²	52.7	41%	0.414	28%	0.281	S	S	.	.	H	α-helix	trans	-57.8	-47	-178.9	-73.2	172.5	0	0	0	112.4	A63 I64 V69 Y70 Q71	A63-L67 WeakPolarHBondContact O-CB 3.31Å; A63-L67 VanDerWaalsContact O-CG 3.27Å; A63-L67 WeakPolarHBondContact O-CG 3.32Å; A63-L67 PolarHBondContact O-N 2.93Å; I64-L67 PolarHBondContact O-N 2.76Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3.01Å; L67-Y70 PolarHBondContact O-N 3.48Å; L67-Q71 VanDerWaalsContact O-CB 3.25Å; L67-Q71 WeakPolarHBondContact O-CB 3.33Å; L67-Q71 VanDerWaalsContact O-CG 3.31Å; L67-Q71 WeakPolarHBondContact O-CG 3.36Å; L67-Q71 PolarHBondContact O-N 3Å
68	I	88.4	Confident	89.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.8	-43.4	179.6	-72.9	167	0	0	0	111.3	I64 C66 K72 M75 F348 A351 C352 F355	I64-I68 HydrophobicContact CG2-CD1 3.63Å; I64-I68 HydrophobicContact CG2-CG1 4.3Å; I64-I68 VanDerWaalsContact O-CG1 3.29Å; I64-I68 WeakPolarHBondContact O-CG1 3.27Å; I64-I68 PolarHBondContact O-N 3.1Å; C66-I68 PolarHBondContact O-N 3.45Å; I68-K72 PolarHBondContact O-N 3.45Å; I68-M75 HydrophobicContact CG2-CE 4Å; I68-M75 HydrophobicContact CG2-CG 4.47Å; I68-F348 HydrophobicContact CB-CE1 4.06Å; I68-F348 HydrophobicContact CB-CZ 4Å; I68-F348 HydrophobicContact CD1-CD1 3.81Å; I68-F348 HydrophobicContact CD1-CE1 3.59Å; I68-F348 HydrophobicContact CD1-CZ 4.39Å; I68-F348 HydrophobicContact CG1-CE1 4.41Å; I68-F348 HydrophobicContact CG2-CE1 4.1Å; I68-F348 HydrophobicContact CG2-CE2 4.15Å; I68-F348 HydrophobicContact CG2-CZ 3.89Å; I68-A351 HydrophobicContact CD1-CB 3.79Å; I68-A351 HydrophobicContact CG1-CB 3.94Å; I68-A351 HydrophobicContact CG2-CB 3.78Å; I68-C352 WeakPolarHBondContact CD1-SG 3.18Å; I68-F355 HydrophobicContact CG1-CD2 4.15Å; I68-F355 HydrophobicContact CG1-CE2 3.82Å
69	V	89.8	Confident	89	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-72.6	-41.9	-177.5	177	0	0	0	0	111.5	V65 C66 L67 R76 N80 L81 A84 F348	V65-V69 WeakPolarHBondContact O-CG2 3.5Å; V65-V69 PolarHBondContact O-N 2.98Å; C66-V69 PolarHBondContact O-N 3.23Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3.01Å; V69-R76 WeakPolarHBondContact O-CG 3.39Å; V69-N80 HydrophobicContact CG1-CB 4.31Å; V69-N80 HydrophobicContact CG2-CB 4.09Å; V69-L81 HydrophobicContact CG1-CD2 4.34Å; V69-A84 HydrophobicContact CB-CB 4.04Å; V69-A84 HydrophobicContact CG1-CB 3.96Å; V69-A84 HydrophobicContact CG2-CB 4.19Å; V69-F348 HydrophobicContact CG2-CE2 3.94Å; V69-F348 HydrophobicContact CG2-CZ 3.96Å
70	Y	88.2	Confident	88.8	Confident	124 Å²	124	48.9 Å²	48.9	49%	0.486	27%	0.265	S	S	.	.	H	α-helix	trans	-76.4	-36.9	-177.8	-69.2	-58.9	0	0	0	113.1	C66 L67 R76	C66-Y70 HydrophobicContact CB-CD2 4.11Å; C66-Y70 HydrophobicContact CB-CE2 4.03Å; C66-Y70 WeakPolarHBondContact O-CD2 3.39Å; C66-Y70 PolarHBondContact O-N 3.43Å; L67-Y70 PolarHBondContact O-N 3.48Å; Y70-R76 PolarHBondContact O-NE 3.23Å; Y70-R76 PolarHBondContact O-NH2 3.47Å
71	Q	87.6	Confident	88.8	Confident	105 Å²	105	45.1 Å²	45.1	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-78.3	-33.2	-176.5	-70	-175.4	-7.7	0	0	113.9	L67 P73 F355	L67-Q71 VanDerWaalsContact O-CB 3.25Å; L67-Q71 WeakPolarHBondContact O-CB 3.33Å; L67-Q71 VanDerWaalsContact O-CG 3.31Å; L67-Q71 WeakPolarHBondContact O-CG 3.36Å; L67-Q71 PolarHBondContact O-N 3Å; Q71-P73 WeakPolarHBondContact O-CD 3.23Å; Q71-F355 VanDerWaalsContact OE1-CZ 3.29Å
72	K	83	Confident	89	Confident	72 Å²	72	44.4 Å²	44.4	31%	0.313	24%	0.238	S	C	.	.			trans	-103.5	106.2	-174.8	-56.7	-73.2	-172	172.1	0	109.8	I68 A74 M75 E354	I68-K72 PolarHBondContact O-N 3.45Å; K72-A74 PolarHBondContact O-N 3Å; K72-A74 VanDerWaalsContact O-N 3.13Å; K72-M75 HydrophobicContact CB-CB 4.2Å; K72-M75 HydrophobicContact CB-CG 3.95Å; K72-M75 WeakPolarHBondContact O-CB 3.48Å; K72-M75 PolarHBondContact O-N 3.46Å; K72-E354 IonicContact NZ-OE1 3.53Å; K72-E354 PolarHBondContact NZ-OE1 2.91Å; K72-E354 IonicContact NZ-OE2 2.87Å; K72-E354 PolarHBondContact NZ-OE2 3.4Å
73	P	83.3	Confident	88.9	Confident	92 Å²	92	44.8 Å²	44.8	60%	0.597	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-56	-34.5	179.8	-26.3	35.3	0	0	0	113.4	Q71 M75 R76	Q71-P73 WeakPolarHBondContact O-CD 3.23Å; P73-M75 PolarHBondContact O-N 3.44Å; P73-M75 VanDerWaalsContact O-N 3.1Å; P73-R76 WeakPolarHBondContact O-CB 3.27Å; P73-R76 PolarHBondContact O-N 3.32Å
74	A	77.5	Confident	88.9	Confident	97 Å²	97	43.8 Å²	43.8	80%	0.802	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-62	-15.2	175.8	0	0	0	0	0	114.3	K72	K72-A74 PolarHBondContact O-N 3Å; K72-A74 VanDerWaalsContact O-N 3.13Å
75	M	79.7	Confident	89.1	Confident	17 Å²	17	41.6 Å²	41.6	8%	0.084	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-100	0.1	177.4	-65.7	-67.3	-78.2	0	0	112.9	I68 K72 P73 S77 N80 K347 F348	I68-M75 HydrophobicContact CG2-CE 4Å; I68-M75 HydrophobicContact CG2-CG 4.47Å; K72-M75 HydrophobicContact CB-CB 4.2Å; K72-M75 HydrophobicContact CB-CG 3.95Å; K72-M75 WeakPolarHBondContact O-CB 3.48Å; K72-M75 PolarHBondContact O-N 3.46Å; P73-M75 PolarHBondContact O-N 3.44Å; P73-M75 VanDerWaalsContact O-N 3.1Å; M75-S77 PolarHBondContact O-N 2.98Å; M75-N80 WeakPolarHBondContact O-CB 3.45Å; M75-N80 PolarHBondContact O-ND2 3.22Å; M75-K347 HydrophobicContact CE-CB 3.98Å; M75-K347 HydrophobicContact SD-CB 4.06Å; M75-K347 HydrophobicContact SD-CD 4.13Å; M75-F348 HydrophobicContact CE-CD2 3.85Å; M75-F348 HydrophobicContact CE-CE2 4.2Å
76	R	85	Confident	89.3	Confident	127 Å²	127	41.6 Å²	41.6	48%	0.479	22%	0.221	S	C	.	.			trans	-82.3	47.3	-179.2	-61.6	179	-175.5	165.4	-1.8	113.3	V69 Y70 P73	V69-R76 WeakPolarHBondContact O-CG 3.39Å; Y70-R76 PolarHBondContact O-NE 3.23Å; Y70-R76 PolarHBondContact O-NH2 3.47Å; P73-R76 WeakPolarHBondContact O-CB 3.27Å; P73-R76 PolarHBondContact O-N 3.32Å
77	S	90.1	Very high	89.4	Confident	45 Å²	45	40.9 Å²	40.9	32%	0.315	22%	0.216	S	C	.	.			trans	-77.3	161.1	171.7	68.3	0	0	0	0	111	M75 I79 N80 L81	M75-S77 PolarHBondContact O-N 2.98Å; S77-I79 VanDerWaalsContact C-N 3.32Å; S77-I79 PolarHBondContact O-N 2.9Å; S77-I79 WeakPolarHBondContact OG-CG2 3.48Å; S77-N80 PolarHBondContact O-N 3.43Å; S77-N80 VanDerWaalsContact O-N 3.12Å; S77-N80 WeakPolarHBondContact OG-CB 3.34Å; S77-N80 PolarHBondContact OG-N 2.98Å; S77-N80 PolarHBondContact OG-ND2 2.72Å; S77-L81 WeakPolarHBondContact O-CG 3.43Å; S77-L81 PolarHBondContact O-N 2.73Å
78	A	91.4	Very high	89.7	Confident	8 Å²	8	41 Å²	41	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-54.9	-45.8	-179.5	0	0	0	0	0	112.8	N80 L81 L82 L153 P155 A158	A78-N80 PolarHBondContact O-N 2.75Å; A78-L81 PolarHBondContact O-N 2.75Å; A78-L82 PolarHBondContact O-N 2.95Å; A78-L153 HydrophobicContact CB-CD2 4.06Å; A78-L153 HydrophobicContact CB-CG 3.86Å; A78-L153 WeakPolarHBondContact CB-O 3.43Å; A78-P155 HydrophobicContact CB-CG 4.46Å; A78-A158 HydrophobicContact CB-CB 3.94Å
79	I	89.7	Confident	90.2	Very high	34 Å²	34	41 Å²	41	17%	0.174	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-38.4	178.2	-168.3	71.2	0	0	0	112.5	S77 L81 L82 L83 I138	S77-I79 VanDerWaalsContact C-N 3.32Å; S77-I79 PolarHBondContact O-N 2.9Å; S77-I79 WeakPolarHBondContact OG-CG2 3.48Å; I79-L81 VanDerWaalsContact C-N 3.31Å; I79-L81 PolarHBondContact O-N 3.14Å; I79-L82 HydrophobicContact CD1-CD1 4.44Å; I79-L82 WeakPolarHBondContact O-CB 3.13Å; I79-L82 PolarHBondContact O-N 3.44Å; I79-L83 WeakPolarHBondContact O-CG 3.39Å; I79-L83 PolarHBondContact O-N 3.23Å; I79-I138 HydrophobicContact CD1-CB 4.47Å; I79-I138 HydrophobicContact CD1-CD1 4.39Å; I79-I138 HydrophobicContact CD1-CG1 3.86Å; I79-I138 HydrophobicContact CD1-CG2 4.09Å
80	N	90.9	Very high	90.5	Very high	14 Å²	14	41.1 Å²	41.1	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-71.7	-30.1	-179	-72.9	-6.5	0	0	0	111.5	V69 M75 S77 A78 L83 A84	V69-N80 HydrophobicContact CG1-CB 4.31Å; V69-N80 HydrophobicContact CG2-CB 4.09Å; M75-N80 WeakPolarHBondContact O-CB 3.45Å; M75-N80 PolarHBondContact O-ND2 3.22Å; S77-N80 PolarHBondContact O-N 3.43Å; S77-N80 VanDerWaalsContact O-N 3.12Å; S77-N80 WeakPolarHBondContact OG-CB 3.34Å; S77-N80 PolarHBondContact OG-N 2.98Å; S77-N80 PolarHBondContact OG-ND2 2.72Å; A78-N80 PolarHBondContact O-N 2.75Å; N80-L83 PolarHBondContact O-N 2.85Å; N80-A84 WeakPolarHBondContact O-CB 3.46Å; N80-A84 PolarHBondContact O-N 3.06Å
81	L	93.9	Very high	90.9	Very high	22 Å²	22	36 Å²	36	12%	0.115	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-45	169.9	-67.4	173.2	0	0	0	111.2	V69 S77 A78 I79 L83 A84 T85 P155 K159 I162	V69-L81 HydrophobicContact CG1-CD2 4.34Å; S77-L81 WeakPolarHBondContact O-CG 3.43Å; S77-L81 PolarHBondContact O-N 2.73Å; A78-L81 PolarHBondContact O-N 2.75Å; I79-L81 VanDerWaalsContact C-N 3.31Å; I79-L81 PolarHBondContact O-N 3.14Å; L81-L83 PolarHBondContact O-N 2.78Å; L81-A84 PolarHBondContact O-N 3.36Å; L81-T85 PolarHBondContact O-N 2.93Å; L81-T85 PolarHBondContact O-OG1 3.38Å; L81-P155 HydrophobicContact CD1-CB 4.19Å; L81-K159 HydrophobicContact CD1-CG 4.29Å; L81-I162 HydrophobicContact CB-CD1 4.34Å
82	L	94.6	Very high	91.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-46.7	174.4	-66.1	174.1	0	0	0	111.4	A78 I79 A84 T85 L86 I134 I137 I138 L153 I162	A78-L82 PolarHBondContact O-N 2.95Å; I79-L82 HydrophobicContact CD1-CD1 4.44Å; I79-L82 WeakPolarHBondContact O-CB 3.13Å; I79-L82 PolarHBondContact O-N 3.44Å; L82-A84 VanDerWaalsContact C-N 3.3Å; L82-A84 PolarHBondContact O-N 3.41Å; L82-T85 PolarHBondContact O-N 3.49Å; L82-L86 PolarHBondContact O-N 3.15Å; L82-I134 HydrophobicContact CB-CG2 3.92Å; L82-I134 HydrophobicContact CD2-CD1 3.91Å; L82-I134 HydrophobicContact CD2-CG2 4.43Å; L82-I134 WeakPolarHBondContact O-CG2 3.3Å; L82-I137 HydrophobicContact CD1-CG2 3.69Å; L82-I137 HydrophobicContact CD2-CG2 4.02Å; L82-I138 HydrophobicContact CB-CD1 4.27Å; L82-I138 HydrophobicContact CB-CG1 4.18Å; L82-I138 HydrophobicContact CD1-CG1 3.95Å; L82-L153 HydrophobicContact CD1-CD2 3.9Å; L82-I162 HydrophobicContact CD2-CD1 4.02Å; L82-I162 HydrophobicContact CD2-CG1 3.8Å
83	L	92.8	Very high	92	Very high	9 Å²	9	29.6 Å²	29.6	5%	0.047	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-37	176.4	-66.2	176.2	0	0	0	112.8	I79 N80 L81 L86 A87 I138 Y341 I345	I79-L83 WeakPolarHBondContact O-CG 3.39Å; I79-L83 PolarHBondContact O-N 3.23Å; N80-L83 PolarHBondContact O-N 2.85Å; L81-L83 PolarHBondContact O-N 2.78Å; L83-L86 PolarHBondContact O-N 3.03Å; L83-A87 WeakPolarHBondContact O-CB 3.45Å; L83-A87 PolarHBondContact O-N 3.26Å; L83-I138 HydrophobicContact CD2-CD1 4.03Å; L83-Y341 HydrophobicContact CD2-CD1 4.1Å; L83-Y341 HydrophobicContact CD2-CE1 3.57Å; L83-Y341 HydrophobicContact CD2-CE2 4.47Å; L83-I345 HydrophobicContact CD1-CD1 3.48Å; L83-I345 VanDerWaalsContact CD1-CD1 3.48Å
84	A	94.3	Very high	92.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.7	-37.4	175.4	0	0	0	0	0	112.2	V69 N80 L81 L82 A87 F88	V69-A84 HydrophobicContact CB-CB 4.04Å; V69-A84 HydrophobicContact CG1-CB 3.96Å; V69-A84 HydrophobicContact CG2-CB 4.19Å; N80-A84 WeakPolarHBondContact O-CB 3.46Å; N80-A84 PolarHBondContact O-N 3.06Å; L81-A84 PolarHBondContact O-N 3.36Å; L82-A84 VanDerWaalsContact C-N 3.3Å; L82-A84 PolarHBondContact O-N 3.41Å; A84-A87 PolarHBondContact O-N 2.97Å; A84-F88 WeakPolarHBondContact O-CB 3.34Å; A84-F88 PolarHBondContact O-N 3.22Å
85	T	96.8	Very high	93.5	Very high	12 Å²	12	24.2 Å²	24.2	7%	0.074	12%	0.119	C	C	.	.	H	α-helix	trans	-67.2	-39.9	174.5	-58.7	0	0	0	0	112.2	L81 L82 F88 S89 E130 I134 I162	L81-T85 PolarHBondContact O-N 2.93Å; L81-T85 PolarHBondContact O-OG1 3.38Å; L82-T85 PolarHBondContact O-N 3.49Å; T85-F88 PolarHBondContact O-N 3.15Å; T85-S89 PolarHBondContact O-N 3.17Å; T85-S89 PolarHBondContact O-OG 3.26Å; T85-E130 HydrophobicContact CG2-CG 4.25Å; T85-E130 WeakPolarHBondContact CG2-OE1 3.4Å; T85-I134 HydrophobicContact CG2-CD1 3.93Å; T85-I134 HydrophobicContact CG2-CG1 3.98Å; T85-I162 HydrophobicContact CG2-CG2 3.94Å; T85-I162 WeakPolarHBondContact OG1-CD1 3.48Å
86	L	94.9	Very high	94.3	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-47.1	173.1	-176.8	54.5	0	0	0	110.9	L82 L83 F88 S89 D90 G131 I134 L135 Y341	L82-L86 PolarHBondContact O-N 3.15Å; L83-L86 PolarHBondContact O-N 3.03Å; L86-F88 VanDerWaalsContact C-N 3.34Å; L86-F88 PolarHBondContact O-N 2.96Å; L86-S89 PolarHBondContact O-N 3.01Å; L86-D90 PolarHBondContact O-N 2.69Å; L86-G131 VanDerWaalsContact CD1-CA 3.5Å; L86-I134 HydrophobicContact CB-CB 4.48Å; L86-I134 HydrophobicContact CB-CG2 4Å; L86-L135 HydrophobicContact CD2-CD2 3.79Å; L86-L135 HydrophobicContact CD2-CG 4.18Å; L86-Y341 WeakPolarHBondContact CD2-OH 3.02Å
87	A	95.7	Very high	94.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175.2	0	0	0	0	0	112.7	N62 V65 L83 A84 D90 I91	N62-A87 HydrophobicContact CB-CB 3.88Å; N62-A87 WeakPolarHBondContact CB-O 3.5Å; N62-A87 WeakPolarHBondContact OD1-CA 3.37Å; V65-A87 HydrophobicContact CB-CB 3.89Å; V65-A87 HydrophobicContact CG1-CB 3.66Å; L83-A87 WeakPolarHBondContact O-CB 3.45Å; L83-A87 PolarHBondContact O-N 3.26Å; A84-A87 PolarHBondContact O-N 2.97Å; A87-D90 PolarHBondContact O-N 3.18Å; A87-I91 VanDerWaalsContact O-CG1 3.31Å; A87-I91 WeakPolarHBondContact O-CG1 3.34Å; A87-I91 PolarHBondContact O-N 3.37Å
88	F	97.1	Very high	95	Very high	82 Å²	82	18.6 Å²	18.6	36%	0.36	10%	0.095	S	C	.	.	H	α-helix	trans	-61.9	-43.5	175.6	177.5	-96.5	0	0	0	112	A84 T85 L86 D90 I91 M92 W166	A84-F88 WeakPolarHBondContact O-CB 3.34Å; A84-F88 PolarHBondContact O-N 3.22Å; T85-F88 PolarHBondContact O-N 3.15Å; L86-F88 VanDerWaalsContact C-N 3.34Å; L86-F88 PolarHBondContact O-N 2.96Å; F88-D90 VanDerWaalsContact C-N 3.33Å; F88-D90 PolarHBondContact O-N 2.93Å; F88-I91 WeakPolarHBondContact O-CB 3.29Å; F88-I91 PolarHBondContact O-N 3.25Å; F88-M92 HydrophobicContact CD1-CG 4.39Å; F88-M92 HydrophobicContact CD2-CE 4.18Å; F88-M92 HydrophobicContact CE1-CG 4.01Å; F88-M92 HydrophobicContact CE2-CE 3.5Å; F88-M92 VanDerWaalsContact CE2-CE 3.5Å; F88-M92 HydrophobicContact CZ-CE 3.71Å; F88-M92 HydrophobicContact CZ-CG 4.08Å; F88-M92 HydrophobicContact CZ-SD 4.4Å; F88-M92 WeakPolarHBondContact O-CG 3.47Å; F88-M92 PolarHBondContact O-N 2.76Å; F88-W166 HydrophobicContact CD1-CH2 4.04Å; F88-W166 AromaticContact CD1-CZ2 3.75Å; F88-W166 HydrophobicContact CD1-CZ2 3.75Å; F88-W166 AromaticContact CE1-CH2 3.8Å; F88-W166 HydrophobicContact CE1-CH2 3.8Å; F88-W166 AromaticContact CE1-CZ2 3.83Å; F88-W166 HydrophobicContact CE1-CZ2 3.83Å
89	S	97.2	Very high	95.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-40	176.5	-55.4	0	0	0	0	111.6	T85 L86 M92 L93 E130	T85-S89 PolarHBondContact O-N 3.17Å; T85-S89 PolarHBondContact O-OG 3.26Å; L86-S89 PolarHBondContact O-N 3.01Å; S89-M92 PolarHBondContact O-N 3.48Å; S89-L93 WeakPolarHBondContact O-CG 3.02Å; S89-L93 PolarHBondContact O-N 3.41Å; S89-E130 VanDerWaalsContact OG-CG 3.27Å; S89-E130 WeakPolarHBondContact OG-CG 3.38Å
90	D	96.7	Very high	95.3	Very high	2 Å²	2	21 Å²	21	1%	0.011	11%	0.107	C	C	.	.	H	α-helix	trans	-67.3	-36	175.9	-71.9	-23.5	0	0	0	113	L86 A87 F88 M92 L93 S94 T334 N337	L86-D90 PolarHBondContact O-N 2.69Å; A87-D90 PolarHBondContact O-N 3.18Å; F88-D90 VanDerWaalsContact C-N 3.33Å; F88-D90 PolarHBondContact O-N 2.93Å; D90-M92 VanDerWaalsContact C-N 3.34Å; D90-L93 PolarHBondContact O-N 3.13Å; D90-S94 WeakPolarHBondContact O-CB 3.47Å; D90-S94 PolarHBondContact O-N 2.95Å; D90-S94 PolarHBondContact O-OG 3.04Å; D90-T334 HydrophobicContact CB-CG2 3.92Å; D90-N337 PolarHBondContact OD2-ND2 3.05Å
91	I	97.5	Very high	95.3	Very high	16 Å²	16	21.4 Å²	21.4	8%	0.082	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-48.3	170.6	-72.2	166.2	0	0	0	109.5	F59 N62 A63 A87 F88 L93 S94 L95	F59-I91 HydrophobicContact CD2-CG2 3.97Å; F59-I91 HydrophobicContact CE2-CG2 4.07Å; N62-I91 HydrophobicContact CB-CD1 4.16Å; N62-I91 HydrophobicContact CB-CG1 3.65Å; A63-I91 HydrophobicContact CB-CD1 4.29Å; A87-I91 VanDerWaalsContact O-CG1 3.31Å; A87-I91 WeakPolarHBondContact O-CG1 3.34Å; A87-I91 PolarHBondContact O-N 3.37Å; F88-I91 WeakPolarHBondContact O-CB 3.29Å; F88-I91 PolarHBondContact O-N 3.25Å; I91-L93 VanDerWaalsContact C-N 3.35Å; I91-L93 PolarHBondContact O-N 2.92Å; I91-S94 WeakPolarHBondContact O-CB 3.23Å; I91-S94 PolarHBondContact O-N 3.13Å; I91-S94 VanDerWaalsContact O-N 3.12Å; I91-L95 HydrophobicContact CG2-CD1 3.82Å; I91-L95 HydrophobicContact CG2-CG 4.38Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 2.77Å
92	M	97.4	Very high	95.3	Very high	41 Å²	41	20.7 Å²	20.7	20%	0.202	11%	0.107	C	C	.	.	H	α-helix	trans	-64.4	-38.5	-179.3	-66.5	-59.4	139.2	0	0	112.1	F88 S89 D90 S94 L95 L96 F127	F88-M92 HydrophobicContact CD1-CG 4.39Å; F88-M92 HydrophobicContact CD2-CE 4.18Å; F88-M92 HydrophobicContact CE1-CG 4.01Å; F88-M92 HydrophobicContact CE2-CE 3.5Å; F88-M92 VanDerWaalsContact CE2-CE 3.5Å; F88-M92 HydrophobicContact CZ-CE 3.71Å; F88-M92 HydrophobicContact CZ-CG 4.08Å; F88-M92 HydrophobicContact CZ-SD 4.4Å; F88-M92 WeakPolarHBondContact O-CG 3.47Å; F88-M92 PolarHBondContact O-N 2.76Å; S89-M92 PolarHBondContact O-N 3.48Å; D90-M92 VanDerWaalsContact C-N 3.34Å; M92-S94 VanDerWaalsContact C-N 3.34Å; M92-S94 PolarHBondContact O-N 2.88Å; M92-L95 PolarHBondContact O-N 3.1Å; M92-L96 HydrophobicContact CB-CD1 4.41Å; M92-L96 VanDerWaalsContact O-CB 3.23Å; M92-L96 WeakPolarHBondContact O-CB 3.47Å; M92-L96 WeakPolarHBondContact O-CG 3.46Å; M92-L96 PolarHBondContact O-N 2.97Å; M92-L96 HydrophobicContact SD-CD1 4.02Å; M92-F127 HydrophobicContact CB-CD1 3.64Å; M92-F127 HydrophobicContact CB-CD2 3.72Å; M92-F127 HydrophobicContact CB-CE1 3.43Å; M92-F127 VanDerWaalsContact CB-CE1 3.43Å; M92-F127 HydrophobicContact CB-CE2 3.54Å; M92-F127 HydrophobicContact CB-CG 3.8Å; M92-F127 HydrophobicContact CB-CZ 3.4Å; M92-F127 HydrophobicContact CG-CD1 4.19Å; M92-F127 HydrophobicContact CG-CE1 3.66Å; M92-F127 HydrophobicContact CG-CE2 4.44Å; M92-F127 HydrophobicContact CG-CZ 3.82Å
93	L	95.9	Very high	95.2	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-60.3	-44.1	170.4	-74	171.4	0	0	0	112.1	S89 D90 I91 L95 C97 M98 Y124 F127 V128 T334	S89-L93 WeakPolarHBondContact O-CG 3.02Å; S89-L93 PolarHBondContact O-N 3.41Å; D90-L93 PolarHBondContact O-N 3.13Å; I91-L93 VanDerWaalsContact C-N 3.35Å; I91-L93 PolarHBondContact O-N 2.92Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L93-L95 PolarHBondContact O-N 3.12Å; L93-C97 HydrophobicContact CD2-CB 4.42Å; L93-C97 WeakPolarHBondContact O-CB 3.36Å; L93-C97 PolarHBondContact O-N 3.22Å; L93-C97 VanDerWaalsContact O-N 3.13Å; L93-M98 WeakPolarHBondContact O-CG 3.21Å; L93-M98 PolarHBondContact O-N 2.95Å; L93-Y124 HydrophobicContact CD2-CD2 3.95Å; L93-F127 HydrophobicContact CD1-CB 4.28Å; L93-F127 HydrophobicContact CD2-CB 3.84Å; L93-F127 HydrophobicContact CD2-CD2 4.36Å; L93-F127 HydrophobicContact CG-CB 3.68Å; L93-F127 HydrophobicContact CG-CG 4.48Å; L93-V128 HydrophobicContact CD1-CG2 4.31Å; L93-V128 HydrophobicContact CD2-CG2 4.2Å; L93-T334 HydrophobicContact CB-CG2 4.38Å; L93-T334 HydrophobicContact CD1-CG2 4.32Å
94	S	96.8	Very high	95	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.9	-30	-178.7	-55.3	0	0	0	0	112.8	I55 D90 I91 M92 P99	I55-S94 WeakPolarHBondContact CG2-O 3.45Å; D90-S94 WeakPolarHBondContact O-CB 3.47Å; D90-S94 PolarHBondContact O-N 2.95Å; D90-S94 PolarHBondContact O-OG 3.04Å; I91-S94 WeakPolarHBondContact O-CB 3.23Å; I91-S94 PolarHBondContact O-N 3.13Å; I91-S94 VanDerWaalsContact O-N 3.12Å; M92-S94 VanDerWaalsContact C-N 3.34Å; M92-S94 PolarHBondContact O-N 2.88Å; S94-P99 VanDerWaalsContact O-CD 3.26Å; S94-P99 WeakPolarHBondContact O-CD 3.42Å; S94-P99 WeakPolarHBondContact O-CG 3.46Å
95	L	96.1	Very high	94.8	Very high	76 Å²	76	23.9 Å²	23.9	40%	0.398	13%	0.127	S	C	.	.	H	α-helix	trans	-96.1	-38.2	-178.5	-65.9	178.8	0	0	0	113.7	F59 I91 M92 L93 P99	F59-L95 HydrophobicContact CD2-CD1 4.07Å; F59-L95 HydrophobicContact CD2-CD2 3.95Å; F59-L95 HydrophobicContact CD2-CG 4.08Å; F59-L95 HydrophobicContact CE2-CD1 3.93Å; F59-L95 HydrophobicContact CE2-CD2 4.3Å; F59-L95 HydrophobicContact CE2-CG 4.42Å; I91-L95 HydrophobicContact CG2-CD1 3.82Å; I91-L95 HydrophobicContact CG2-CG 4.38Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 2.77Å; M92-L95 PolarHBondContact O-N 3.1Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L93-L95 PolarHBondContact O-N 3.12Å; L95-P99 WeakPolarHBondContact O-CG 3.27Å
96	L	95.4	Very high	94.5	Very high	65 Å²	65	25.4 Å²	25.4	34%	0.34	14%	0.141	S	C	.	.	H	α-helix	trans	-102.7	-14.3	-168.9	-56.2	-179.4	0	0	0	113.7	M92 F100 L123 F127	M92-L96 HydrophobicContact CB-CD1 4.41Å; M92-L96 VanDerWaalsContact O-CB 3.23Å; M92-L96 WeakPolarHBondContact O-CB 3.47Å; M92-L96 WeakPolarHBondContact O-CG 3.46Å; M92-L96 PolarHBondContact O-N 2.97Å; M92-L96 HydrophobicContact SD-CD1 4.02Å; L96-F100 VanDerWaalsContact O-CD2 3.29Å; L96-F100 WeakPolarHBondContact O-CD2 3.37Å; L96-F100 WeakPolarHBondContact O-CE2 3.29Å; L96-L123 HydrophobicContact CB-CD1 4.46Å; L96-L123 HydrophobicContact CD1-CD1 4.42Å; L96-F127 HydrophobicContact CD1-CE2 3.84Å; L96-F127 HydrophobicContact CD1-CZ 3.98Å
97	C	93.8	Very high	94.2	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.034	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-57.8	-177.3	-57.7	0	0	0	0	111.7	L93 P99 F100 T101	L93-C97 HydrophobicContact CD2-CB 4.42Å; L93-C97 WeakPolarHBondContact O-CB 3.36Å; L93-C97 PolarHBondContact O-N 3.22Å; L93-C97 VanDerWaalsContact O-N 3.13Å; C97-P99 VanDerWaalsContact C-CD 3.43Å; C97-F100 PolarHBondContact O-N 2.9Å; C97-T101 PolarHBondContact O-N 3.45Å; C97-T101 PolarHBondContact O-OG1 2.96Å
98	M	95.2	Very high	93.7	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-57	-39.3	-173.6	-64.8	-169.8	-170.9	0	0	115.2	I55 L93 F100 T101 A102 Y331 T334	I55-M98 HydrophobicContact CD1-CB 3.73Å; I55-M98 HydrophobicContact CG1-CB 3.51Å; I55-M98 HydrophobicContact CG1-CG 4.36Å; I55-M98 HydrophobicContact CG1-SD 3.94Å; L93-M98 WeakPolarHBondContact O-CG 3.21Å; L93-M98 PolarHBondContact O-N 2.95Å; M98-F100 VanDerWaalsContact C-N 3.35Å; M98-F100 PolarHBondContact O-N 3.22Å; M98-T101 PolarHBondContact O-N 2.89Å; M98-A102 PolarHBondContact O-N 3.27Å; M98-Y331 VanDerWaalsContact CE-CB 3.42Å; M98-Y331 HydrophobicContact CE-CD1 3.59Å; M98-Y331 HydrophobicContact CE-CD2 4.45Å; M98-Y331 HydrophobicContact CE-CE1 4.42Å; M98-Y331 HydrophobicContact CE-CG 3.59Å; M98-Y331 HydrophobicContact CG-CD1 3.94Å; M98-Y331 HydrophobicContact CG-CD2 3.89Å; M98-Y331 HydrophobicContact CG-CE1 3.99Å; M98-Y331 HydrophobicContact CG-CE2 3.95Å; M98-Y331 HydrophobicContact CG-CG 3.88Å; M98-Y331 HydrophobicContact SD-CD1 4.5Å; M98-Y331 HydrophobicContact SD-CD2 4.49Å; M98-Y331 HydrophobicContact SD-CG 4.17Å; M98-T334 HydrophobicContact CE-CG2 3.43Å; M98-T334 VanDerWaalsContact CE-CG2 3.43Å; M98-T334 WeakPolarHBondContact CE-OG1 3.42Å
99	P	95.1	Very high	93.1	Very high	40 Å²	40	29.9 Å²	29.9	26%	0.26	17%	0.174	S	C	.	.	H	α-helix	trans	-64.9	-39.8	-178.2	-22.7	35.7	0	0	0	112.2	I55 S94 L95 C97 A102 V103	I55-P99 HydrophobicContact CD1-CB 4.44Å; I55-P99 HydrophobicContact CD1-CG 4.09Å; S94-P99 VanDerWaalsContact O-CD 3.26Å; S94-P99 WeakPolarHBondContact O-CD 3.42Å; S94-P99 WeakPolarHBondContact O-CG 3.46Å; L95-P99 WeakPolarHBondContact O-CG 3.27Å; C97-P99 VanDerWaalsContact C-CD 3.43Å; P99-A102 WeakPolarHBondContact O-CB 3.28Å; P99-A102 PolarHBondContact O-N 2.69Å; P99-A102 VanDerWaalsContact O-N 3.11Å; P99-V103 WeakPolarHBondContact O-CG2 3.09Å; P99-V103 PolarHBondContact O-N 3.24Å
100	F	92.8	Very high	92.6	Very high	54 Å²	54	31.7 Å²	31.7	24%	0.237	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-39.1	177.6	-57.2	-76	0	0	0	111.1	L96 C97 M98 A102 V103 T104 W110 F112 F116	L96-F100 VanDerWaalsContact O-CD2 3.29Å; L96-F100 WeakPolarHBondContact O-CD2 3.37Å; L96-F100 WeakPolarHBondContact O-CE2 3.29Å; C97-F100 PolarHBondContact O-N 2.9Å; M98-F100 VanDerWaalsContact C-N 3.35Å; M98-F100 PolarHBondContact O-N 3.22Å; F100-A102 VanDerWaalsContact C-N 3.28Å; F100-A102 PolarHBondContact O-N 3.4Å; F100-V103 PolarHBondContact O-N 3.22Å; F100-T104 WeakPolarHBondContact O-CB 3.31Å; F100-T104 PolarHBondContact O-N 3.17Å; F100-T104 PolarHBondContact O-OG1 3.21Å; F100-W110 HydrophobicContact CB-CH2 4.31Å; F100-W110 HydrophobicContact CB-CZ3 4.29Å; F100-F112 HydrophobicContact CB-CE2 4.11Å; F100-F112 HydrophobicContact CB-CZ 4.42Å; F100-F112 AromaticContact CD1-CD1 3.95Å; F100-F112 HydrophobicContact CD1-CD1 3.95Å; F100-F112 HydrophobicContact CD1-CD2 4.33Å; F100-F112 AromaticContact CD1-CE1 3.61Å; F100-F112 HydrophobicContact CD1-CE1 3.61Å; F100-F112 HydrophobicContact CD1-CE2 4.02Å; F100-F112 HydrophobicContact CD1-CG 4.3Å; F100-F112 AromaticContact CD1-CZ 3.65Å; F100-F112 HydrophobicContact CD1-CZ 3.65Å; F100-F112 HydrophobicContact CE1-CD1 4.32Å; F100-F112 HydrophobicContact CE1-CE1 4.05Å; F100-F112 HydrophobicContact CE1-CZ 4.47Å; F100-F116 HydrophobicContact CB-CE1 4.28Å; F100-F116 AromaticContact CD1-CE1 3.47Å; F100-F116 HydrophobicContact CD1-CE1 3.47Å; F100-F116 VanDerWaalsContact CD1-CE1 3.47Å; F100-F116 AromaticContact CD1-CZ 3.72Å; F100-F116 HydrophobicContact CD1-CZ 3.72Å; F100-F116 AromaticContact CD2-CE1 4Å; F100-F116 HydrophobicContact CD2-CE1 4Å; F100-F116 AromaticContact CD2-CZ 3.8Å; F100-F116 HydrophobicContact CD2-CZ 3.8Å; F100-F116 AromaticContact CE1-CE1 3.71Å; F100-F116 HydrophobicContact CE1-CE1 3.71Å; F100-F116 HydrophobicContact CE1-CE2 4.46Å; F100-F116 AromaticContact CE1-CZ 3.49Å; F100-F116 HydrophobicContact CE1-CZ 3.49Å; F100-F116 VanDerWaalsContact CE1-CZ 3.49Å; F100-F116 HydrophobicContact CE2-CE1 4.22Å; F100-F116 AromaticContact CE2-CZ 3.59Å; F100-F116 HydrophobicContact CE2-CZ 3.59Å; F100-F116 AromaticContact CG-CE1 3.63Å; F100-F116 HydrophobicContact CG-CE1 3.63Å; F100-F116 AromaticContact CG-CZ 3.87Å; F100-F116 HydrophobicContact CG-CZ 3.87Å; F100-F116 HydrophobicContact CZ-CE1 4.09Å; F100-F116 HydrophobicContact CZ-CE2 4.29Å; F100-F116 AromaticContact CZ-CZ 3.42Å; F100-F116 HydrophobicContact CZ-CZ 3.42Å; F100-F116 VanDerWaalsContact CZ-CZ 3.42Å
101	T	91.7	Very high	92.1	Very high	21 Å²	21	35.6 Å²	35.6	13%	0.129	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-37.3	170.1	-45.7	0	0	0	0	111.2	M51 C97 M98 T104 V105 L327 Y331	M51-T101 HydrophobicContact CE-CG2 3.68Å; C97-T101 PolarHBondContact O-N 3.45Å; C97-T101 PolarHBondContact O-OG1 2.96Å; M98-T101 PolarHBondContact O-N 2.89Å; T101-T104 WeakPolarHBondContact O-CB 3.46Å; T101-T104 PolarHBondContact O-N 3.25Å; T101-V105 VanDerWaalsContact O-CG2 3.29Å; T101-V105 WeakPolarHBondContact O-CG2 3.35Å; T101-V105 PolarHBondContact O-N 3.48Å; T101-L327 HydrophobicContact CG2-CD2 3.66Å; T101-Y331 HydrophobicContact CG2-CE2 4.09Å; T101-Y331 PolarHBondContact OG1-OH 2.68Å
102	A	93.5	Very high	91.5	Very high	7 Å²	7	38.1 Å²	38.1	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-44.6	179.6	0	0	0	0	0	112	M51 M98 P99 F100 T104 V105 A106	M51-A102 HydrophobicContact CB-CB 3.94Å; M51-A102 HydrophobicContact CE-CB 3.71Å; M98-A102 PolarHBondContact O-N 3.27Å; P99-A102 WeakPolarHBondContact O-CB 3.28Å; P99-A102 PolarHBondContact O-N 2.69Å; P99-A102 VanDerWaalsContact O-N 3.11Å; F100-A102 VanDerWaalsContact C-N 3.28Å; F100-A102 PolarHBondContact O-N 3.4Å; A102-T104 VanDerWaalsContact C-N 3.32Å; A102-T104 PolarHBondContact O-N 3.2Å; A102-V105 PolarHBondContact O-N 2.84Å; A102-A106 PolarHBondContact O-N 2.74Å
103	V	92.3	Very high	90.9	Very high	67 Å²	67	38 Å²	38	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-59.1	-47.9	173.6	174.3	0	0	0	0	109.9	P99 F100 V105 A106 T107 F112	P99-V103 WeakPolarHBondContact O-CG2 3.09Å; P99-V103 PolarHBondContact O-N 3.24Å; F100-V103 PolarHBondContact O-N 3.22Å; V103-V105 VanDerWaalsContact C-N 3.3Å; V103-V105 PolarHBondContact O-N 2.72Å; V103-A106 WeakPolarHBondContact O-CB 3.41Å; V103-A106 PolarHBondContact O-N 3.08Å; V103-T107 HydrophobicContact CG1-CG2 4.06Å; V103-T107 PolarHBondContact O-N 3.48Å; V103-T107 PolarHBondContact O-OG1 3.35Å; V103-F112 HydrophobicContact CB-CE2 4.2Å; V103-F112 HydrophobicContact CB-CZ 3.84Å; V103-F112 HydrophobicContact CG1-CE2 4.12Å; V103-F112 HydrophobicContact CG1-CZ 3.7Å; V103-F112 HydrophobicContact CG2-CZ 4.26Å
104	T	89.9	Confident	90.2	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-58.1	-40.8	179.3	-55.4	0	0	0	0	112.5	F100 T101 A102 A108 W110 P193	F100-T104 WeakPolarHBondContact O-CB 3.31Å; F100-T104 PolarHBondContact O-N 3.17Å; F100-T104 PolarHBondContact O-OG1 3.21Å; T101-T104 WeakPolarHBondContact O-CB 3.46Å; T101-T104 PolarHBondContact O-N 3.25Å; A102-T104 VanDerWaalsContact C-N 3.32Å; A102-T104 PolarHBondContact O-N 3.2Å; T104-A108 WeakPolarHBondContact O-CA 3.17Å; T104-A108 PolarHBondContact O-N 2.96Å; T104-W110 HydrophobicContact CG2-CE3 4.26Å; T104-P193 WeakPolarHBondContact CG2-O 3.23Å
105	V	90.1	Very high	89.6	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.024	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-40.2	175.4	169.6	0	0	0	0	111.4	R44 L47 M51 T101 A102 V103 I324	R44-V105 WeakPolarHBondContact CB-O 3.39Å; L47-V105 HydrophobicContact CB-CG1 3.8Å; M51-V105 HydrophobicContact CE-CG2 4.38Å; T101-V105 VanDerWaalsContact O-CG2 3.29Å; T101-V105 WeakPolarHBondContact O-CG2 3.35Å; T101-V105 PolarHBondContact O-N 3.48Å; A102-V105 PolarHBondContact O-N 2.84Å; V103-V105 VanDerWaalsContact C-N 3.3Å; V103-V105 PolarHBondContact O-N 2.72Å; V105-I324 HydrophobicContact CG2-CD1 4.04Å; V105-I324 HydrophobicContact CG2-CG2 4.39Å
106	A	90.6	Very high	89.2	Confident	45 Å²	45	43.4 Å²	43.4	37%	0.372	27%	0.27	S	S	.	.	H	α-helix	trans	-70.2	-45.4	-178.9	0	0	0	0	0	112.5	A48 A102 V103	A48-A106 HydrophobicContact CB-CB 3.85Å; A102-A106 PolarHBondContact O-N 2.74Å; V103-A106 WeakPolarHBondContact O-CB 3.41Å; V103-A106 PolarHBondContact O-N 3.08Å
107	T	88.3	Confident	88.9	Confident	72 Å²	72	40.4 Å²	40.4	44%	0.442	25%	0.254	S	S	.	.	H	α-helix	trans	-80.1	-23	-179.9	57	0	0	0	0	112.2	V103 D109	V103-T107 HydrophobicContact CG1-CG2 4.06Å; V103-T107 PolarHBondContact O-N 3.48Å; V103-T107 PolarHBondContact O-OG1 3.35Å; T107-D109 PolarHBondContact O-N 3.47Å; T107-D109 PolarHBondContact OG1-N 3.02Å; T107-D109 PolarHBondContact OG1-O 3.12Å
108	A	85.3	Confident	88.6	Confident	22 Å²	22	43.8 Å²	43.8	18%	0.182	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	38.1	-163.4	0	0	0	0	0	112.3	T104 P193	T104-A108 WeakPolarHBondContact O-CA 3.17Å; T104-A108 PolarHBondContact O-N 2.96Å; A108-P193 HydrophobicContact CB-CG 4.43Å; A108-P193 WeakPolarHBondContact O-CB 3.43Å; A108-P193 WeakPolarHBondContact O-CG 2.95Å
109	D	84.5	Confident	88.3	Confident	82 Å²	82	45.3 Å²	45.3	44%	0.439	28%	0.279	S	S	.	.	S	Bend	trans	-149.7	145.6	173.9	-179.9	45.8	0	0	0	110.8	T107 S111	T107-D109 PolarHBondContact O-N 3.47Å; T107-D109 PolarHBondContact OG1-N 3.02Å; T107-D109 PolarHBondContact OG1-O 3.12Å; D109-S111 PolarHBondContact OD2-OG 3.42Å
110	W	86.1	Confident	88.1	Confident	39 Å²	39	44 Å²	44	15%	0.148	27%	0.271	C	S	.	.			trans	-96.5	92.1	171.9	179.7	-91	0	0	0	110.5	F100 T104 F112 G113 F116 C117 C195	F100-W110 HydrophobicContact CB-CH2 4.31Å; F100-W110 HydrophobicContact CB-CZ3 4.29Å; T104-W110 HydrophobicContact CG2-CE3 4.26Å; W110-F112 AromaticContact CD2-CD2 3.96Å; W110-F112 HydrophobicContact CD2-CD2 3.96Å; W110-F112 AromaticContact CE2-CD2 3.98Å; W110-F112 AromaticContact CE3-CD2 3.9Å; W110-F112 HydrophobicContact CE3-CD2 3.9Å; W110-F112 HydrophobicContact CE3-CE2 4.48Å; W110-F112 AromaticContact CH2-CD2 3.95Å; W110-F112 HydrophobicContact CH2-CD2 3.95Å; W110-F112 HydrophobicContact CZ2-CB 3.84Å; W110-F112 HydrophobicContact CZ2-CD2 4.01Å; W110-F112 HydrophobicContact CZ2-CG 4.34Å; W110-F112 AromaticContact CZ3-CD2 3.89Å; W110-F112 HydrophobicContact CZ3-CD2 3.89Å; W110-F112 HydrophobicContact CZ3-CE2 4.4Å; W110-G113 PolarHBondContact NE1-O 2.95Å; W110-F116 HydrophobicContact CH2-CD1 4.08Å; W110-F116 HydrophobicContact CH2-CE1 4.17Å; W110-F116 AromaticContact CZ2-CD1 3.72Å; W110-F116 HydrophobicContact CZ2-CD1 3.72Å; W110-F116 HydrophobicContact CZ2-CE1 4.28Å; W110-C117 HydrophobicContact CZ2-CB 3.77Å; W110-C195 HydrophobicContact CD2-CB 3.67Å; W110-C195 HydrophobicContact CE3-CB 3.57Å; W110-C195 HydrophobicContact CG-CB 4.48Å; W110-C195 HydrophobicContact CH2-CB 3.54Å; W110-C195 HydrophobicContact CZ2-CB 3.63Å; W110-C195 HydrophobicContact CZ3-CB 3.52Å
111	S	85.7	Confident	88.1	Confident	83 Å²	83	42 Å²	42	58%	0.58	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	4.5	-174.8	-34.5	0	0	0	0	114.5	D109	D109-S111 PolarHBondContact OD2-OG 3.42Å
112	F	86.3	Confident	88.1	Confident	70 Å²	70	42.4 Å²	42.4	31%	0.307	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.2	-174.2	-55.9	-75.9	0	0	0	114.6	F100 V103 W110 F116	F100-F112 HydrophobicContact CB-CE2 4.11Å; F100-F112 HydrophobicContact CB-CZ 4.42Å; F100-F112 AromaticContact CD1-CD1 3.95Å; F100-F112 HydrophobicContact CD1-CD1 3.95Å; F100-F112 HydrophobicContact CD1-CD2 4.33Å; F100-F112 AromaticContact CD1-CE1 3.61Å; F100-F112 HydrophobicContact CD1-CE1 3.61Å; F100-F112 HydrophobicContact CD1-CE2 4.02Å; F100-F112 HydrophobicContact CD1-CG 4.3Å; F100-F112 AromaticContact CD1-CZ 3.65Å; F100-F112 HydrophobicContact CD1-CZ 3.65Å; F100-F112 HydrophobicContact CE1-CD1 4.32Å; F100-F112 HydrophobicContact CE1-CE1 4.05Å; F100-F112 HydrophobicContact CE1-CZ 4.47Å; V103-F112 HydrophobicContact CB-CE2 4.2Å; V103-F112 HydrophobicContact CB-CZ 3.84Å; V103-F112 HydrophobicContact CG1-CE2 4.12Å; V103-F112 HydrophobicContact CG1-CZ 3.7Å; V103-F112 HydrophobicContact CG2-CZ 4.26Å; W110-F112 AromaticContact CD2-CD2 3.96Å; W110-F112 HydrophobicContact CD2-CD2 3.96Å; W110-F112 AromaticContact CE2-CD2 3.98Å; W110-F112 AromaticContact CE3-CD2 3.9Å; W110-F112 HydrophobicContact CE3-CD2 3.9Å; W110-F112 HydrophobicContact CE3-CE2 4.48Å; W110-F112 AromaticContact CH2-CD2 3.95Å; W110-F112 HydrophobicContact CH2-CD2 3.95Å; W110-F112 HydrophobicContact CZ2-CB 3.84Å; W110-F112 HydrophobicContact CZ2-CD2 4.01Å; W110-F112 HydrophobicContact CZ2-CG 4.34Å; W110-F112 AromaticContact CZ3-CD2 3.89Å; W110-F112 HydrophobicContact CZ3-CD2 3.89Å; W110-F112 HydrophobicContact CZ3-CE2 4.4Å; F112-F116 HydrophobicContact CB-CB 4.22Å; F112-F116 HydrophobicContact CB-CD1 3.44Å; F112-F116 VanDerWaalsContact CB-CD1 3.44Å; F112-F116 HydrophobicContact CB-CE1 4.2Å; F112-F116 HydrophobicContact CB-CG 4.13Å; F112-F116 HydrophobicContact CG-CD1 4Å; F112-F116 HydrophobicContact CG-CE1 4.27Å; F112-F116 VanDerWaalsContact O-CB 3.28Å; F112-F116 WeakPolarHBondContact O-CB 3.43Å
113	G	84.5	Confident	88.2	Confident	39 Å²	39	44 Å²	44	40%	0.402	27%	0.271	S	S	.	.	H	α-helix	trans	79.9	168.9	-179.7	0	0	0	0	0	114.7	W110 C117	W110-G113 PolarHBondContact NE1-O 2.95Å; G113-C117 WeakPolarHBondContact O-CB 3.27Å; G113-C117 PolarHBondContact O-N 3.47Å; G113-C117 VanDerWaalsContact O-N 3.13Å
114	S	81.1	Confident	88.4	Confident	77 Å²	77	41.7 Å²	41.7	54%	0.538	26%	0.255	S	S	.	.	H	α-helix	trans	-75.9	-35.1	-172.3	61.6	0	0	0	0	113.7	C117 R118	S114-C117 PolarHBondContact O-N 2.86Å; S114-R118 PolarHBondContact O-N 2.94Å
115	G	84.1	Confident	88.6	Confident	40 Å²	40	42.2 Å²	42.2	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-49	175.7	0	0	0	0	0	111.8	C117 R118 A119	G115-C117 VanDerWaalsContact C-N 3.33Å; G115-C117 PolarHBondContact O-N 3.1Å; G115-R118 PolarHBondContact O-N 3.32Å; G115-A119 PolarHBondContact O-N 3.4Å
116	F	88.1	Confident	89	Confident	74 Å²	74	42.8 Å²	42.8	33%	0.325	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-38.8	175.8	-171.6	-104.1	0	0	0	111.7	F100 W110 F112 R118 A119 S120	F100-F116 HydrophobicContact CB-CE1 4.28Å; F100-F116 AromaticContact CD1-CE1 3.47Å; F100-F116 HydrophobicContact CD1-CE1 3.47Å; F100-F116 VanDerWaalsContact CD1-CE1 3.47Å; F100-F116 AromaticContact CD1-CZ 3.72Å; F100-F116 HydrophobicContact CD1-CZ 3.72Å; F100-F116 AromaticContact CD2-CE1 4Å; F100-F116 HydrophobicContact CD2-CE1 4Å; F100-F116 AromaticContact CD2-CZ 3.8Å; F100-F116 HydrophobicContact CD2-CZ 3.8Å; F100-F116 AromaticContact CE1-CE1 3.71Å; F100-F116 HydrophobicContact CE1-CE1 3.71Å; F100-F116 HydrophobicContact CE1-CE2 4.46Å; F100-F116 AromaticContact CE1-CZ 3.49Å; F100-F116 HydrophobicContact CE1-CZ 3.49Å; F100-F116 VanDerWaalsContact CE1-CZ 3.49Å; F100-F116 HydrophobicContact CE2-CE1 4.22Å; F100-F116 AromaticContact CE2-CZ 3.59Å; F100-F116 HydrophobicContact CE2-CZ 3.59Å; F100-F116 AromaticContact CG-CE1 3.63Å; F100-F116 HydrophobicContact CG-CE1 3.63Å; F100-F116 AromaticContact CG-CZ 3.87Å; F100-F116 HydrophobicContact CG-CZ 3.87Å; F100-F116 HydrophobicContact CZ-CE1 4.09Å; F100-F116 HydrophobicContact CZ-CE2 4.29Å; F100-F116 AromaticContact CZ-CZ 3.42Å; F100-F116 HydrophobicContact CZ-CZ 3.42Å; F100-F116 VanDerWaalsContact CZ-CZ 3.42Å; W110-F116 HydrophobicContact CH2-CD1 4.08Å; W110-F116 HydrophobicContact CH2-CE1 4.17Å; W110-F116 AromaticContact CZ2-CD1 3.72Å; W110-F116 HydrophobicContact CZ2-CD1 3.72Å; W110-F116 HydrophobicContact CZ2-CE1 4.28Å; F112-F116 HydrophobicContact CB-CB 4.22Å; F112-F116 HydrophobicContact CB-CD1 3.44Å; F112-F116 VanDerWaalsContact CB-CD1 3.44Å; F112-F116 HydrophobicContact CB-CE1 4.2Å; F112-F116 HydrophobicContact CB-CG 4.13Å; F112-F116 HydrophobicContact CG-CD1 4Å; F112-F116 HydrophobicContact CG-CE1 4.27Å; F112-F116 VanDerWaalsContact O-CB 3.28Å; F112-F116 WeakPolarHBondContact O-CB 3.43Å; F116-R118 PolarHBondContact O-N 3.29Å; F116-A119 PolarHBondContact O-N 2.94Å; F116-S120 WeakPolarHBondContact O-CB 3.48Å; F116-S120 PolarHBondContact O-N 3.3Å; F116-S120 PolarHBondContact O-OG 2.75Å
117	C	88.3	Confident	89.3	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-45	175.6	179.1	0	0	0	0	112.9	W110 G113 S114 G115 A119 S120 I121 I187 C195	W110-C117 HydrophobicContact CZ2-CB 3.77Å; G113-C117 WeakPolarHBondContact O-CB 3.27Å; G113-C117 PolarHBondContact O-N 3.47Å; G113-C117 VanDerWaalsContact O-N 3.13Å; S114-C117 PolarHBondContact O-N 2.86Å; G115-C117 VanDerWaalsContact C-N 3.33Å; G115-C117 PolarHBondContact O-N 3.1Å; C117-A119 VanDerWaalsContact C-N 3.34Å; C117-A119 PolarHBondContact O-N 3.31Å; C117-S120 WeakPolarHBondContact CA-OG 3.5Å; C117-S120 PolarHBondContact O-N 3.21Å; C117-S120 PolarHBondContact O-OG 3.47Å; C117-I121 WeakPolarHBondContact O-CG1 3.42Å; C117-I121 PolarHBondContact O-N 3.37Å; C117-I187 HydrophobicContact CB-CG2 4.24Å; C117-I187 WeakPolarHBondContact SG-CG2 3.29Å; C117-C195 WeakPolarHBondContact CA-SG 3.48Å; C117-C195 HydrophobicContact CB-CB 3.99Å; C117-C195 WeakPolarHBondContact CB-SG 3.47Å; C117-C195 PolarHBondContact O-SG 3.05Å; C117-C195 VanDerWaalsContact SG-CA 3.55Å; C117-C195 WeakPolarHBondContact SG-CB 3.19Å; C117-C195 CovalentContact SG-SG 2.02Å; C117-C195 PolarHBondContact SG-SG 3Å
118	R	86.9	Confident	89.7	Confident	77 Å²	77	37.8 Å²	37.8	29%	0.291	22%	0.223	S	C	.	.	H	α-helix	trans	-58.9	-46	174.5	-77.3	-177	-72.6	-148.5	3.8	112.1	S114 G115 F116 I121 M122 I187	S114-R118 PolarHBondContact O-N 2.94Å; G115-R118 PolarHBondContact O-N 3.32Å; F116-R118 PolarHBondContact O-N 3.29Å; R118-I121 PolarHBondContact O-N 2.97Å; R118-M122 PolarHBondContact O-N 3.35Å; R118-I187 HydrophobicContact CG-CD1 3.5Å; R118-I187 VanDerWaalsContact CG-CD1 3.5Å; R118-I187 HydrophobicContact CG-CG2 4.49Å
119	A	90.3	Very high	90.2	Very high	33 Å²	33	37.1 Å²	37.1	27%	0.273	22%	0.216	S	C	.	.	H	α-helix	trans	-63.6	-42.8	177.3	0	0	0	0	0	112.1	G115 F116 C117 M122 L123	G115-A119 PolarHBondContact O-N 3.4Å; F116-A119 PolarHBondContact O-N 2.94Å; C117-A119 VanDerWaalsContact C-N 3.34Å; C117-A119 PolarHBondContact O-N 3.31Å; A119-M122 WeakPolarHBondContact O-CB 3.47Å; A119-M122 PolarHBondContact O-N 3.11Å; A119-L123 WeakPolarHBondContact O-CB 3.26Å; A119-L123 VanDerWaalsContact O-CG 3.31Å; A119-L123 WeakPolarHBondContact O-CG 3.3Å; A119-L123 PolarHBondContact O-N 2.92Å
120	S	91.1	Very high	90.9	Very high	13 Å²	13	33.2 Å²	33.2	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-66.7	-37.8	179.1	61	0	0	0	0	112.2	F116 C117 L123 Y124 C195	F116-S120 WeakPolarHBondContact O-CB 3.48Å; F116-S120 PolarHBondContact O-N 3.3Å; F116-S120 PolarHBondContact O-OG 2.75Å; C117-S120 WeakPolarHBondContact CA-OG 3.5Å; C117-S120 PolarHBondContact O-N 3.21Å; C117-S120 PolarHBondContact O-OG 3.47Å; S120-L123 PolarHBondContact O-N 2.85Å; S120-Y124 VanDerWaalsContact O-CB 3.23Å; S120-Y124 WeakPolarHBondContact O-CB 3.33Å; S120-Y124 PolarHBondContact O-N 3.26Å; S120-C195 PolarHBondContact OG-SG 3.36Å; S120-C195 VanDerWaalsContact OG-SG 3.39Å
121	I	90.9	Very high	91.3	Very high	10 Å²	10	31.7 Å²	31.7	5%	0.051	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-46.1	173.3	-71.5	169	0	0	0	110.3	C117 R118 Y124 W125 I187 C195 L197	C117-I121 WeakPolarHBondContact O-CG1 3.42Å; C117-I121 PolarHBondContact O-N 3.37Å; R118-I121 PolarHBondContact O-N 2.97Å; I121-Y124 PolarHBondContact O-N 2.96Å; I121-W125 PolarHBondContact O-N 3.32Å; I121-I187 HydrophobicContact CD1-CG2 4.08Å; I121-C195 VanDerWaalsContact CG1-SG 3.58Å; I121-L197 HydrophobicContact CD1-CD2 4.46Å; I121-L197 HydrophobicContact CG2-CD2 4.08Å; I121-L197 HydrophobicContact CG2-CG 4.29Å
122	M	93.4	Very high	91.8	Very high	30 Å²	30	27.9 Å²	27.9	15%	0.148	17%	0.165	C	C	.	.	H	α-helix	trans	-59.1	-50.6	176.8	-174.2	-151.9	70.8	0	0	111.7	R118 A119 Y124 W125 L126 S173 L174 V177	R118-M122 PolarHBondContact O-N 3.35Å; A119-M122 WeakPolarHBondContact O-CB 3.47Å; A119-M122 PolarHBondContact O-N 3.11Å; M122-Y124 VanDerWaalsContact C-N 3.34Å; M122-Y124 PolarHBondContact O-N 3.34Å; M122-W125 PolarHBondContact O-N 3.34Å; M122-L126 VanDerWaalsContact O-CB 3.3Å; M122-L126 WeakPolarHBondContact O-CB 3.26Å; M122-L126 PolarHBondContact O-N 2.95Å; M122-S173 WeakPolarHBondContact CG-O 3.46Å; M122-L174 HydrophobicContact SD-CD2 4.22Å; M122-V177 HydrophobicContact CB-CG2 3.37Å; M122-V177 HydrophobicContact CG-CG2 3.65Å; M122-V177 HydrophobicContact SD-CG2 3.44Å; M122-V177 WeakPolarHBondContact SD-CG2 3.46Å
123	L	95.3	Very high	92.3	Very high	42 Å²	42	25.7 Å²	25.7	22%	0.22	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-43.7	-180	-72.7	173.3	0	0	0	111.3	L96 A119 S120 L126 F127	L96-L123 HydrophobicContact CB-CD1 4.46Å; L96-L123 HydrophobicContact CD1-CD1 4.42Å; A119-L123 WeakPolarHBondContact O-CB 3.26Å; A119-L123 VanDerWaalsContact O-CG 3.31Å; A119-L123 WeakPolarHBondContact O-CG 3.3Å; A119-L123 PolarHBondContact O-N 2.92Å; S120-L123 PolarHBondContact O-N 2.85Å; L123-L126 PolarHBondContact O-N 2.79Å; L123-F127 HydrophobicContact CB-CD2 4.47Å; L123-F127 HydrophobicContact CB-CE2 3.99Å; L123-F127 HydrophobicContact CD2-CE2 3.96Å; L123-F127 HydrophobicContact CD2-CZ 4.12Å; L123-F127 WeakPolarHBondContact O-CD2 3.14Å; L123-F127 PolarHBondContact O-N 3.41Å; L123-F127 VanDerWaalsContact O-N 3.1Å
124	Y	95.1	Very high	92.8	Very high	17 Å²	17	23.9 Å²	23.9	7%	0.067	14%	0.139	C	C	.	.	H	α-helix	trans	-54.6	-56.3	174.3	172.5	-103.1	0	0	0	110.7	L93 S120 I121 M122 L126 F127 V128 H300 L327 S330 Y331	L93-Y124 HydrophobicContact CD2-CD2 3.95Å; S120-Y124 VanDerWaalsContact O-CB 3.23Å; S120-Y124 WeakPolarHBondContact O-CB 3.33Å; S120-Y124 PolarHBondContact O-N 3.26Å; I121-Y124 PolarHBondContact O-N 2.96Å; M122-Y124 VanDerWaalsContact C-N 3.34Å; M122-Y124 PolarHBondContact O-N 3.34Å; Y124-L126 VanDerWaalsContact C-N 3.33Å; Y124-L126 PolarHBondContact O-N 2.85Å; Y124-F127 PolarHBondContact O-N 2.81Å; Y124-V128 HydrophobicContact CD1-CG2 4.5Å; Y124-V128 HydrophobicContact CD2-CG2 4.11Å; Y124-V128 HydrophobicContact CE1-CG2 4.3Å; Y124-V128 HydrophobicContact CE2-CG2 3.86Å; Y124-V128 HydrophobicContact CG-CG2 4.43Å; Y124-V128 VanDerWaalsContact O-CB 3.23Å; Y124-V128 WeakPolarHBondContact O-CB 3.49Å; Y124-V128 WeakPolarHBondContact O-CG2 3.26Å; Y124-V128 PolarHBondContact O-N 2.88Å; Y124-H300 AromaticContact CE1-CE1 3.85Å; Y124-H300 AromaticContact CE1-NE2 3.86Å; Y124-H300 AromaticContact CZ-NE2 3.72Å; Y124-H300 PolarHBondContact OH-CD2 3.1Å; Y124-H300 PolarHBondContact OH-CE1 3.32Å; Y124-H300 VanDerWaalsContact OH-CE1 3.29Å; Y124-H300 PolarHBondContact OH-NE2 3.44Å; Y124-L327 HydrophobicContact CE2-CD1 3.94Å; Y124-S330 PolarHBondContact OH-OG 3.21Å; Y124-Y331 HydrophobicContact CD2-CE1 4.04Å; Y124-Y331 HydrophobicContact CE2-CD1 4.48Å; Y124-Y331 AromaticContact CE2-CE1 3.72Å; Y124-Y331 HydrophobicContact CE2-CE1 3.72Å
125	W	95.3	Very high	93.3	Very high	17 Å²	17	20.8 Å²	20.8	6%	0.064	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-34.6	-179	-70.1	117.4	0	0	0	113.1	I121 M122 V128 L129 L197 L212 V216 H300	I121-W125 PolarHBondContact O-N 3.32Å; M122-W125 PolarHBondContact O-N 3.34Å; W125-V128 HydrophobicContact CE3-CG1 4.04Å; W125-V128 HydrophobicContact CZ3-CG1 4.31Å; W125-V128 PolarHBondContact O-N 3.37Å; W125-L129 VanDerWaalsContact O-CB 3.24Å; W125-L129 WeakPolarHBondContact O-CB 3.41Å; W125-L129 WeakPolarHBondContact O-CD1 3.25Å; W125-L129 WeakPolarHBondContact O-CG 3.04Å; W125-L129 PolarHBondContact O-N 2.91Å; W125-L197 HydrophobicContact CZ2-CD1 4.28Å; W125-L212 HydrophobicContact CB-CD2 4.28Å; W125-L212 HydrophobicContact CD2-CD1 3.96Å; W125-L212 HydrophobicContact CD2-CD2 4.07Å; W125-L212 HydrophobicContact CD2-CG 4.49Å; W125-L212 HydrophobicContact CE3-CD2 4.22Å; W125-L212 HydrophobicContact CG-CD1 4.16Å; W125-L212 HydrophobicContact CG-CD2 4.1Å; W125-L212 HydrophobicContact CZ2-CD1 4.13Å; W125-L212 HydrophobicContact CZ3-CB 4.45Å; W125-V216 HydrophobicContact CE3-CG2 4Å; W125-V216 HydrophobicContact CZ3-CB 4.42Å; W125-V216 HydrophobicContact CZ3-CG1 4.42Å; W125-V216 HydrophobicContact CZ3-CG2 3.87Å; W125-H300 AromaticContact CH2-CE1 3.54Å; W125-H300 AromaticContact CH2-ND1 3.99Å; W125-H300 AromaticContact CZ2-CE1 3.91Å
126	L	97.5	Very high	93.8	Very high	15 Å²	15	21 Å²	21	8%	0.079	11%	0.108	C	C	.	.	H	α-helix	trans	-57.7	-56.1	175.8	173.4	61.9	0	0	0	111.7	M122 L123 Y124 V128 L129 E130 W166 L170	M122-L126 VanDerWaalsContact O-CB 3.3Å; M122-L126 WeakPolarHBondContact O-CB 3.26Å; M122-L126 PolarHBondContact O-N 2.95Å; L123-L126 PolarHBondContact O-N 2.79Å; Y124-L126 VanDerWaalsContact C-N 3.33Å; Y124-L126 PolarHBondContact O-N 2.85Å; L126-V128 VanDerWaalsContact C-N 3.28Å; L126-V128 PolarHBondContact O-N 2.84Å; L126-L129 PolarHBondContact O-N 3.4Å; L126-E130 WeakPolarHBondContact O-CB 3.44Å; L126-E130 PolarHBondContact O-N 2.96Å; L126-W166 HydrophobicContact CD1-CE3 4.27Å; L126-W166 HydrophobicContact CD1-CZ3 4.29Å; L126-W166 HydrophobicContact CD2-CZ3 4.32Å; L126-W166 HydrophobicContact CG-CZ3 4.2Å; L126-L170 HydrophobicContact CD1-CB 4.12Å; L126-L170 HydrophobicContact CD1-CD1 4.41Å; L126-L170 HydrophobicContact CD2-CD1 4.47Å
127	F	97.6	Very high	94.2	Very high	12 Å²	12	18.9 Å²	18.9	5%	0.053	10%	0.1	C	C	.	.	H	α-helix	trans	-70.8	-28.8	-177.4	-59.5	-54.1	0	0	0	112.3	M92 L93 L96 L123 Y124 G131 W166	M92-F127 HydrophobicContact CB-CD1 3.64Å; M92-F127 HydrophobicContact CB-CD2 3.72Å; M92-F127 HydrophobicContact CB-CE1 3.43Å; M92-F127 VanDerWaalsContact CB-CE1 3.43Å; M92-F127 HydrophobicContact CB-CE2 3.54Å; M92-F127 HydrophobicContact CB-CG 3.8Å; M92-F127 HydrophobicContact CB-CZ 3.4Å; M92-F127 HydrophobicContact CG-CD1 4.19Å; M92-F127 HydrophobicContact CG-CE1 3.66Å; M92-F127 HydrophobicContact CG-CE2 4.44Å; M92-F127 HydrophobicContact CG-CZ 3.82Å; L93-F127 HydrophobicContact CD1-CB 4.28Å; L93-F127 HydrophobicContact CD2-CB 3.84Å; L93-F127 HydrophobicContact CD2-CD2 4.36Å; L93-F127 HydrophobicContact CG-CB 3.68Å; L93-F127 HydrophobicContact CG-CG 4.48Å; L96-F127 HydrophobicContact CD1-CE2 3.84Å; L96-F127 HydrophobicContact CD1-CZ 3.98Å; L123-F127 HydrophobicContact CB-CD2 4.47Å; L123-F127 HydrophobicContact CB-CE2 3.99Å; L123-F127 HydrophobicContact CD2-CE2 3.96Å; L123-F127 HydrophobicContact CD2-CZ 4.12Å; L123-F127 WeakPolarHBondContact O-CD2 3.14Å; L123-F127 PolarHBondContact O-N 3.41Å; L123-F127 VanDerWaalsContact O-N 3.1Å; Y124-F127 PolarHBondContact O-N 2.81Å; F127-G131 PolarHBondContact O-N 3.48Å; F127-W166 AromaticContact CD1-CH2 3.86Å; F127-W166 HydrophobicContact CD1-CH2 3.86Å; F127-W166 HydrophobicContact CD1-CZ3 4.17Å; F127-W166 AromaticContact CE1-CH2 3.83Å; F127-W166 HydrophobicContact CE1-CH2 3.83Å; F127-W166 AromaticContact CE1-CZ3 4Å; F127-W166 HydrophobicContact CE1-CZ3 4Å
128	V	96.2	Very high	94.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-66	-52	173	159	0	0	0	0	111.5	L93 Y124 W125 L126 E130 G131 V132 V216 W297	L93-V128 HydrophobicContact CD1-CG2 4.31Å; L93-V128 HydrophobicContact CD2-CG2 4.2Å; Y124-V128 HydrophobicContact CD1-CG2 4.5Å; Y124-V128 HydrophobicContact CD2-CG2 4.11Å; Y124-V128 HydrophobicContact CE1-CG2 4.3Å; Y124-V128 HydrophobicContact CE2-CG2 3.86Å; Y124-V128 HydrophobicContact CG-CG2 4.43Å; Y124-V128 VanDerWaalsContact O-CB 3.23Å; Y124-V128 WeakPolarHBondContact O-CB 3.49Å; Y124-V128 WeakPolarHBondContact O-CG2 3.26Å; Y124-V128 PolarHBondContact O-N 2.88Å; W125-V128 HydrophobicContact CE3-CG1 4.04Å; W125-V128 HydrophobicContact CZ3-CG1 4.31Å; W125-V128 PolarHBondContact O-N 3.37Å; L126-V128 VanDerWaalsContact C-N 3.28Å; L126-V128 PolarHBondContact O-N 2.84Å; V128-E130 VanDerWaalsContact C-N 3.27Å; V128-E130 PolarHBondContact O-N 3.44Å; V128-G131 PolarHBondContact O-N 3.41Å; V128-V132 WeakPolarHBondContact O-CB 3.45Å; V128-V132 VanDerWaalsContact O-CG2 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.3Å; V128-V132 PolarHBondContact O-N 3.34Å; V128-V216 HydrophobicContact CG1-CB 4.48Å; V128-V216 HydrophobicContact CG1-CG1 3.74Å; V128-V216 HydrophobicContact CG1-CG2 3.82Å; V128-W297 HydrophobicContact CB-CH2 3.75Å; V128-W297 HydrophobicContact CB-CZ2 3.95Å; V128-W297 HydrophobicContact CG1-CH2 3.1Å; V128-W297 HydrophobicContact CG1-CZ2 3.31Å; V128-W297 HydrophobicContact CG1-CZ3 3.84Å; V128-W297 HydrophobicContact CG2-CH2 3.29Å; V128-W297 HydrophobicContact CG2-CZ2 3.69Å; V128-W297 HydrophobicContact CG2-CZ3 4.44Å
129	L	97	Very high	94.5	Very high	8 Å²	8	16.1 Å²	16.1	4%	0.042	9%	0.092	C	C	.	.	H	α-helix	trans	-61	-39.9	178.3	-75.8	163.1	0	0	0	111	W125 L126 V132 S133 S169 V172 L212 A215 V216	W125-L129 VanDerWaalsContact O-CB 3.24Å; W125-L129 WeakPolarHBondContact O-CB 3.41Å; W125-L129 WeakPolarHBondContact O-CD1 3.25Å; W125-L129 WeakPolarHBondContact O-CG 3.04Å; W125-L129 PolarHBondContact O-N 2.91Å; L126-L129 PolarHBondContact O-N 3.4Å; L129-V132 PolarHBondContact O-N 3.06Å; L129-S133 VanDerWaalsContact O-CB 3.29Å; L129-S133 WeakPolarHBondContact O-CB 3.31Å; L129-S133 PolarHBondContact O-N 2.87Å; L129-S133 PolarHBondContact O-OG 3.11Å; L129-S169 WeakPolarHBondContact CB-OG 3.43Å; L129-V172 HydrophobicContact CD1-CB 3.81Å; L129-V172 HydrophobicContact CD1-CG1 3.58Å; L129-V172 HydrophobicContact CD2-CG1 4.33Å; L129-L212 HydrophobicContact CD1-CD2 4.33Å; L129-A215 HydrophobicContact CD2-CB 3.79Å; L129-V216 HydrophobicContact CD2-CG2 3.51Å; L129-V216 HydrophobicContact CG-CG2 4Å
130	E	97.7	Very high	94.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.3	-51.7	175.3	178.9	61.6	-170.8	0	0	110.7	T85 S89 L126 V128 V132 S133 I134 S165 W166 S169	T85-E130 HydrophobicContact CG2-CG 4.25Å; T85-E130 WeakPolarHBondContact CG2-OE1 3.4Å; S89-E130 VanDerWaalsContact OG-CG 3.27Å; S89-E130 WeakPolarHBondContact OG-CG 3.38Å; L126-E130 WeakPolarHBondContact O-CB 3.44Å; L126-E130 PolarHBondContact O-N 2.96Å; V128-E130 VanDerWaalsContact C-N 3.27Å; V128-E130 PolarHBondContact O-N 3.44Å; E130-V132 VanDerWaalsContact C-N 3.28Å; E130-V132 PolarHBondContact O-N 3.41Å; E130-S133 WeakPolarHBondContact O-CB 3.47Å; E130-S133 PolarHBondContact O-N 3.35Å; E130-S133 VanDerWaalsContact O-N 3.11Å; E130-I134 WeakPolarHBondContact O-CG1 3.27Å; E130-I134 PolarHBondContact O-N 3.48Å; E130-S165 VanDerWaalsContact CD-OG 3.28Å; E130-S165 PolarHBondContact OE1-OG 3.47Å; E130-S165 VanDerWaalsContact OE1-OG 3.08Å; E130-S165 WeakPolarHBondContact OE2-CB 3.41Å; E130-S165 PolarHBondContact OE2-OG 3.43Å; E130-W166 HydrophobicContact CG-CD2 4.25Å; E130-W166 HydrophobicContact CG-CH2 4.26Å; E130-W166 HydrophobicContact CG-CZ2 3.75Å; E130-W166 VanDerWaalsContact OE1-CD1 3.32Å; E130-W166 PolarHBondContact OE1-NE1 3.08Å; E130-W166 PolarHBondContact OE2-N 2.86Å; E130-S169 PolarHBondContact N-OG 3.43Å
131	G	95.6	Very high	94.6	Very high	6 Å²	6	17.1 Å²	17.1	6%	0.062	9%	0.093	C	C	.	.	H	α-helix	trans	-57.3	-40.6	178.8	0	0	0	0	0	113.1	L86 F127 V128 I134 L135	L86-G131 VanDerWaalsContact CD1-CA 3.5Å; F127-G131 PolarHBondContact O-N 3.48Å; V128-G131 PolarHBondContact O-N 3.41Å; G131-I134 PolarHBondContact O-N 2.54Å; G131-L135 WeakPolarHBondContact O-CG 3.43Å; G131-L135 PolarHBondContact O-N 2.91Å; G131-L135 VanDerWaalsContact O-N 3.1Å
132	V	95.3	Very high	94.4	Very high	4 Å²	4	20 Å²	20	2%	0.024	10%	0.103	C	C	.	.	H	α-helix	trans	-68.1	-42.1	176.2	171.5	0	0	0	0	112.1	V128 L129 E130 I134 L135 L136 V216 P220 F293	V128-V132 WeakPolarHBondContact O-CB 3.45Å; V128-V132 VanDerWaalsContact O-CG2 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.3Å; V128-V132 PolarHBondContact O-N 3.34Å; L129-V132 PolarHBondContact O-N 3.06Å; E130-V132 VanDerWaalsContact C-N 3.28Å; E130-V132 PolarHBondContact O-N 3.41Å; V132-I134 VanDerWaalsContact C-N 3.29Å; V132-I134 PolarHBondContact O-N 3.47Å; V132-L135 PolarHBondContact O-N 3.49Å; V132-L136 WeakPolarHBondContact O-CB 3.37Å; V132-L136 PolarHBondContact O-N 2.88Å; V132-V216 HydrophobicContact CG2-CG1 4.24Å; V132-P220 HydrophobicContact CG1-CB 3.65Å; V132-P220 HydrophobicContact CG1-CG 3.3Å; V132-F293 HydrophobicContact CG1-CE2 4.11Å; V132-F293 HydrophobicContact CG2-CD2 4.38Å; V132-F293 HydrophobicContact CG2-CE2 3.76Å
133	S	96.6	Very high	94.2	Very high	24 Å²	24	19.7 Å²	19.7	17%	0.168	10%	0.101	C	C	.	.	H	α-helix	trans	-59.4	-41.6	175.8	-63.2	0	0	0	0	111.3	L129 E130 L136 I137	L129-S133 VanDerWaalsContact O-CB 3.29Å; L129-S133 WeakPolarHBondContact O-CB 3.31Å; L129-S133 PolarHBondContact O-N 2.87Å; L129-S133 PolarHBondContact O-OG 3.11Å; E130-S133 WeakPolarHBondContact O-CB 3.47Å; E130-S133 PolarHBondContact O-N 3.35Å; E130-S133 VanDerWaalsContact O-N 3.11Å; S133-L136 WeakPolarHBondContact O-CB 3.3Å; S133-L136 PolarHBondContact O-N 3.45Å; S133-I137 WeakPolarHBondContact O-CD1 3.13Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.49Å; S133-I137 PolarHBondContact O-N 3.43Å
134	I	95.5	Very high	93.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.5	-44.6	175.5	-62.2	-52.7	0	0	0	111.8	L82 T85 L86 E130 G131 V132 L136 I137 I138 I162	L82-I134 HydrophobicContact CB-CG2 3.92Å; L82-I134 HydrophobicContact CD2-CD1 3.91Å; L82-I134 HydrophobicContact CD2-CG2 4.43Å; L82-I134 WeakPolarHBondContact O-CG2 3.3Å; T85-I134 HydrophobicContact CG2-CD1 3.93Å; T85-I134 HydrophobicContact CG2-CG1 3.98Å; L86-I134 HydrophobicContact CB-CB 4.48Å; L86-I134 HydrophobicContact CB-CG2 4Å; E130-I134 WeakPolarHBondContact O-CG1 3.27Å; E130-I134 PolarHBondContact O-N 3.48Å; G131-I134 PolarHBondContact O-N 2.54Å; V132-I134 VanDerWaalsContact C-N 3.29Å; V132-I134 PolarHBondContact O-N 3.47Å; I134-L136 VanDerWaalsContact C-N 3.26Å; I134-L136 PolarHBondContact O-N 3.09Å; I134-I137 HydrophobicContact CD1-CD1 4.25Å; I134-I137 PolarHBondContact O-N 2.89Å; I134-I138 HydrophobicContact CG2-CD1 3.91Å; I134-I138 HydrophobicContact CG2-CG1 4.4Å; I134-I138 VanDerWaalsContact O-CG1 3.28Å; I134-I138 WeakPolarHBondContact O-CG1 3.17Å; I134-I138 PolarHBondContact O-N 3Å; I134-I162 HydrophobicContact CD1-CG1 4.04Å
135	L	92.4	Very high	93.5	Very high	13 Å²	13	21.2 Å²	21.2	7%	0.068	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-36.5	175.9	-72.2	174.8	0	0	0	112.3	L86 G131 V132 S139 L289 F293	L86-L135 HydrophobicContact CD2-CD2 3.79Å; L86-L135 HydrophobicContact CD2-CG 4.18Å; G131-L135 WeakPolarHBondContact O-CG 3.43Å; G131-L135 PolarHBondContact O-N 2.91Å; G131-L135 VanDerWaalsContact O-N 3.1Å; V132-L135 PolarHBondContact O-N 3.49Å; L135-S139 WeakPolarHBondContact O-CB 3.44Å; L135-S139 PolarHBondContact O-N 3.41Å; L135-S139 PolarHBondContact O-OG 2.83Å; L135-L289 HydrophobicContact CD2-CD2 4.43Å; L135-F293 HydrophobicContact CD1-CB 4.39Å; L135-F293 HydrophobicContact CD1-CD2 4.14Å
136	L	94.4	Very high	92.9	Very high	44 Å²	44	21.9 Å²	21.9	23%	0.23	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-48.8	174.7	-174	63.9	0	0	0	111.3	V132 S133 I134 I138 S139 V140 V223	V132-L136 WeakPolarHBondContact O-CB 3.37Å; V132-L136 PolarHBondContact O-N 2.88Å; S133-L136 WeakPolarHBondContact O-CB 3.3Å; S133-L136 PolarHBondContact O-N 3.45Å; I134-L136 VanDerWaalsContact C-N 3.26Å; I134-L136 PolarHBondContact O-N 3.09Å; L136-I138 VanDerWaalsContact C-N 3.32Å; L136-I138 PolarHBondContact O-N 3.23Å; L136-S139 PolarHBondContact O-N 2.89Å; L136-S139 VanDerWaalsContact O-N 3.1Å; L136-V140 WeakPolarHBondContact O-CG2 3.3Å; L136-V140 PolarHBondContact O-N 2.87Å; L136-V223 HydrophobicContact CD1-CB 3.58Å; L136-V223 HydrophobicContact CD1-CG1 3.45Å; L136-V223 VanDerWaalsContact CD1-CG1 3.45Å; L136-V223 HydrophobicContact CD1-CG2 4.3Å
137	I	94.9	Very high	92.2	Very high	30 Å²	30	23 Å²	23	15%	0.154	12%	0.122	C	C	.	.	H	α-helix	trans	-58.1	-45.8	176.9	-67.3	160.8	0	0	0	110.5	L82 S133 I134 S139 V140 D141 L161	L82-I137 HydrophobicContact CD1-CG2 3.69Å; L82-I137 HydrophobicContact CD2-CG2 4.02Å; S133-I137 WeakPolarHBondContact O-CD1 3.13Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.49Å; S133-I137 PolarHBondContact O-N 3.43Å; I134-I137 HydrophobicContact CD1-CD1 4.25Å; I134-I137 PolarHBondContact O-N 2.89Å; I137-S139 VanDerWaalsContact C-N 3.31Å; I137-S139 PolarHBondContact O-N 2.85Å; I137-V140 PolarHBondContact O-N 2.65Å; I137-D141 WeakPolarHBondContact O-CB 3.32Å; I137-D141 PolarHBondContact O-N 2.89Å; I137-L161 HydrophobicContact CD1-CB 4.08Å; I137-L161 HydrophobicContact CG2-CD1 4.06Å
138	I	91.7	Very high	91.6	Very high	8 Å²	8	26.8 Å²	26.8	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-42.8	176.3	-67.9	171.1	0	0	0	110.6	I79 L82 L83 I134 L136 R142	I79-I138 HydrophobicContact CD1-CB 4.47Å; I79-I138 HydrophobicContact CD1-CD1 4.39Å; I79-I138 HydrophobicContact CD1-CG1 3.86Å; I79-I138 HydrophobicContact CD1-CG2 4.09Å; L82-I138 HydrophobicContact CB-CD1 4.27Å; L82-I138 HydrophobicContact CB-CG1 4.18Å; L82-I138 HydrophobicContact CD1-CG1 3.95Å; L83-I138 HydrophobicContact CD2-CD1 4.03Å; I134-I138 HydrophobicContact CG2-CD1 3.91Å; I134-I138 HydrophobicContact CG2-CG1 4.4Å; I134-I138 VanDerWaalsContact O-CG1 3.28Å; I134-I138 WeakPolarHBondContact O-CG1 3.17Å; I134-I138 PolarHBondContact O-N 3Å; L136-I138 VanDerWaalsContact C-N 3.32Å; L136-I138 PolarHBondContact O-N 3.23Å; I138-R142 HydrophobicContact CG2-CG 4.46Å; I138-R142 WeakPolarHBondContact O-CG 3.34Å; I138-R142 PolarHBondContact O-N 3.44Å
139	S	90.3	Very high	91.1	Very high	12 Å²	12	36 Å²	36	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-66.9	-42.4	-178.2	-61.3	0	0	0	0	112.2	L135 L136 I137 R142 F143 M224	L135-S139 WeakPolarHBondContact O-CB 3.44Å; L135-S139 PolarHBondContact O-N 3.41Å; L135-S139 PolarHBondContact O-OG 2.83Å; L136-S139 PolarHBondContact O-N 2.89Å; L136-S139 VanDerWaalsContact O-N 3.1Å; I137-S139 VanDerWaalsContact C-N 3.31Å; I137-S139 PolarHBondContact O-N 2.85Å; S139-R142 PolarHBondContact O-N 3.4Å; S139-F143 PolarHBondContact O-N 3.02Å; S139-M224 WeakPolarHBondContact OG-CG 3.28Å
140	V	92.4	Very high	90.5	Very high	54 Å²	54	38.9 Å²	38.9	33%	0.327	19%	0.187	S	C	.	.	H	α-helix	trans	-65.7	-46	176	173.3	0	0	0	0	111	L136 I137 R142 F143 L144 V223	L136-V140 WeakPolarHBondContact O-CG2 3.3Å; L136-V140 PolarHBondContact O-N 2.87Å; I137-V140 PolarHBondContact O-N 2.65Å; V140-R142 VanDerWaalsContact C-N 3.27Å; V140-R142 PolarHBondContact O-N 2.95Å; V140-F143 WeakPolarHBondContact O-CB 3.24Å; V140-F143 PolarHBondContact O-N 3.4Å; V140-F143 VanDerWaalsContact O-N 3.12Å; V140-L144 HydrophobicContact CG1-CD1 4.14Å; V140-L144 HydrophobicContact CG1-CG 4.29Å; V140-L144 WeakPolarHBondContact O-CG 3.49Å; V140-L144 PolarHBondContact O-N 3.39Å; V140-V223 HydrophobicContact CG2-CG1 3.97Å
141	D	90.9	Very high	90	Very high	12 Å²	12	44.8 Å²	44.8	6%	0.064	22%	0.219	C	C	.	.	H	α-helix	trans	-52.7	-47.1	174.7	173.4	71.8	0	0	0	111.5	I137 F143 L144 I145 L153	I137-D141 WeakPolarHBondContact O-CB 3.32Å; I137-D141 PolarHBondContact O-N 2.89Å; D141-F143 PolarHBondContact O-N 3.23Å; D141-L144 PolarHBondContact O-N 2.85Å; D141-I145 WeakPolarHBondContact O-CG1 3.47Å; D141-I145 PolarHBondContact O-N 2.98Å; D141-I145 WeakPolarHBondContact OD2-CD1 3.43Å; D141-L153 HydrophobicContact CB-CD2 4.02Å; D141-L153 WeakPolarHBondContact OD1-CB 3.47Å; D141-L153 WeakPolarHBondContact OD1-CD2 3.31Å
142	R	87.6	Confident	89.5	Confident	71 Å²	71	49.6 Å²	49.6	27%	0.268	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-38.8	179.2	-67.1	-66.2	174.2	-137	0.9	112.8	I138 S139 V140 I146 I286	I138-R142 HydrophobicContact CG2-CG 4.46Å; I138-R142 WeakPolarHBondContact O-CG 3.34Å; I138-R142 PolarHBondContact O-N 3.44Å; S139-R142 PolarHBondContact O-N 3.4Å; V140-R142 VanDerWaalsContact C-N 3.27Å; V140-R142 PolarHBondContact O-N 2.95Å; R142-I146 VanDerWaalsContact O-CB 3.31Å; R142-I146 WeakPolarHBondContact O-CB 3.03Å; R142-I146 VanDerWaalsContact O-CG1 3.27Å; R142-I146 WeakPolarHBondContact O-CG1 3.35Å; R142-I146 PolarHBondContact O-N 3.23Å; R142-I286 HydrophobicContact CB-CD1 3.49Å; R142-I286 VanDerWaalsContact CB-CD1 3.49Å; R142-I286 HydrophobicContact CB-CG1 4.23Å; R142-I286 HydrophobicContact CG-CD1 3.67Å; R142-I286 HydrophobicContact CG-CG1 3.99Å
143	F	88.8	Confident	89.3	Confident	23 Å²	23	50.8 Å²	50.8	10%	0.101	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-47.8	172.6	165.9	-97.8	0	0	0	111.5	S139 V140 D141 I145 I146 V147 Q148 Y226 C230	S139-F143 PolarHBondContact O-N 3.02Å; V140-F143 WeakPolarHBondContact O-CB 3.24Å; V140-F143 PolarHBondContact O-N 3.4Å; V140-F143 VanDerWaalsContact O-N 3.12Å; D141-F143 PolarHBondContact O-N 3.23Å; F143-I145 PolarHBondContact O-N 2.99Å; F143-I146 PolarHBondContact O-N 3.33Å; F143-V147 HydrophobicContact CD2-CB 3.95Å; F143-V147 HydrophobicContact CD2-CG1 4.44Å; F143-V147 HydrophobicContact CD2-CG2 3.75Å; F143-V147 HydrophobicContact CE2-CB 3.9Å; F143-V147 HydrophobicContact CE2-CG1 3.9Å; F143-V147 HydrophobicContact CE2-CG2 4.03Å; F143-V147 HydrophobicContact CZ-CG1 4.45Å; F143-V147 VanDerWaalsContact O-CB 3.31Å; F143-V147 WeakPolarHBondContact O-CB 3.5Å; F143-V147 PolarHBondContact O-N 3.28Å; F143-Q148 HydrophobicContact CE1-CG 4.09Å; F143-Q148 HydrophobicContact CZ-CG 4.26Å; F143-Q148 PolarHBondContact O-N 3.13Å; F143-Y226 HydrophobicContact CE2-CE1 4.3Å; F143-Y226 HydrophobicContact CZ-CE1 4.28Å; F143-C230 HydrophobicContact CD2-CB 3.9Å; F143-C230 HydrophobicContact CE2-CB 3.57Å
144	L	89.2	Confident	89.2	Confident	40 Å²	40	52.7 Å²	52.7	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-46.3	179.5	-66.6	177.2	0	0	0	111.7	V140 D141 Q148 R149 Q150	V140-L144 HydrophobicContact CG1-CD1 4.14Å; V140-L144 HydrophobicContact CG1-CG 4.29Å; V140-L144 WeakPolarHBondContact O-CG 3.49Å; V140-L144 PolarHBondContact O-N 3.39Å; D141-L144 PolarHBondContact O-N 2.85Å; L144-Q148 CarbonylContact O-C 3.38Å; L144-Q148 WeakPolarHBondContact O-CA 3.5Å; L144-Q148 WeakPolarHBondContact O-CB 3.31Å; L144-Q148 PolarHBondContact O-N 3.35Å; L144-R149 PolarHBondContact O-N 3.26Å; L144-Q150 CarbonylContact C-O 3.33Å; L144-Q150 PolarHBondContact O-N 3.33Å
145	I	86.3	Confident	89	Confident	51 Å²	51	55.5 Å²	55.5	26%	0.262	27%	0.274	S	S	.	.	H	α-helix	trans	-67.9	-45.1	-179.7	-67.3	170.8	0	0	0	111.7	D141 F143 R149 Q150 D151	D141-I145 WeakPolarHBondContact O-CG1 3.47Å; D141-I145 PolarHBondContact O-N 2.98Å; D141-I145 WeakPolarHBondContact OD2-CD1 3.43Å; F143-I145 PolarHBondContact O-N 2.99Å; I145-R149 VanDerWaalsContact O-CA 3.29Å; I145-R149 WeakPolarHBondContact O-CA 3.34Å; I145-R149 PolarHBondContact O-N 2.8Å; I145-Q150 PolarHBondContact N-O 3.38Å; I145-D151 HydrophobicContact CG1-CB 4.35Å
146	I	82.5	Confident	89.1	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	30%	0.3	C	S	.	.	H	α-helix	trans	-83.6	-44.3	-170.5	-62.9	170.4	0	0	0	112.1	R142 F143 I231 I286	R142-I146 VanDerWaalsContact O-CB 3.31Å; R142-I146 WeakPolarHBondContact O-CB 3.03Å; R142-I146 VanDerWaalsContact O-CG1 3.27Å; R142-I146 WeakPolarHBondContact O-CG1 3.35Å; R142-I146 PolarHBondContact O-N 3.23Å; F143-I146 PolarHBondContact O-N 3.33Å; I146-I231 HydrophobicContact CB-CG1 4.4Å; I146-I231 HydrophobicContact CD1-CD1 4.4Å; I146-I231 HydrophobicContact CD1-CG2 4.35Å; I146-I231 HydrophobicContact CG2-CG1 4.42Å; I146-I231 HydrophobicContact CG2-CG2 4.15Å; I146-I286 HydrophobicContact CD1-CD1 4.1Å
147	V	84	Confident	89.2	Confident	40 Å²	40	65.6 Å²	65.6	24%	0.242	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-50	-173.4	-178.5	0	0	0	0	110.3	F143 C230 I231	F143-V147 HydrophobicContact CD2-CB 3.95Å; F143-V147 HydrophobicContact CD2-CG1 4.44Å; F143-V147 HydrophobicContact CD2-CG2 3.75Å; F143-V147 HydrophobicContact CE2-CB 3.9Å; F143-V147 HydrophobicContact CE2-CG1 3.9Å; F143-V147 HydrophobicContact CE2-CG2 4.03Å; F143-V147 HydrophobicContact CZ-CG1 4.45Å; F143-V147 VanDerWaalsContact O-CB 3.31Å; F143-V147 WeakPolarHBondContact O-CB 3.5Å; F143-V147 PolarHBondContact O-N 3.28Å; V147-C230 HydrophobicContact CG1-CB 4.5Å; V147-C230 HydrophobicContact CG2-CB 4.16Å; V147-I231 HydrophobicContact CG2-CB 4.4Å; V147-I231 HydrophobicContact CG2-CG1 3.75Å
148	Q	84.1	Confident	89.2	Confident	90 Å²	90	64.2 Å²	64.2	42%	0.421	31%	0.306	S	S	.	.	S	Bend	trans	-89.9	-9.9	-176.5	-58.2	-170.2	-10.8	0	0	113.6	F143 L144 Q150	F143-Q148 HydrophobicContact CE1-CG 4.09Å; F143-Q148 HydrophobicContact CZ-CG 4.26Å; F143-Q148 PolarHBondContact O-N 3.13Å; L144-Q148 CarbonylContact O-C 3.38Å; L144-Q148 WeakPolarHBondContact O-CA 3.5Å; L144-Q148 WeakPolarHBondContact O-CB 3.31Å; L144-Q148 PolarHBondContact O-N 3.35Å; Q148-Q150 HydrophobicContact CB-CB 4.47Å; Q148-Q150 HydrophobicContact CB-CG 4.06Å; Q148-Q150 PolarHBondContact O-N 2.84Å
149	R	85.1	Confident	89.4	Confident	196 Å²	196	70.2 Å²	70.2	74%	0.74	33%	0.332	S	S	*	.			trans	56.6	31.8	-175	-56.5	179.1	-177.8	157	-1.2	113.1	L144 I145	L144-R149 PolarHBondContact O-N 3.26Å; I145-R149 VanDerWaalsContact O-CA 3.29Å; I145-R149 WeakPolarHBondContact O-CA 3.34Å; I145-R149 PolarHBondContact O-N 2.8Å
150	Q	85.4	Confident	89.8	Confident	67 Å²	67	73.7 Å²	73.7	31%	0.313	35%	0.353	S	S	.	.			trans	-106.6	110.8	178.8	-65.3	-176	7.6	0	0	109.6	L144 I145 Q148 K152	L144-Q150 CarbonylContact C-O 3.33Å; L144-Q150 PolarHBondContact O-N 3.33Å; I145-Q150 PolarHBondContact N-O 3.38Å; Q148-Q150 HydrophobicContact CB-CB 4.47Å; Q148-Q150 HydrophobicContact CB-CG 4.06Å; Q148-Q150 PolarHBondContact O-N 2.84Å; Q150-K152 HydrophobicContact CB-CD 4.32Å; Q150-K152 HydrophobicContact CB-CG 4.34Å
151	D	86	Confident	90	Very high	125 Å²	125	74.9 Å²	74.9	67%	0.668	36%	0.357	S	S	*	.			trans	-98.5	91.3	170.5	-167.6	-4.3	0	0	0	109.2	I145	I145-D151 HydrophobicContact CG1-CB 4.35Å
152	K	86.3	Confident	90.3	Very high	107 Å²	107	75.4 Å²	75.4	47%	0.465	36%	0.359	S	S	.	.			trans	-109.8	-8.8	-172.9	-76.8	178.5	173.8	173.4	0	113.1	Q150 T154 R157	Q150-K152 HydrophobicContact CB-CD 4.32Å; Q150-K152 HydrophobicContact CB-CG 4.34Å; K152-T154 PolarHBondContact O-N 3.1Å; K152-R157 VanDerWaalsContact O-CD 3.24Å; K152-R157 WeakPolarHBondContact O-CD 3.44Å; K152-R157 PolarHBondContact O-NH1 3.48Å
153	L	91	Very high	90.8	Very high	28 Å²	28	74.7 Å²	74.7	15%	0.147	37%	0.368	C	S	.	.			trans	-88.6	93.3	-171.1	-172.5	69.4	0	0	0	110.6	A78 L82 D141 A158 L161	A78-L153 HydrophobicContact CB-CD2 4.06Å; A78-L153 HydrophobicContact CB-CG 3.86Å; A78-L153 WeakPolarHBondContact CB-O 3.43Å; L82-L153 HydrophobicContact CD1-CD2 3.9Å; D141-L153 HydrophobicContact CB-CD2 4.02Å; D141-L153 WeakPolarHBondContact OD1-CB 3.47Å; D141-L153 WeakPolarHBondContact OD1-CD2 3.31Å; L153-A158 HydrophobicContact CD1-CB 4.26Å; L153-L161 HydrophobicContact CD1-CD1 3.91Å
154	T	93.6	Very high	91.3	Very high	64 Å²	64	75.6 Å²	75.6	39%	0.393	38%	0.384	S	S	.	.			trans	-86.6	158.4	173.3	67.4	0	0	0	0	111.2	K152 H156 R157 A158	K152-T154 PolarHBondContact O-N 3.1Å; T154-H156 PolarHBondContact O-N 3.43Å; T154-R157 PolarHBondContact O-N 3Å; T154-R157 VanDerWaalsContact O-N 3.12Å; T154-R157 WeakPolarHBondContact OG1-CG 3.25Å; T154-R157 PolarHBondContact OG1-N 3.01Å; T154-A158 PolarHBondContact O-N 3.45Å
155	P	92.3	Very high	91.7	Very high	60 Å²	60	74 Å²	74	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-57.2	-34.5	176.2	-26.3	34.8	0	0	0	113.4	A78 L81 K159	A78-P155 HydrophobicContact CB-CG 4.46Å; L81-P155 HydrophobicContact CD1-CB 4.19Å; P155-K159 WeakPolarHBondContact O-CG 3.33Å; P155-K159 PolarHBondContact O-N 2.96Å; P155-K159 VanDerWaalsContact O-N 3.09Å
156	H	94.4	Very high	92.3	Very high	136 Å²	136	74.8 Å²	74.8	63%	0.63	38%	0.376	S	S	*	.	H	α-helix	trans	-64	-50.2	174.4	-179.2	-83.1	0	0	0	111.5	T154 A158 K159 V160	T154-H156 PolarHBondContact O-N 3.43Å; H156-A158 VanDerWaalsContact C-N 3.29Å; H156-A158 PolarHBondContact O-N 2.99Å; H156-K159 PolarHBondContact O-N 3.42Å; H156-V160 PolarHBondContact O-N 2.93Å; H156-V160 VanDerWaalsContact O-N 3.1Å
157	R	95.5	Very high	93	Very high	133 Å²	133	77.7 Å²	77.7	50%	0.502	40%	0.395	S	S	.	.	H	α-helix	trans	-60.6	-39.5	177	-74.5	177.9	173	-178.7	-2.6	111.9	K152 T154 K159 V160 L161	K152-R157 VanDerWaalsContact O-CD 3.24Å; K152-R157 WeakPolarHBondContact O-CD 3.44Å; K152-R157 PolarHBondContact O-NH1 3.48Å; T154-R157 PolarHBondContact O-N 3Å; T154-R157 VanDerWaalsContact O-N 3.12Å; T154-R157 WeakPolarHBondContact OG1-CG 3.25Å; T154-R157 PolarHBondContact OG1-N 3.01Å; R157-K159 PolarHBondContact O-N 3.18Å; R157-V160 PolarHBondContact O-N 2.96Å; R157-L161 WeakPolarHBondContact O-CG 3.43Å; R157-L161 PolarHBondContact O-N 3.34Å
158	A	96.1	Very high	93.6	Very high	0 Å²	0	80.8 Å²	80.8	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-60	-44.3	174.9	0	0	0	0	0	112.1	A78 L153 T154 H156 V160 L161 I162	A78-A158 HydrophobicContact CB-CB 3.94Å; L153-A158 HydrophobicContact CD1-CB 4.26Å; T154-A158 PolarHBondContact O-N 3.45Å; H156-A158 VanDerWaalsContact C-N 3.29Å; H156-A158 PolarHBondContact O-N 2.99Å; A158-V160 VanDerWaalsContact C-N 3.34Å; A158-V160 PolarHBondContact O-N 3.47Å; A158-L161 PolarHBondContact O-N 3.28Å; A158-I162 WeakPolarHBondContact O-CB 3.45Å; A158-I162 WeakPolarHBondContact O-CD1 3.32Å; A158-I162 WeakPolarHBondContact O-CG1 3.24Å; A158-I162 PolarHBondContact O-N 2.69Å
159	K	95.8	Very high	94.3	Very high	134 Å²	134	76.6 Å²	76.6	58%	0.583	39%	0.391	S	S	*	.	H	α-helix	trans	-60.7	-41.6	175.6	-70.8	175.9	-175.6	-176.3	0	112.7	L81 P155 H156 R157 I162 A163	L81-K159 HydrophobicContact CD1-CG 4.29Å; P155-K159 WeakPolarHBondContact O-CG 3.33Å; P155-K159 PolarHBondContact O-N 2.96Å; P155-K159 VanDerWaalsContact O-N 3.09Å; H156-K159 PolarHBondContact O-N 3.42Å; R157-K159 PolarHBondContact O-N 3.18Å; K159-I162 PolarHBondContact O-N 3.37Å; K159-A163 WeakPolarHBondContact O-CB 3.02Å; K159-A163 PolarHBondContact O-N 2.95Å
160	V	97.5	Very high	94.8	Very high	86 Å²	86	70.8 Å²	70.8	52%	0.521	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-44.6	176.5	175.1	0	0	0	0	110.9	H156 R157 A158 I162 A163 G164	H156-V160 PolarHBondContact O-N 2.93Å; H156-V160 VanDerWaalsContact O-N 3.1Å; R157-V160 PolarHBondContact O-N 2.96Å; A158-V160 VanDerWaalsContact C-N 3.34Å; A158-V160 PolarHBondContact O-N 3.47Å; V160-I162 PolarHBondContact O-N 3.45Å; V160-A163 PolarHBondContact O-N 3.42Å; V160-G164 PolarHBondContact O-N 2.92Å
161	L	97.4	Very high	95.3	Very high	79 Å²	79	71.2 Å²	71.2	41%	0.414	38%	0.384	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.5	-71.3	172.9	0	0	0	112.1	I137 L153 R157 A158 G164 S165	I137-L161 HydrophobicContact CD1-CB 4.08Å; I137-L161 HydrophobicContact CG2-CD1 4.06Å; L153-L161 HydrophobicContact CD1-CD1 3.91Å; R157-L161 WeakPolarHBondContact O-CG 3.43Å; R157-L161 PolarHBondContact O-N 3.34Å; A158-L161 PolarHBondContact O-N 3.28Å; L161-G164 PolarHBondContact O-N 3.26Å; L161-S165 PolarHBondContact O-N 3.06Å; L161-S165 PolarHBondContact O-OG 2.74Å
162	I	98	Very high	95.7	Very high	22 Å²	22	66.5 Å²	66.5	11%	0.113	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-50.9	174.2	-70	160.4	0	0	0	110.1	L81 L82 T85 I134 A158 K159 V160 G164 S165 W166	L81-I162 HydrophobicContact CB-CD1 4.34Å; L82-I162 HydrophobicContact CD2-CD1 4.02Å; L82-I162 HydrophobicContact CD2-CG1 3.8Å; T85-I162 HydrophobicContact CG2-CG2 3.94Å; T85-I162 WeakPolarHBondContact OG1-CD1 3.48Å; I134-I162 HydrophobicContact CD1-CG1 4.04Å; A158-I162 WeakPolarHBondContact O-CB 3.45Å; A158-I162 WeakPolarHBondContact O-CD1 3.32Å; A158-I162 WeakPolarHBondContact O-CG1 3.24Å; A158-I162 PolarHBondContact O-N 2.69Å; K159-I162 PolarHBondContact O-N 3.37Å; V160-I162 PolarHBondContact O-N 3.45Å; I162-G164 VanDerWaalsContact C-N 3.26Å; I162-G164 PolarHBondContact O-N 3.17Å; I162-S165 WeakPolarHBondContact CA-OG 3.46Å; I162-S165 PolarHBondContact O-N 3.13Å; I162-S165 VanDerWaalsContact O-N 3.1Å; I162-S165 PolarHBondContact O-OG 2.83Å; I162-W166 VanDerWaalsContact O-CD1 3.25Å; I162-W166 PolarHBondContact O-N 3.27Å
163	A	98	Very high	96.1	Very high	56 Å²	56	61.4 Å²	61.4	46%	0.463	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-41.7	179.2	0	0	0	0	0	111.6	K159 V160 W166 V167	K159-A163 WeakPolarHBondContact O-CB 3.02Å; K159-A163 PolarHBondContact O-N 2.95Å; V160-A163 PolarHBondContact O-N 3.42Å; A163-W166 PolarHBondContact O-N 2.93Å; A163-V167 WeakPolarHBondContact O-CG2 3.39Å; A163-V167 PolarHBondContact O-N 3.26Å
164	G	98.2	Very high	96	Very high	42 Å²	42	63.2 Å²	63.2	43%	0.433	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-39.9	174.4	0	0	0	0	0	113.6	V160 L161 I162 V167 L168	V160-G164 PolarHBondContact O-N 2.92Å; L161-G164 PolarHBondContact O-N 3.26Å; I162-G164 VanDerWaalsContact C-N 3.26Å; I162-G164 PolarHBondContact O-N 3.17Å; G164-V167 PolarHBondContact O-N 3.28Å; G164-L168 WeakPolarHBondContact O-CB 3.25Å; G164-L168 PolarHBondContact O-N 3.36Å
165	S	98	Very high	95.8	Very high	8 Å²	8	63.2 Å²	63.2	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-68.6	-36.2	178.6	66	0	0	0	0	112.6	E130 L161 I162 L168 S169	E130-S165 VanDerWaalsContact CD-OG 3.28Å; E130-S165 PolarHBondContact OE1-OG 3.47Å; E130-S165 VanDerWaalsContact OE1-OG 3.08Å; E130-S165 WeakPolarHBondContact OE2-CB 3.41Å; E130-S165 PolarHBondContact OE2-OG 3.43Å; L161-S165 PolarHBondContact O-N 3.06Å; L161-S165 PolarHBondContact O-OG 2.74Å; I162-S165 WeakPolarHBondContact CA-OG 3.46Å; I162-S165 PolarHBondContact O-N 3.13Å; I162-S165 VanDerWaalsContact O-N 3.1Å; I162-S165 PolarHBondContact O-OG 2.83Å; S165-L168 PolarHBondContact O-N 2.91Å; S165-S169 VanDerWaalsContact O-CB 3.23Å; S165-S169 WeakPolarHBondContact O-CB 3.37Å; S165-S169 PolarHBondContact O-N 3.2Å; S165-S169 PolarHBondContact O-OG 3.42Å
166	W	98.1	Very high	95.3	Very high	67 Å²	67	60.9 Å²	60.9	25%	0.254	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-47.3	173.1	-85.2	95.4	0	0	0	111.9	F88 L126 F127 E130 I162 A163 S169 L170	F88-W166 HydrophobicContact CD1-CH2 4.04Å; F88-W166 AromaticContact CD1-CZ2 3.75Å; F88-W166 HydrophobicContact CD1-CZ2 3.75Å; F88-W166 AromaticContact CE1-CH2 3.8Å; F88-W166 HydrophobicContact CE1-CH2 3.8Å; F88-W166 AromaticContact CE1-CZ2 3.83Å; F88-W166 HydrophobicContact CE1-CZ2 3.83Å; L126-W166 HydrophobicContact CD1-CE3 4.27Å; L126-W166 HydrophobicContact CD1-CZ3 4.29Å; L126-W166 HydrophobicContact CD2-CZ3 4.32Å; L126-W166 HydrophobicContact CG-CZ3 4.2Å; F127-W166 AromaticContact CD1-CH2 3.86Å; F127-W166 HydrophobicContact CD1-CH2 3.86Å; F127-W166 HydrophobicContact CD1-CZ3 4.17Å; F127-W166 AromaticContact CE1-CH2 3.83Å; F127-W166 HydrophobicContact CE1-CH2 3.83Å; F127-W166 AromaticContact CE1-CZ3 4Å; F127-W166 HydrophobicContact CE1-CZ3 4Å; E130-W166 HydrophobicContact CG-CD2 4.25Å; E130-W166 HydrophobicContact CG-CH2 4.26Å; E130-W166 HydrophobicContact CG-CZ2 3.75Å; E130-W166 VanDerWaalsContact OE1-CD1 3.32Å; E130-W166 PolarHBondContact OE1-NE1 3.08Å; E130-W166 PolarHBondContact OE2-N 2.86Å; I162-W166 VanDerWaalsContact O-CD1 3.25Å; I162-W166 PolarHBondContact O-N 3.27Å; A163-W166 PolarHBondContact O-N 2.93Å; W166-S169 PolarHBondContact O-N 3.39Å; W166-L170 VanDerWaalsContact O-CB 3.3Å; W166-L170 WeakPolarHBondContact O-CB 3.49Å; W166-L170 PolarHBondContact O-N 2.85Å
167	V	98.2	Very high	94.6	Very high	92 Å²	92	57.3 Å²	57.3	56%	0.558	32%	0.32	S	S	*	.	H	α-helix	trans	-61.3	-47.6	178.1	172.8	0	0	0	0	110.3	A163 G164 S169 L170 C171	A163-V167 WeakPolarHBondContact O-CG2 3.39Å; A163-V167 PolarHBondContact O-N 3.26Å; G164-V167 PolarHBondContact O-N 3.28Å; V167-S169 PolarHBondContact O-N 3.45Å; V167-L170 PolarHBondContact O-N 3.41Å; V167-C171 WeakPolarHBondContact O-CB 3.42Å; V167-C171 PolarHBondContact O-N 3.1Å; V167-C171 PolarHBondContact O-SG 3.38Å
168	L	96.9	Very high	93.6	Very high	105 Å²	105	56.7 Å²	56.7	55%	0.55	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-46.2	178.4	-179.2	61.7	0	0	0	111.9	G164 S165 L170 C171 V172	G164-L168 WeakPolarHBondContact O-CB 3.25Å; G164-L168 PolarHBondContact O-N 3.36Å; S165-L168 PolarHBondContact O-N 2.91Å; L168-L170 VanDerWaalsContact C-N 3.33Å; L168-L170 PolarHBondContact O-N 3.44Å; L168-C171 PolarHBondContact O-N 3.16Å; L168-V172 HydrophobicContact CD1-CG2 4.23Å; L168-V172 WeakPolarHBondContact O-CG2 3.25Å; L168-V172 PolarHBondContact O-N 2.95Å
169	S	97.9	Very high	91.8	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.014	35%	0.35	C	S	.	.	H	α-helix	trans	-64	-38.2	179.7	-59.5	0	0	0	0	112	L129 E130 S165 W166 V167 S173	L129-S169 WeakPolarHBondContact CB-OG 3.43Å; E130-S169 PolarHBondContact N-OG 3.43Å; S165-S169 VanDerWaalsContact O-CB 3.23Å; S165-S169 WeakPolarHBondContact O-CB 3.37Å; S165-S169 PolarHBondContact O-N 3.2Å; S165-S169 PolarHBondContact O-OG 3.42Å; W166-S169 PolarHBondContact O-N 3.39Å; V167-S169 PolarHBondContact O-N 3.45Å; S169-S173 VanDerWaalsContact O-CB 3.29Å; S169-S173 WeakPolarHBondContact O-CB 3.24Å; S169-S173 PolarHBondContact O-N 2.93Å; S169-S173 PolarHBondContact O-OG 2.96Å
170	L	96.3	Very high	89.9	Confident	73 Å²	73	61.8 Å²	61.8	38%	0.382	36%	0.359	S	S	.	.	H	α-helix	trans	-63.6	-51.9	172.2	-174.4	63.9	0	0	0	110.7	L126 W166 V167 L168 V172 S173 L174	L126-L170 HydrophobicContact CD1-CB 4.12Å; L126-L170 HydrophobicContact CD1-CD1 4.41Å; L126-L170 HydrophobicContact CD2-CD1 4.47Å; W166-L170 VanDerWaalsContact O-CB 3.3Å; W166-L170 WeakPolarHBondContact O-CB 3.49Å; W166-L170 PolarHBondContact O-N 2.85Å; V167-L170 PolarHBondContact O-N 3.41Å; L168-L170 VanDerWaalsContact C-N 3.33Å; L168-L170 PolarHBondContact O-N 3.44Å; L170-V172 VanDerWaalsContact C-N 3.26Å; L170-V172 PolarHBondContact O-N 3.22Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-S173 VanDerWaalsContact O-N 3.12Å; L170-S173 PolarHBondContact O-OG 3.43Å; L170-L174 HydrophobicContact CD1-CD1 4.36Å; L170-L174 HydrophobicContact CD1-CD2 4.05Å; L170-L174 HydrophobicContact CD1-CG 3.93Å; L170-L174 HydrophobicContact CG-CD1 3.91Å; L170-L174 HydrophobicContact CG-CD2 4.49Å; L170-L174 HydrophobicContact CG-CG 3.98Å; L170-L174 WeakPolarHBondContact O-CB 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.82Å
171	C	95.4	Very high	88	Confident	77 Å²	77	58.8 Å²	58.8	52%	0.52	34%	0.338	S	S	.	.	H	α-helix	trans	-54.8	-41.2	178.3	-70.5	0	0	0	0	112.8	V167 L168 P175	V167-C171 WeakPolarHBondContact O-CB 3.42Å; V167-C171 PolarHBondContact O-N 3.1Å; V167-C171 PolarHBondContact O-SG 3.38Å; L168-C171 PolarHBondContact O-N 3.16Å; C171-P175 WeakPolarHBondContact O-CD 3.31Å
172	V	94.4	Very high	85.7	Confident	26 Å²	26	61.5 Å²	61.5	16%	0.158	36%	0.358	C	S	.	.	H	α-helix	trans	-75.7	-32.3	179.9	175.5	0	0	0	0	112.3	L129 L168 L170 P175 Y208 L212	L129-V172 HydrophobicContact CD1-CB 3.81Å; L129-V172 HydrophobicContact CD1-CG1 3.58Å; L129-V172 HydrophobicContact CD2-CG1 4.33Å; L168-V172 HydrophobicContact CD1-CG2 4.23Å; L168-V172 WeakPolarHBondContact O-CG2 3.25Å; L168-V172 PolarHBondContact O-N 2.95Å; L170-V172 VanDerWaalsContact C-N 3.26Å; L170-V172 PolarHBondContact O-N 3.22Å; V172-P175 WeakPolarHBondContact O-CD 3.45Å; V172-Y208 WeakPolarHBondContact O-CE2 3.27Å; V172-Y208 PolarHBondContact O-OH 2.95Å; V172-L212 HydrophobicContact CG1-CD2 4Å
173	S	94.1	Very high	83.3	Confident	0 Å²	0	63 Å²	63	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-87.1	-26.6	-177.6	56.1	0	0	0	0	114.5	M122 S169 L170 S176 Y208	M122-S173 WeakPolarHBondContact CG-O 3.46Å; S169-S173 VanDerWaalsContact O-CB 3.29Å; S169-S173 WeakPolarHBondContact O-CB 3.24Å; S169-S173 PolarHBondContact O-N 2.93Å; S169-S173 PolarHBondContact O-OG 2.96Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-S173 VanDerWaalsContact O-N 3.12Å; L170-S173 PolarHBondContact O-OG 3.43Å; S173-S176 VanDerWaalsContact O-CB 3.31Å; S173-S176 WeakPolarHBondContact O-CB 3.37Å; S173-S176 PolarHBondContact O-N 2.87Å; S173-S176 VanDerWaalsContact O-N 3.13Å; S173-S176 PolarHBondContact O-OG 2.79Å; S173-Y208 PolarHBondContact O-OH 3.35Å
174	L	90.8	Very high	80.5	Confident	66 Å²	66	64.8 Å²	64.8	35%	0.346	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-38.2	-179.2	-85	172.7	0	0	0	115.7	M122 L170 S176 V177 V178	M122-L174 HydrophobicContact SD-CD2 4.22Å; L170-L174 HydrophobicContact CD1-CD1 4.36Å; L170-L174 HydrophobicContact CD1-CD2 4.05Å; L170-L174 HydrophobicContact CD1-CG 3.93Å; L170-L174 HydrophobicContact CG-CD1 3.91Å; L170-L174 HydrophobicContact CG-CD2 4.49Å; L170-L174 HydrophobicContact CG-CG 3.98Å; L170-L174 WeakPolarHBondContact O-CB 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.82Å; L174-S176 PolarHBondContact O-N 3.47Å; L174-V177 PolarHBondContact O-N 3.08Å; L174-V178 PolarHBondContact O-N 3.3Å
175	P	88.1	Confident	77.9	Confident	63 Å²	63	65.5 Å²	65.5	41%	0.409	40%	0.396	S	S	.	.	H	α-helix	trans	-55.4	-23	178.2	-27.6	36.3	0	0	0	114.1	C171 V172 V177 Y208	C171-P175 WeakPolarHBondContact O-CD 3.31Å; V172-P175 WeakPolarHBondContact O-CD 3.45Å; P175-V177 PolarHBondContact O-N 3.47Å; P175-Y208 HydrophobicContact CB-CD2 4.14Å; P175-Y208 HydrophobicContact CB-CE2 3.76Å; P175-Y208 HydrophobicContact CG-CD2 4.46Å; P175-Y208 HydrophobicContact CG-CE2 3.94Å
176	S	81.6	Confident	75.4	Confident	11 Å²	11	65.7 Å²	65.7	8%	0.077	40%	0.399	C	S	.	.	H	α-helix	trans	-60.7	-27.4	175.2	-44.6	0	0	0	0	113.8	S173 L174 Y208	S173-S176 VanDerWaalsContact O-CB 3.31Å; S173-S176 WeakPolarHBondContact O-CB 3.37Å; S173-S176 PolarHBondContact O-N 2.87Å; S173-S176 VanDerWaalsContact O-N 3.13Å; S173-S176 PolarHBondContact O-OG 2.79Å; L174-S176 PolarHBondContact O-N 3.47Å; S176-Y208 PolarHBondContact OG-OH 3.46Å
177	V	81	Confident	73.2	Confident	61 Å²	61	64 Å²	64	37%	0.37	39%	0.394	S	S	.	.	H	α-helix	trans	-104.7	-36.8	-178.7	-168	0	0	0	0	112.2	M122 L174 P175 G179	M122-V177 HydrophobicContact CB-CG2 3.37Å; M122-V177 HydrophobicContact CG-CG2 3.65Å; M122-V177 HydrophobicContact SD-CG2 3.44Å; M122-V177 WeakPolarHBondContact SD-CG2 3.46Å; L174-V177 PolarHBondContact O-N 3.08Å; P175-V177 PolarHBondContact O-N 3.47Å; V177-G179 PolarHBondContact O-N 3.3Å
178	V	73.6	Confident	70.9	Confident	120 Å²	120	61 Å²	61	73%	0.727	38%	0.383	S	S	*	.	H	α-helix	trans	-71	-14.4	-173	179.7	0	0	0	0	112.9	L174	L174-V178 PolarHBondContact O-N 3.3Å
179	G	59.1	Low	68.7	Low	39 Å²	39	56.4 Å²	56.4	40%	0.402	36%	0.36	S	S	.	.			trans	73.8	90.7	151.5	0	0	0	0	0	116.4	V177	V177-G179 PolarHBondContact O-N 3.3Å
180	W	54.4	Low	66.7	Low	202 Å²	202	63.5 Å²	63.5	77%	0.765	40%	0.404	S	S	*	.	S	Bend	trans	-94.4	-10.3	150.5	-171.3	-94.9	0	0	0	112.2	T182	W180-T182 PolarHBondContact O-N 3.28Å
181	R	57.4	Low	65.2	Low	23 Å²	23	63 Å²	63	9%	0.087	40%	0.397	C	S	.	.			trans	-89.3	82.5	-177.1	-64.6	-168.5	-175	-162	1.6	112.1	G186 I187 D205	R181-G186 PolarHBondContact NH1-O 2.89Å; R181-I187 HydrophobicContact CB-CD1 3.99Å; R181-I187 HydrophobicContact CB-CG1 4.19Å; R181-D205 WeakPolarHBondContact CD-OD1 3.39Å; R181-D205 WeakPolarHBondContact CG-OD1 3.38Å; R181-D205 WeakPolarHBondContact CG-OD2 3.37Å; R181-D205 IonicContact CZ-OD1 3.61Å; R181-D205 IonicContact NE-OD1 3.53Å; R181-D205 PolarHBondContact NE-OD1 3.35Å; R181-D205 IonicContact NE-OD2 2.74Å; R181-D205 PolarHBondContact NE-OD2 3.4Å; R181-D205 PolarHBondContact NH2-O 2.87Å; R181-D205 IonicContact NH2-OD1 3.22Å
182	T	49.6	Very low	64	Low	136 Å²	136	59.6 Å²	59.6	83%	0.834	37%	0.374	S	S	*	.			trans	-99.4	109.5	167.1	44.8	0	0	0	0	109.6	W180	W180-T182 PolarHBondContact O-N 3.28Å
183	G	47.7	Very low	63.1	Low	53 Å²	53	59.4 Å²	59.4	55%	0.546	37%	0.374	S	S	.	.	S	Bend	trans	160.8	146.5	172.4	0	0	0	0	0	113.4	A185 G186	G183-A185 PolarHBondContact O-N 3.23Å; G183-G186 PolarHBondContact O-N 2.99Å
184	A	40.6	Very low	62.5	Low	95 Å²	95	59.9 Å²	59.9	79%	0.785	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-12.8	178.2	0	0	0	0	0	114.2
185	A	41.8	Very low	62.3	Low	57 Å²	57	57.8 Å²	57.8	47%	0.471	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-8	177.6	0	0	0	0	0	114.6	G183	G183-A185 PolarHBondContact O-N 3.23Å
186	G	47.3	Very low	62.2	Low	12 Å²	12	56 Å²	56	12%	0.124	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-25.1	-163.5	0	0	0	0	0	116.9	R181 G183	R181-G186 PolarHBondContact NH1-O 2.89Å; G183-G186 PolarHBondContact O-N 2.99Å
187	I	50.7	Low	62.4	Low	30 Å²	30	56.3 Å²	56.3	15%	0.154	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-152.1	114	-175.4	-57.8	-177.3	0	0	0	108.3	C117 R118 I121 R181	C117-I187 HydrophobicContact CB-CG2 4.24Å; C117-I187 WeakPolarHBondContact SG-CG2 3.29Å; R118-I187 HydrophobicContact CG-CD1 3.5Å; R118-I187 VanDerWaalsContact CG-CD1 3.5Å; R118-I187 HydrophobicContact CG-CG2 4.49Å; I121-I187 HydrophobicContact CD1-CG2 4.08Å; R181-I187 HydrophobicContact CB-CD1 3.99Å; R181-I187 HydrophobicContact CB-CG1 4.19Å
188	G	51.1	Low	62.4	Low	31 Å²	31	53.4 Å²	53.4	32%	0.32	34%	0.337	S	S	.	.	S	Bend	trans	65.5	44.4	-176.8	0	0	0	0	0	112.7	T190	G188-T190 PolarHBondContact O-N 3.11Å
189	G	50.8	Low	62.9	Low	7 Å²	7	49.1 Å²	49.1	7%	0.072	31%	0.308	C	S	.	.			trans	-50.1	140.1	175.9	0	0	0	0	0	110.4	W191 A192	G189-W191 PolarHBondContact O-N 3.16Å; G189-A192 PolarHBondContact O-N 2.65Å; G189-A192 VanDerWaalsContact O-N 3.16Å
190	T	54	Low	64	Low	152 Å²	152	48 Å²	48	93%	0.933	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-15.7	-176.8	49.4	0	0	0	0	114.6	G188	G188-T190 PolarHBondContact O-N 3.11Å
191	W	65.3	Low	65.4	Low	61 Å²	61	43.5 Å²	43.5	23%	0.231	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-27.7	-175.8	-179.8	87.7	0	0	0	114.9	G189 Y314 Y315 S316 F319	G189-W191 PolarHBondContact O-N 3.16Å; W191-Y314 WeakPolarHBondContact CH2-O 3.12Å; W191-Y314 WeakPolarHBondContact CZ3-O 3.34Å; W191-Y315 HydrophobicContact CB-CD1 4.09Å; W191-Y315 HydrophobicContact CB-CE1 4.1Å; W191-Y315 AromaticContact CD1-CD1 3.77Å; W191-Y315 HydrophobicContact CD2-CD1 4.05Å; W191-Y315 VanDerWaalsContact CE2-C 3.5Å; W191-Y315 AromaticContact CG-CD1 3.66Å; W191-Y315 HydrophobicContact CG-CD1 3.66Å; W191-Y315 HydrophobicContact CG-CE1 4.18Å; W191-Y315 VanDerWaalsContact CZ2-CA 3.44Å; W191-Y315 WeakPolarHBondContact CZ2-O 3.36Å; W191-Y315 PolarHBondContact NE1-O 3.44Å; W191-S316 WeakPolarHBondContact CH2-O 3.3Å; W191-S316 WeakPolarHBondContact CZ2-O 3.47Å; W191-F319 HydrophobicContact CE3-CD1 4.25Å; W191-F319 HydrophobicContact CH2-CB 3.31Å; W191-F319 AromaticContact CH2-CD1 3.87Å; W191-F319 HydrophobicContact CH2-CD1 3.87Å; W191-F319 AromaticContact CH2-CG 3.89Å; W191-F319 HydrophobicContact CH2-CG 3.89Å; W191-F319 HydrophobicContact CZ3-CB 3.63Å; W191-F319 AromaticContact CZ3-CD1 3.21Å; W191-F319 HydrophobicContact CZ3-CD1 3.21Å; W191-F319 AromaticContact CZ3-CE1 3.97Å; W191-F319 HydrophobicContact CZ3-CE1 3.97Å; W191-F319 AromaticContact CZ3-CG 3.64Å; W191-F319 HydrophobicContact CZ3-CG 3.64Å
192	A	70.2	Confident	66.7	Low	6 Å²	6	44.1 Å²	44.1	5%	0.05	29%	0.29	C	S	.	.	S	Bend	trans	-128.1	129.1	176.1	0	0	0	0	0	111	G189 Q194 F319	G189-A192 PolarHBondContact O-N 2.65Å; G189-A192 VanDerWaalsContact O-N 3.16Å; A192-Q194 HydrophobicContact CB-CG 4.06Å; A192-Q194 PolarHBondContact O-N 3.47Å; A192-F319 HydrophobicContact CB-CD1 4.04Å; A192-F319 HydrophobicContact CB-CE1 3.95Å
193	P	76	Confident	68.5	Low	22 Å²	22	44.2 Å²	44.2	14%	0.143	28%	0.282	C	S	.	.	S	Bend	trans	-79	65.9	179.8	32.2	-33	0	0	0	109.9	T104 A108 Y320	T104-P193 WeakPolarHBondContact CG2-O 3.23Å; A108-P193 HydrophobicContact CB-CG 4.43Å; A108-P193 WeakPolarHBondContact O-CB 3.43Å; A108-P193 WeakPolarHBondContact O-CG 2.95Å; P193-Y320 HydrophobicContact CG-CD2 4.05Å; P193-Y320 HydrophobicContact CG-CE1 4.25Å; P193-Y320 HydrophobicContact CG-CE2 3.51Å
194	Q	82.4	Confident	70.3	Confident	10 Å²	10	44.5 Å²	44.5	5%	0.047	28%	0.279	C	S	.	.	S	Bend	trans	-156.9	145.5	175.8	56.6	178	-24.7	0	0	111.5	A192 V196 Y320 S323	A192-Q194 HydrophobicContact CB-CG 4.06Å; A192-Q194 PolarHBondContact O-N 3.47Å; Q194-V196 HydrophobicContact CB-CG1 4.28Å; Q194-V196 HydrophobicContact CG-CG1 3.95Å; Q194-V196 HydrophobicContact CG-CG2 3.98Å; Q194-V196 PolarHBondContact O-N 3.22Å; Q194-Y320 HydrophobicContact CB-CE2 4.44Å; Q194-Y320 HydrophobicContact CG-CD2 4.31Å; Q194-S323 VanDerWaalsContact NE2-CB 3.33Å; Q194-S323 PolarHBondContact NE2-OG 2.87Å; Q194-S323 VanDerWaalsContact NE2-OG 3.15Å; Q194-S323 PolarHBondContact OE1-OG 3.36Å
195	C	85.9	Confident	72.3	Confident	23 Å²	23	40.7 Å²	40.7	16%	0.155	25%	0.246	C	C	.	.			trans	-85.6	93.9	174.2	177	0	0	0	0	110.6	W110 C117 S120 I121	W110-C195 HydrophobicContact CD2-CB 3.67Å; W110-C195 HydrophobicContact CE3-CB 3.57Å; W110-C195 HydrophobicContact CG-CB 4.48Å; W110-C195 HydrophobicContact CH2-CB 3.54Å; W110-C195 HydrophobicContact CZ2-CB 3.63Å; W110-C195 HydrophobicContact CZ3-CB 3.52Å; C117-C195 WeakPolarHBondContact CA-SG 3.48Å; C117-C195 HydrophobicContact CB-CB 3.99Å; C117-C195 WeakPolarHBondContact CB-SG 3.47Å; C117-C195 PolarHBondContact O-SG 3.05Å; C117-C195 VanDerWaalsContact SG-CA 3.55Å; C117-C195 WeakPolarHBondContact SG-CB 3.19Å; C117-C195 CovalentContact SG-SG 2.02Å; C117-C195 PolarHBondContact SG-SG 3Å; S120-C195 PolarHBondContact OG-SG 3.36Å; S120-C195 VanDerWaalsContact OG-SG 3.39Å; I121-C195 VanDerWaalsContact CG1-SG 3.58Å
196	V	85.9	Confident	74.6	Confident	25 Å²	25	39.9 Å²	39.9	15%	0.152	23%	0.231	C	C	.	.	S	Bend	trans	-137.2	162.9	-179.7	-61.3	0	0	0	0	111.7	Q194 G198 F319	Q194-V196 HydrophobicContact CB-CG1 4.28Å; Q194-V196 HydrophobicContact CG-CG1 3.95Å; Q194-V196 HydrophobicContact CG-CG2 3.98Å; Q194-V196 PolarHBondContact O-N 3.22Å; V196-G198 PolarHBondContact O-N 2.87Å; V196-F319 HydrophobicContact CG2-CE1 4.4Å; V196-F319 HydrophobicContact CG2-CZ 4.13Å
197	L	85.4	Confident	76.7	Confident	17 Å²	17	41.3 Å²	41.3	9%	0.089	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-71	97.2	167.9	-63.3	173.8	0	0	0	108.5	I121 W125 Y208 L212	I121-L197 HydrophobicContact CD1-CD2 4.46Å; I121-L197 HydrophobicContact CG2-CD2 4.08Å; I121-L197 HydrophobicContact CG2-CG 4.29Å; W125-L197 HydrophobicContact CZ2-CD1 4.28Å; L197-Y208 HydrophobicContact CD1-CE1 4.42Å; L197-L212 HydrophobicContact CD1-CD1 3.68Å
198	G	81.7	Confident	78.6	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.242	C	C	.	.			trans	-82.7	-173.4	-178.2	0	0	0	0	0	114.3	V196 S200 V308	V196-G198 PolarHBondContact O-N 2.87Å; G198-S200 PolarHBondContact O-N 3.17Å; G198-V308 WeakPolarHBondContact O-CG2 3.49Å
199	Y	83.3	Confident	80.5	Confident	30 Å²	30	39.7 Å²	39.7	12%	0.118	23%	0.228	C	C	.	.			trans	-53.1	134.6	176.4	-177.8	-106.3	0	0	0	112.2	E201 A307 R311 Y314	Y199-E201 HydrophobicContact CE1-CG 3.99Å; Y199-E201 WeakPolarHBondContact CE1-OE1 3.48Å; Y199-E201 VanDerWaalsContact CZ-OE1 3.25Å; Y199-E201 PolarHBondContact OH-OE1 3.18Å; Y199-E201 PolarHBondContact OH-OE2 2.89Å; Y199-A307 VanDerWaalsContact CA-O 3.22Å; Y199-A307 WeakPolarHBondContact CA-O 3.29Å; Y199-A307 PolarHBondContact N-O 3.44Å; Y199-R311 HydrophobicContact CD1-CG 4.45Å; Y199-R311 HydrophobicContact CD2-CB 4.15Å; Y199-R311 HydrophobicContact CE1-CB 4.21Å; Y199-R311 HydrophobicContact CE1-CG 4.09Å; Y199-R311 HydrophobicContact CE2-CB 3.62Å; Y199-R311 HydrophobicContact CE2-CG 4.36Å; Y199-Y314 VanDerWaalsContact CB-CD1 3.42Å
200	S	83.3	Confident	82.6	Confident	15 Å²	15	42.1 Å²	42.1	11%	0.105	24%	0.241	C	C	.	.			trans	-145.7	139.8	172.4	-175.4	0	0	0	0	111.1	G198 S202 D205 R206	G198-S200 PolarHBondContact O-N 3.17Å; S200-S202 WeakPolarHBondContact OG-CB 3.37Å; S200-S202 PolarHBondContact OG-N 3.02Å; S200-S202 VanDerWaalsContact OG-N 3.17Å; S200-D205 WeakPolarHBondContact CB-OD2 3.49Å; S200-D205 VanDerWaalsContact OG-CB 3.31Å; S200-D205 WeakPolarHBondContact OG-CB 3.44Å; S200-D205 PolarHBondContact OG-OD2 3.28Å; S200-R206 PolarHBondContact O-NE 3.49Å; S200-R206 PolarHBondContact O-NH2 3.37Å
201	E	82.4	Confident	84.6	Confident	109 Å²	109	39.1 Å²	39.1	51%	0.509	22%	0.219	S	C	.	.			trans	-84	-16.8	171.1	-62.6	-68.4	-175.8	0	0	112.5	Y199 M203 R206	Y199-E201 HydrophobicContact CE1-CG 3.99Å; Y199-E201 WeakPolarHBondContact CE1-OE1 3.48Å; Y199-E201 VanDerWaalsContact CZ-OE1 3.25Å; Y199-E201 PolarHBondContact OH-OE1 3.18Å; Y199-E201 PolarHBondContact OH-OE2 2.89Å; E201-M203 PolarHBondContact O-N 3.26Å; E201-R206 IonicContact OE2-CZ 3.71Å; E201-R206 IonicContact OE2-NH2 2.79Å; E201-R206 PolarHBondContact OE2-NH2 3.29Å
202	S	84.9	Confident	86	Confident	35 Å²	35	36.2 Å²	36.2	25%	0.245	21%	0.208	C	C	.	.			trans	-68	127.6	-179.1	171.5	0	0	0	0	111	S200 A204 D205 R206	S200-S202 WeakPolarHBondContact OG-CB 3.37Å; S200-S202 PolarHBondContact OG-N 3.02Å; S200-S202 VanDerWaalsContact OG-N 3.17Å; S202-A204 PolarHBondContact O-N 3.46Å; S202-A204 PolarHBondContact OG-N 3.49Å; S202-D205 WeakPolarHBondContact CB-OD2 3.25Å; S202-D205 PolarHBondContact O-N 3.34Å; S202-D205 VanDerWaalsContact O-N 3.13Å; S202-R206 PolarHBondContact O-N 2.95Å
203	M	87.1	Confident	87.2	Confident	139 Å²	139	36.3 Å²	36.3	69%	0.685	21%	0.208	S	C	*	.	H	α-helix	trans	-61.9	-32.4	175.4	-64.9	-59.8	144.1	0	0	112.2	E201 D205 G207	E201-M203 PolarHBondContact O-N 3.26Å; M203-D205 VanDerWaalsContact C-N 3.34Å; M203-G207 PolarHBondContact O-N 3.29Å
204	A	86.3	Confident	88.2	Confident	58 Å²	58	37.9 Å²	37.9	48%	0.479	22%	0.218	S	C	.	.	H	α-helix	trans	-65	-40.1	175.6	0	0	0	0	0	111.5	S202 G207 Y208	S202-A204 PolarHBondContact O-N 3.46Å; S202-A204 PolarHBondContact OG-N 3.49Å; A204-G207 PolarHBondContact O-N 3Å; A204-Y208 WeakPolarHBondContact O-CB 3.44Å; A204-Y208 PolarHBondContact O-N 3.13Å
205	D	83.5	Confident	88.8	Confident	15 Å²	15	38.9 Å²	38.9	8%	0.08	23%	0.228	C	C	.	.	H	α-helix	trans	-70.9	-41.9	179.9	-74.6	-23.9	0	0	0	112.6	R181 S200 S202 M203 Y208 T209	R181-D205 WeakPolarHBondContact CD-OD1 3.39Å; R181-D205 WeakPolarHBondContact CG-OD1 3.38Å; R181-D205 WeakPolarHBondContact CG-OD2 3.37Å; R181-D205 IonicContact CZ-OD1 3.61Å; R181-D205 IonicContact NE-OD1 3.53Å; R181-D205 PolarHBondContact NE-OD1 3.35Å; R181-D205 IonicContact NE-OD2 2.74Å; R181-D205 PolarHBondContact NE-OD2 3.4Å; R181-D205 PolarHBondContact NH2-O 2.87Å; R181-D205 IonicContact NH2-OD1 3.22Å; S200-D205 WeakPolarHBondContact CB-OD2 3.49Å; S200-D205 VanDerWaalsContact OG-CB 3.31Å; S200-D205 WeakPolarHBondContact OG-CB 3.44Å; S200-D205 PolarHBondContact OG-OD2 3.28Å; S202-D205 WeakPolarHBondContact CB-OD2 3.25Å; S202-D205 PolarHBondContact O-N 3.34Å; S202-D205 VanDerWaalsContact O-N 3.13Å; M203-D205 VanDerWaalsContact C-N 3.34Å; D205-Y208 PolarHBondContact O-N 3.05Å; D205-T209 PolarHBondContact O-N 2.93Å; D205-T209 VanDerWaalsContact O-N 3.08Å; D205-T209 PolarHBondContact O-OG1 3.25Å; D205-T209 VanDerWaalsContact O-OG1 3.1Å
206	R	89.2	Confident	89.3	Confident	41 Å²	41	37.9 Å²	37.9	16%	0.155	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-47.4	172.8	-67.8	-177	174.2	168.6	7.2	110.6	S200 E201 S202 Y208 T209 V210 V308 F309	S200-R206 PolarHBondContact O-NE 3.49Å; S200-R206 PolarHBondContact O-NH2 3.37Å; E201-R206 IonicContact OE2-CZ 3.71Å; E201-R206 IonicContact OE2-NH2 2.79Å; E201-R206 PolarHBondContact OE2-NH2 3.29Å; S202-R206 PolarHBondContact O-N 2.95Å; R206-Y208 VanDerWaalsContact C-N 3.32Å; R206-Y208 PolarHBondContact O-N 2.99Å; R206-T209 PolarHBondContact O-N 2.86Å; R206-V210 WeakPolarHBondContact O-CG2 3.39Å; R206-V210 PolarHBondContact O-N 3.48Å; R206-V308 HydrophobicContact CB-CG1 4.23Å; R206-V308 HydrophobicContact CG-CG1 3.72Å; R206-F309 HydrophobicContact CB-CE1 4.06Å; R206-F309 HydrophobicContact CB-CZ 3.98Å; R206-F309 HydrophobicContact CG-CE1 4.15Å; R206-F309 HydrophobicContact CG-CZ 4.43Å
207	G	91	Very high	89.8	Confident	41 Å²	41	37.1 Å²	37.1	42%	0.423	22%	0.215	S	C	.	.	H	α-helix	trans	-58.5	-42	176.7	0	0	0	0	0	112.6	M203 A204 V210 L211	M203-G207 PolarHBondContact O-N 3.29Å; A204-G207 PolarHBondContact O-N 3Å; G207-V210 PolarHBondContact O-N 3.25Å; G207-L211 WeakPolarHBondContact O-CB 3.04Å; G207-L211 PolarHBondContact O-N 3.49Å
208	Y	90.9	Very high	90.3	Very high	25 Å²	25	41.3 Å²	41.3	10%	0.098	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-44.9	176.7	-179.9	-121.1	0	0	0	112.7	V172 S173 P175 S176 L197 A204 D205 R206 V210 L211 L212	V172-Y208 WeakPolarHBondContact O-CE2 3.27Å; V172-Y208 PolarHBondContact O-OH 2.95Å; S173-Y208 PolarHBondContact O-OH 3.35Å; P175-Y208 HydrophobicContact CB-CD2 4.14Å; P175-Y208 HydrophobicContact CB-CE2 3.76Å; P175-Y208 HydrophobicContact CG-CD2 4.46Å; P175-Y208 HydrophobicContact CG-CE2 3.94Å; S176-Y208 PolarHBondContact OG-OH 3.46Å; L197-Y208 HydrophobicContact CD1-CE1 4.42Å; A204-Y208 WeakPolarHBondContact O-CB 3.44Å; A204-Y208 PolarHBondContact O-N 3.13Å; D205-Y208 PolarHBondContact O-N 3.05Å; R206-Y208 VanDerWaalsContact C-N 3.32Å; R206-Y208 PolarHBondContact O-N 2.99Å; Y208-V210 VanDerWaalsContact C-N 3.31Å; Y208-V210 PolarHBondContact O-N 3.42Å; Y208-L211 HydrophobicContact CD2-CD2 4.47Å; Y208-L211 WeakPolarHBondContact O-CB 3.3Å; Y208-L211 PolarHBondContact O-N 2.9Å; Y208-L212 HydrophobicContact CD1-CD1 4.09Å; Y208-L212 HydrophobicContact CE1-CD1 3.58Å; Y208-L212 HydrophobicContact CE1-CG 4.35Å; Y208-L212 HydrophobicContact CE2-CD1 4.17Å; Y208-L212 HydrophobicContact CE2-CD2 4.27Å; Y208-L212 HydrophobicContact CE2-CG 4.05Å; Y208-L212 WeakPolarHBondContact O-CG 3.4Å; Y208-L212 PolarHBondContact O-N 2.92Å
209	T	91.6	Very high	91	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-39.4	175.3	-56.5	0	0	0	0	111.6	D205 R206 L212 A213 L305 V308	D205-T209 PolarHBondContact O-N 2.93Å; D205-T209 VanDerWaalsContact O-N 3.08Å; D205-T209 PolarHBondContact O-OG1 3.25Å; D205-T209 VanDerWaalsContact O-OG1 3.1Å; R206-T209 PolarHBondContact O-N 2.86Å; T209-L212 PolarHBondContact O-N 3.24Å; T209-A213 WeakPolarHBondContact O-CB 3.23Å; T209-A213 PolarHBondContact O-N 3.04Å; T209-L305 HydrophobicContact CG2-CD2 4.33Å; T209-V308 HydrophobicContact CG2-CB 4.19Å; T209-V308 HydrophobicContact CG2-CG1 4.46Å; T209-V308 HydrophobicContact CG2-CG2 3.83Å; T209-V308 WeakPolarHBondContact OG1-CG2 3.44Å
210	V	95	Very high	91.5	Very high	57 Å²	57	43.5 Å²	43.5	35%	0.345	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-43.8	174.2	171.5	0	0	0	0	110.9	R206 G207 Y208 L212 A213 V214 L305 F309	R206-V210 WeakPolarHBondContact O-CG2 3.39Å; R206-V210 PolarHBondContact O-N 3.48Å; G207-V210 PolarHBondContact O-N 3.25Å; Y208-V210 VanDerWaalsContact C-N 3.31Å; Y208-V210 PolarHBondContact O-N 3.42Å; V210-L212 VanDerWaalsContact C-N 3.33Å; V210-L212 PolarHBondContact O-N 3.43Å; V210-A213 PolarHBondContact O-N 3.42Å; V210-V214 HydrophobicContact CG1-CG2 4.18Å; V210-V214 WeakPolarHBondContact O-CB 3.22Å; V210-V214 VanDerWaalsContact O-CG2 3.27Å; V210-V214 WeakPolarHBondContact O-CG2 3.38Å; V210-V214 PolarHBondContact O-N 3.32Å; V210-L305 HydrophobicContact CG2-CD2 4.15Å; V210-F309 HydrophobicContact CG2-CE2 3.75Å; V210-F309 HydrophobicContact CG2-CZ 3.7Å
211	L	95.1	Very high	92.1	Very high	89 Å²	89	45.8 Å²	45.8	47%	0.466	26%	0.257	S	S	.	.	H	α-helix	trans	-56.6	-47.7	175.4	176.9	67.1	0	0	0	111.2	G207 Y208 V214 A215	G207-L211 WeakPolarHBondContact O-CB 3.04Å; G207-L211 PolarHBondContact O-N 3.49Å; Y208-L211 HydrophobicContact CD2-CD2 4.47Å; Y208-L211 WeakPolarHBondContact O-CB 3.3Å; Y208-L211 PolarHBondContact O-N 2.9Å; L211-V214 PolarHBondContact O-N 3.02Å; L211-A215 VanDerWaalsContact O-CB 3.27Å; L211-A215 WeakPolarHBondContact O-CB 3.45Å; L211-A215 PolarHBondContact O-N 3.3Å
212	L	94.8	Very high	92.7	Very high	1 Å²	1	43 Å²	43	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-45.3	176.1	-70.6	172.4	0	0	0	111.6	W125 L129 V172 L197 Y208 T209 V210 V214 A215 V216	W125-L212 HydrophobicContact CB-CD2 4.28Å; W125-L212 HydrophobicContact CD2-CD1 3.96Å; W125-L212 HydrophobicContact CD2-CD2 4.07Å; W125-L212 HydrophobicContact CD2-CG 4.49Å; W125-L212 HydrophobicContact CE3-CD2 4.22Å; W125-L212 HydrophobicContact CG-CD1 4.16Å; W125-L212 HydrophobicContact CG-CD2 4.1Å; W125-L212 HydrophobicContact CZ2-CD1 4.13Å; W125-L212 HydrophobicContact CZ3-CB 4.45Å; L129-L212 HydrophobicContact CD1-CD2 4.33Å; V172-L212 HydrophobicContact CG1-CD2 4Å; L197-L212 HydrophobicContact CD1-CD1 3.68Å; Y208-L212 HydrophobicContact CD1-CD1 4.09Å; Y208-L212 HydrophobicContact CE1-CD1 3.58Å; Y208-L212 HydrophobicContact CE1-CG 4.35Å; Y208-L212 HydrophobicContact CE2-CD1 4.17Å; Y208-L212 HydrophobicContact CE2-CD2 4.27Å; Y208-L212 HydrophobicContact CE2-CG 4.05Å; Y208-L212 WeakPolarHBondContact O-CG 3.4Å; Y208-L212 PolarHBondContact O-N 2.92Å; T209-L212 PolarHBondContact O-N 3.24Å; V210-L212 VanDerWaalsContact C-N 3.33Å; V210-L212 PolarHBondContact O-N 3.43Å; L212-V214 VanDerWaalsContact C-N 3.34Å; L212-V214 PolarHBondContact O-N 3.24Å; L212-A215 PolarHBondContact O-N 2.96Å; L212-V216 VanDerWaalsContact O-CB 3.25Å; L212-V216 WeakPolarHBondContact O-CB 3.29Å; L212-V216 VanDerWaalsContact O-CG2 3.31Å; L212-V216 WeakPolarHBondContact O-CG2 3.3Å; L212-V216 PolarHBondContact O-N 3.26Å
213	A	96.1	Very high	93.2	Very high	7 Å²	7	43.9 Å²	43.9	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-41.6	177.5	0	0	0	0	0	112.3	T209 V210 F217 F218 T301 L305	T209-A213 WeakPolarHBondContact O-CB 3.23Å; T209-A213 PolarHBondContact O-N 3.04Å; V210-A213 PolarHBondContact O-N 3.42Å; A213-F217 WeakPolarHBondContact O-CA 3.47Å; A213-F217 WeakPolarHBondContact O-CB 3.44Å; A213-F217 PolarHBondContact O-N 3.34Å; A213-F218 HydrophobicContact CB-CD2 4.42Å; A213-F218 HydrophobicContact CB-CE2 4.19Å; A213-F218 WeakPolarHBondContact O-CD2 3.11Å; A213-F218 PolarHBondContact O-N 2.97Å; A213-T301 HydrophobicContact CB-CG2 3.71Å; A213-L305 HydrophobicContact CB-CD1 4.2Å; A213-L305 HydrophobicContact CB-CD2 3.98Å; A213-L305 HydrophobicContact CB-CG 4.19Å
214	V	96.9	Very high	93.4	Very high	56 Å²	56	37.6 Å²	37.6	34%	0.339	23%	0.226	S	C	.	.	I	π-helix	trans	-65.9	-46.6	177.3	170.8	0	0	0	0	111	V210 L211 L212 F218 V219	V210-V214 HydrophobicContact CG1-CG2 4.18Å; V210-V214 WeakPolarHBondContact O-CB 3.22Å; V210-V214 VanDerWaalsContact O-CG2 3.27Å; V210-V214 WeakPolarHBondContact O-CG2 3.38Å; V210-V214 PolarHBondContact O-N 3.32Å; L211-V214 PolarHBondContact O-N 3.02Å; L212-V214 VanDerWaalsContact C-N 3.34Å; L212-V214 PolarHBondContact O-N 3.24Å; V214-F218 HydrophobicContact CG2-CD2 4.32Å; V214-F218 PolarHBondContact O-N 2.97Å; V214-V219 HydrophobicContact CG1-CG2 3.71Å; V214-V219 WeakPolarHBondContact O-CB 3.17Å; V214-V219 PolarHBondContact O-N 3.26Å
215	A	95.7	Very high	93.7	Very high	31 Å²	31	37.9 Å²	37.9	26%	0.256	22%	0.219	S	C	.	.	I	π-helix	trans	-69.7	-38.6	-178.1	0	0	0	0	0	113	L129 L211 L212 P220	L129-A215 HydrophobicContact CD2-CB 3.79Å; L211-A215 VanDerWaalsContact O-CB 3.27Å; L211-A215 WeakPolarHBondContact O-CB 3.45Å; L211-A215 PolarHBondContact O-N 3.3Å; L212-A215 PolarHBondContact O-N 2.96Å; A215-P220 VanDerWaalsContact O-CD 3.31Å; A215-P220 WeakPolarHBondContact O-CD 3.49Å; A215-P220 WeakPolarHBondContact O-CG 3.46Å
216	V	94.9	Very high	94.1	Very high	1 Å²	1	44 Å²	44	1%	0.006	24%	0.242	C	C	.	.	I	π-helix	trans	-86.6	-34.1	-176.1	173.4	0	0	0	0	112.3	W125 V128 L129 V132 L212 F293 W297	W125-V216 HydrophobicContact CE3-CG2 4Å; W125-V216 HydrophobicContact CZ3-CB 4.42Å; W125-V216 HydrophobicContact CZ3-CG1 4.42Å; W125-V216 HydrophobicContact CZ3-CG2 3.87Å; V128-V216 HydrophobicContact CG1-CB 4.48Å; V128-V216 HydrophobicContact CG1-CG1 3.74Å; V128-V216 HydrophobicContact CG1-CG2 3.82Å; L129-V216 HydrophobicContact CD2-CG2 3.51Å; L129-V216 HydrophobicContact CG-CG2 4Å; V132-V216 HydrophobicContact CG2-CG1 4.24Å; L212-V216 VanDerWaalsContact O-CB 3.25Å; L212-V216 WeakPolarHBondContact O-CB 3.29Å; L212-V216 VanDerWaalsContact O-CG2 3.31Å; L212-V216 WeakPolarHBondContact O-CG2 3.3Å; L212-V216 PolarHBondContact O-N 3.26Å; V216-F293 WeakPolarHBondContact O-CE2 3.47Å; V216-F293 VanDerWaalsContact O-CZ 3.24Å; V216-F293 WeakPolarHBondContact O-CZ 3.39Å; V216-W297 HydrophobicContact CG1-CD2 3.91Å; V216-W297 HydrophobicContact CG1-CE3 3.68Å; V216-W297 HydrophobicContact CG1-CH2 4.32Å; V216-W297 HydrophobicContact CG1-CZ2 4.39Å; V216-W297 HydrophobicContact CG1-CZ3 3.93Å
217	F	95.8	Very high	94.1	Very high	10 Å²	10	42.2 Å²	42.2	4%	0.044	24%	0.236	C	C	.	.	I	π-helix	trans	-120.5	-63.8	-172.8	-171.5	-101.9	0	0	0	113.8	A213 P220 F221 F293 W297 L298 T301	A213-F217 WeakPolarHBondContact O-CA 3.47Å; A213-F217 WeakPolarHBondContact O-CB 3.44Å; A213-F217 PolarHBondContact O-N 3.34Å; F217-P220 WeakPolarHBondContact O-CD 3.34Å; F217-F221 HydrophobicContact CE1-CG 4.48Å; F217-F221 HydrophobicContact CE2-CD2 4.25Å; F217-F221 HydrophobicContact CZ-CB 4.42Å; F217-F221 AromaticContact CZ-CD2 3.94Å; F217-F221 HydrophobicContact CZ-CD2 3.94Å; F217-F221 HydrophobicContact CZ-CE2 4.47Å; F217-F221 HydrophobicContact CZ-CG 4.2Å; F217-F221 WeakPolarHBondContact O-CA 3.5Å; F217-F221 WeakPolarHBondContact O-CB 3.11Å; F217-F221 PolarHBondContact O-N 3.46Å; F217-F293 HydrophobicContact CD2-CE1 4.13Å; F217-F293 HydrophobicContact CD2-CZ 4.13Å; F217-F293 HydrophobicContact CE2-CE1 4.3Å; F217-W297 HydrophobicContact CD2-CB 3.88Å; F217-W297 HydrophobicContact CE2-CB 4.41Å; F217-L298 HydrophobicContact CD1-CD1 4.5Å; F217-L298 HydrophobicContact CE1-CD1 3.63Å; F217-L298 HydrophobicContact CE2-CB 3.73Å; F217-L298 HydrophobicContact CE2-CD1 4.31Å; F217-L298 HydrophobicContact CZ-CB 3.72Å; F217-L298 HydrophobicContact CZ-CD1 3.52Å; F217-L298 HydrophobicContact CZ-CG 4.14Å; F217-T301 HydrophobicContact CB-CG2 3.91Å; F217-T301 WeakPolarHBondContact CB-OG1 3.29Å; F217-T301 HydrophobicContact CD1-CG2 4.42Å; F217-T301 HydrophobicContact CG-CG2 4.32Å
218	F	96.4	Very high	93.9	Very high	104 Å²	104	41.9 Å²	41.9	46%	0.456	22%	0.223	S	C	.	.	I	π-helix	trans	-65.1	-48.7	-165.8	-67	-79	0	0	0	113.9	A213 V214 A222 T301 L305	A213-F218 HydrophobicContact CB-CD2 4.42Å; A213-F218 HydrophobicContact CB-CE2 4.19Å; A213-F218 WeakPolarHBondContact O-CD2 3.11Å; A213-F218 PolarHBondContact O-N 2.97Å; V214-F218 HydrophobicContact CG2-CD2 4.32Å; V214-F218 PolarHBondContact O-N 2.97Å; F218-A222 WeakPolarHBondContact O-CB 3.31Å; F218-A222 PolarHBondContact O-N 2.72Å; F218-T301 HydrophobicContact CE2-CG2 4.23Å; F218-L305 HydrophobicContact CE2-CD1 4.23Å; F218-L305 HydrophobicContact CZ-CD1 4.47Å
219	V	96	Very high	93.8	Very high	73 Å²	73	44.8 Å²	44.8	44%	0.442	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-51.5	177.9	166.2	0	0	0	0	111.1	V214 F221 A222 V223	V214-V219 HydrophobicContact CG1-CG2 3.71Å; V214-V219 WeakPolarHBondContact O-CB 3.17Å; V214-V219 PolarHBondContact O-N 3.26Å; V219-F221 PolarHBondContact O-N 3.04Å; V219-A222 PolarHBondContact O-N 2.79Å; V219-V223 WeakPolarHBondContact O-CG2 3.34Å; V219-V223 PolarHBondContact O-N 3.41Å
220	P	95.1	Very high	93.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.019	25%	0.246	C	C	.	.	H	α-helix	trans	-58.7	-44.1	177.1	-24.1	32.4	0	0	0	113.1	V132 A215 F217 V223 M224 F293	V132-P220 HydrophobicContact CG1-CB 3.65Å; V132-P220 HydrophobicContact CG1-CG 3.3Å; A215-P220 VanDerWaalsContact O-CD 3.31Å; A215-P220 WeakPolarHBondContact O-CD 3.49Å; A215-P220 WeakPolarHBondContact O-CG 3.46Å; F217-P220 WeakPolarHBondContact O-CD 3.34Å; P220-V223 PolarHBondContact O-N 3.01Å; P220-M224 HydrophobicContact CB-CE 3.44Å; P220-M224 VanDerWaalsContact CB-CE 3.44Å; P220-M224 VanDerWaalsContact O-CB 3.26Å; P220-M224 WeakPolarHBondContact O-CB 3.37Å; P220-M224 WeakPolarHBondContact O-CG 3.49Å; P220-M224 PolarHBondContact O-N 3.33Å; P220-F293 HydrophobicContact CB-CE1 4.45Å; P220-F293 HydrophobicContact CB-CE2 4.49Å; P220-F293 HydrophobicContact CB-CZ 3.88Å
221	F	95.4	Very high	93.2	Very high	63 Å²	63	43.2 Å²	43.2	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-59.9	-48.3	178.5	-179.2	-92.9	0	0	0	111.3	F217 V219 V223 M224 L225 F290 F293 S294	F217-F221 HydrophobicContact CE1-CG 4.48Å; F217-F221 HydrophobicContact CE2-CD2 4.25Å; F217-F221 HydrophobicContact CZ-CB 4.42Å; F217-F221 AromaticContact CZ-CD2 3.94Å; F217-F221 HydrophobicContact CZ-CD2 3.94Å; F217-F221 HydrophobicContact CZ-CE2 4.47Å; F217-F221 HydrophobicContact CZ-CG 4.2Å; F217-F221 WeakPolarHBondContact O-CA 3.5Å; F217-F221 WeakPolarHBondContact O-CB 3.11Å; F217-F221 PolarHBondContact O-N 3.46Å; V219-F221 PolarHBondContact O-N 3.04Å; F221-V223 PolarHBondContact O-N 3.27Å; F221-M224 PolarHBondContact O-N 2.84Å; F221-L225 HydrophobicContact CE1-CD2 3.9Å; F221-L225 HydrophobicContact CZ-CD2 4.37Å; F221-L225 WeakPolarHBondContact O-CB 3.44Å; F221-L225 PolarHBondContact O-N 3.47Å; F221-F290 AromaticContact CD2-CE2 3.75Å; F221-F290 HydrophobicContact CD2-CE2 3.75Å; F221-F290 HydrophobicContact CD2-CZ 4.05Å; F221-F290 AromaticContact CE2-CE2 3.73Å; F221-F290 HydrophobicContact CE2-CE2 3.73Å; F221-F290 AromaticContact CE2-CZ 3.53Å; F221-F290 HydrophobicContact CE2-CZ 3.53Å; F221-F290 HydrophobicContact CG-CE2 4.49Å; F221-F290 HydrophobicContact CZ-CE2 4.46Å; F221-F290 HydrophobicContact CZ-CZ 4Å; F221-F293 HydrophobicContact CB-CE1 4.19Å; F221-S294 WeakPolarHBondContact CE2-OG 3.29Å
222	A	95.8	Very high	92.6	Very high	52 Å²	52	40 Å²	40	43%	0.43	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-46.5	179.6	0	0	0	0	0	112	F218 V219 L225 Y226	F218-A222 WeakPolarHBondContact O-CB 3.31Å; F218-A222 PolarHBondContact O-N 2.72Å; V219-A222 PolarHBondContact O-N 2.79Å; A222-L225 PolarHBondContact O-N 2.91Å; A222-Y226 VanDerWaalsContact O-CB 3.32Å; A222-Y226 WeakPolarHBondContact O-CB 3.23Å; A222-Y226 PolarHBondContact O-N 3.38Å
223	V	94.3	Very high	92.2	Very high	52 Å²	52	43.4 Å²	43.4	32%	0.315	23%	0.231	S	C	.	.	H	α-helix	trans	-67.8	-42.8	179.8	176	0	0	0	0	111.6	L136 V140 V219 P220 F221 S227	L136-V223 HydrophobicContact CD1-CB 3.58Å; L136-V223 HydrophobicContact CD1-CG1 3.45Å; L136-V223 VanDerWaalsContact CD1-CG1 3.45Å; L136-V223 HydrophobicContact CD1-CG2 4.3Å; V140-V223 HydrophobicContact CG2-CG1 3.97Å; V219-V223 WeakPolarHBondContact O-CG2 3.34Å; V219-V223 PolarHBondContact O-N 3.41Å; P220-V223 PolarHBondContact O-N 3.01Å; F221-V223 PolarHBondContact O-N 3.27Å; V223-S227 VanDerWaalsContact O-CB 3.27Å; V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.48Å; V223-S227 PolarHBondContact O-OG 3.23Å
224	M	91.9	Very high	91.5	Very high	7 Å²	7	44.6 Å²	44.6	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-43.4	176.9	-72.5	-171.5	-112.8	0	0	111.5	S139 P220 F221 S227 Y228 F290 F293	S139-M224 WeakPolarHBondContact OG-CG 3.28Å; P220-M224 HydrophobicContact CB-CE 3.44Å; P220-M224 VanDerWaalsContact CB-CE 3.44Å; P220-M224 VanDerWaalsContact O-CB 3.26Å; P220-M224 WeakPolarHBondContact O-CB 3.37Å; P220-M224 WeakPolarHBondContact O-CG 3.49Å; P220-M224 PolarHBondContact O-N 3.33Å; F221-M224 PolarHBondContact O-N 2.84Å; M224-S227 PolarHBondContact O-N 3.11Å; M224-Y228 VanDerWaalsContact O-CB 3.26Å; M224-Y228 WeakPolarHBondContact O-CB 3.48Å; M224-Y228 PolarHBondContact O-N 2.73Å; M224-F290 HydrophobicContact CB-CD2 3.7Å; M224-F290 HydrophobicContact CB-CE2 4.13Å; M224-F290 HydrophobicContact SD-CD2 4.48Å; M224-F293 HydrophobicContact CE-CD1 3.7Å; M224-F293 HydrophobicContact CE-CD2 4.02Å; M224-F293 HydrophobicContact CE-CE1 3.64Å; M224-F293 HydrophobicContact CE-CE2 3.99Å; M224-F293 HydrophobicContact CE-CG 3.9Å; M224-F293 HydrophobicContact CE-CZ 3.8Å; M224-F293 HydrophobicContact SD-CD1 4.24Å; M224-F293 HydrophobicContact SD-CG 4.43Å
225	L	92.5	Very high	90.6	Very high	64 Å²	64	43.6 Å²	43.6	34%	0.335	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-48.8	176.7	178.7	62.6	0	0	0	111.1	F221 A222 S227 Y228 M229 F290	F221-L225 HydrophobicContact CE1-CD2 3.9Å; F221-L225 HydrophobicContact CZ-CD2 4.37Å; F221-L225 WeakPolarHBondContact O-CB 3.44Å; F221-L225 PolarHBondContact O-N 3.47Å; A222-L225 PolarHBondContact O-N 2.91Å; L225-S227 PolarHBondContact O-N 2.64Å; L225-Y228 WeakPolarHBondContact O-CB 3.31Å; L225-Y228 PolarHBondContact O-N 3.38Å; L225-M229 HydrophobicContact CD1-CG 4.14Å; L225-M229 HydrophobicContact CG-CG 4.43Å; L225-M229 VanDerWaalsContact O-CG 3.26Å; L225-M229 WeakPolarHBondContact O-CG 3.29Å; L225-M229 PolarHBondContact O-N 3.29Å; L225-F290 HydrophobicContact CB-CE2 4.23Å; L225-F290 HydrophobicContact CB-CZ 4.18Å; L225-F290 HydrophobicContact CD1-CE1 4.43Å; L225-F290 HydrophobicContact CD1-CZ 4.03Å
226	Y	92.3	Very high	90	Very high	143 Å²	143	49 Å²	49	56%	0.561	25%	0.245	S	C	*	.	H	α-helix	trans	-56.8	-50.8	176.4	174.4	-98.4	0	0	0	111.5	F143 A222 Y228 M229 C230	F143-Y226 HydrophobicContact CE2-CE1 4.3Å; F143-Y226 HydrophobicContact CZ-CE1 4.28Å; A222-Y226 VanDerWaalsContact O-CB 3.32Å; A222-Y226 WeakPolarHBondContact O-CB 3.23Å; A222-Y226 PolarHBondContact O-N 3.38Å; Y226-Y228 VanDerWaalsContact C-N 3.28Å; Y226-Y228 PolarHBondContact O-N 3.36Å; Y226-M229 PolarHBondContact O-N 2.98Å; Y226-C230 PolarHBondContact O-N 2.73Å; Y226-C230 PolarHBondContact O-SG 3.17Å
227	S	89.6	Confident	89.3	Confident	5 Å²	5	57.2 Å²	57.2	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-55.2	-45.7	177.4	-62.6	0	0	0	0	111.3	V223 M224 L225 C230 I231	V223-S227 VanDerWaalsContact O-CB 3.27Å; V223-S227 WeakPolarHBondContact O-CB 3.43Å; V223-S227 PolarHBondContact O-N 3.48Å; V223-S227 PolarHBondContact O-OG 3.23Å; M224-S227 PolarHBondContact O-N 3.11Å; L225-S227 PolarHBondContact O-N 2.64Å; S227-C230 PolarHBondContact O-N 2.89Å; S227-I231 WeakPolarHBondContact O-CB 3.48Å; S227-I231 WeakPolarHBondContact O-CD1 3.21Å; S227-I231 WeakPolarHBondContact O-CG1 3.41Å; S227-I231 PolarHBondContact O-N 3.47Å
228	Y	86.4	Confident	88.4	Confident	34 Å²	34	58.2 Å²	58.2	13%	0.133	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-45.8	178.5	174.1	-105	0	0	0	112.8	M224 L225 Y226 C230 I231 L232 F283 L287	M224-Y228 VanDerWaalsContact O-CB 3.26Å; M224-Y228 WeakPolarHBondContact O-CB 3.48Å; M224-Y228 PolarHBondContact O-N 2.73Å; L225-Y228 WeakPolarHBondContact O-CB 3.31Å; L225-Y228 PolarHBondContact O-N 3.38Å; Y226-Y228 VanDerWaalsContact C-N 3.28Å; Y226-Y228 PolarHBondContact O-N 3.36Å; Y228-C230 VanDerWaalsContact C-N 3.34Å; Y228-C230 PolarHBondContact O-N 3.29Å; Y228-I231 PolarHBondContact O-N 2.85Å; Y228-L232 HydrophobicContact CD1-CD1 3.98Å; Y228-L232 HydrophobicContact CD1-CG 4.48Å; Y228-L232 HydrophobicContact CE1-CD1 3.26Å; Y228-L232 HydrophobicContact CE1-CG 3.98Å; Y228-L232 HydrophobicContact CE2-CD1 4.24Å; Y228-L232 HydrophobicContact CE2-CG 4.1Å; Y228-L232 VanDerWaalsContact CZ-CD1 3.41Å; Y228-L232 WeakPolarHBondContact O-CB 3.15Å; Y228-L232 PolarHBondContact O-N 3.3Å; Y228-F283 AromaticContact CD2-CE2 3.86Å; Y228-F283 HydrophobicContact CD2-CE2 3.86Å; Y228-F283 HydrophobicContact CD2-CZ 4.36Å; Y228-F283 HydrophobicContact CE2-CD2 4.32Å; Y228-F283 HydrophobicContact CE2-CE1 4.46Å; Y228-F283 AromaticContact CE2-CE2 3.23Å; Y228-F283 HydrophobicContact CE2-CE2 3.23Å; Y228-F283 AromaticContact CE2-CZ 3.31Å; Y228-F283 HydrophobicContact CE2-CZ 3.31Å; Y228-F283 AromaticContact CZ-CE2 3.98Å; Y228-F283 AromaticContact CZ-CZ 3.7Å; Y228-F283 WeakPolarHBondContact OH-CZ 3.38Å; Y228-L287 HydrophobicContact CE1-CD1 4.48Å; Y228-L287 HydrophobicContact CE2-CB 4.04Å; Y228-L287 HydrophobicContact CE2-CD1 3.76Å; Y228-L287 HydrophobicContact CE2-CG 4.34Å; Y228-L287 WeakPolarHBondContact OH-CD1 3.35Å
229	M	88.9	Confident	87.5	Confident	86 Å²	86	56.9 Å²	56.9	42%	0.424	28%	0.282	S	S	.	.	H	α-helix	trans	-62.2	-41.6	178.7	-69	-60.7	-78.1	0	0	111.5	L225 Y226 L232 N233	L225-M229 HydrophobicContact CD1-CG 4.14Å; L225-M229 HydrophobicContact CG-CG 4.43Å; L225-M229 VanDerWaalsContact O-CG 3.26Å; L225-M229 WeakPolarHBondContact O-CG 3.29Å; L225-M229 PolarHBondContact O-N 3.29Å; Y226-M229 PolarHBondContact O-N 2.98Å; M229-L232 PolarHBondContact O-N 3.35Å; M229-L232 HydrophobicContact SD-CD1 4.38Å; M229-N233 WeakPolarHBondContact O-CB 3.19Å; M229-N233 PolarHBondContact O-N 3.04Å; M229-N233 PolarHBondContact O-ND2 3.47Å
230	C	88.1	Confident	86.5	Confident	26 Å²	26	58.5 Å²	58.5	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-40.9	174.7	-69.5	0	0	0	0	112.7	F143 V147 Y226 S227 Y228 N233 T234	F143-C230 HydrophobicContact CD2-CB 3.9Å; F143-C230 HydrophobicContact CE2-CB 3.57Å; V147-C230 HydrophobicContact CG1-CB 4.5Å; V147-C230 HydrophobicContact CG2-CB 4.16Å; Y226-C230 PolarHBondContact O-N 2.73Å; Y226-C230 PolarHBondContact O-SG 3.17Å; S227-C230 PolarHBondContact O-N 2.89Å; Y228-C230 VanDerWaalsContact C-N 3.34Å; Y228-C230 PolarHBondContact O-N 3.29Å; C230-N233 PolarHBondContact O-N 2.79Å; C230-T234 WeakPolarHBondContact O-CB 3.29Å; C230-T234 PolarHBondContact O-N 2.47Å; C230-T234 PolarHBondContact O-OG1 3.37Å
231	I	84.9	Confident	85.5	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-49.4	174.9	-71	164.1	0	0	0	109.9	I146 V147 S227 Y228 N233 T234 V235 F283 I286	I146-I231 HydrophobicContact CB-CG1 4.4Å; I146-I231 HydrophobicContact CD1-CD1 4.4Å; I146-I231 HydrophobicContact CD1-CG2 4.35Å; I146-I231 HydrophobicContact CG2-CG1 4.42Å; I146-I231 HydrophobicContact CG2-CG2 4.15Å; V147-I231 HydrophobicContact CG2-CB 4.4Å; V147-I231 HydrophobicContact CG2-CG1 3.75Å; S227-I231 WeakPolarHBondContact O-CB 3.48Å; S227-I231 WeakPolarHBondContact O-CD1 3.21Å; S227-I231 WeakPolarHBondContact O-CG1 3.41Å; S227-I231 PolarHBondContact O-N 3.47Å; Y228-I231 PolarHBondContact O-N 2.85Å; I231-N233 PolarHBondContact O-N 3Å; I231-T234 PolarHBondContact O-N 3.16Å; I231-V235 HydrophobicContact CG2-CG2 4.39Å; I231-V235 WeakPolarHBondContact O-CG2 3.23Å; I231-V235 PolarHBondContact O-N 3.37Å; I231-F283 HydrophobicContact CG2-CD2 3.78Å; I231-F283 HydrophobicContact CG2-CE2 4.32Å; I231-I286 HydrophobicContact CD1-CD1 4.1Å
232	L	83.8	Confident	84.3	Confident	22 Å²	22	66.9 Å²	66.9	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-55.5	-49.8	177.2	-92.9	-176.5	0	0	0	112	Y228 M229 T234 V235 R236 F283	Y228-L232 HydrophobicContact CD1-CD1 3.98Å; Y228-L232 HydrophobicContact CD1-CG 4.48Å; Y228-L232 HydrophobicContact CE1-CD1 3.26Å; Y228-L232 HydrophobicContact CE1-CG 3.98Å; Y228-L232 HydrophobicContact CE2-CD1 4.24Å; Y228-L232 HydrophobicContact CE2-CG 4.1Å; Y228-L232 VanDerWaalsContact CZ-CD1 3.41Å; Y228-L232 WeakPolarHBondContact O-CB 3.15Å; Y228-L232 PolarHBondContact O-N 3.3Å; M229-L232 PolarHBondContact O-N 3.35Å; M229-L232 HydrophobicContact SD-CD1 4.38Å; L232-T234 VanDerWaalsContact C-N 3.3Å; L232-T234 PolarHBondContact O-N 3.31Å; L232-V235 PolarHBondContact O-N 2.98Å; L232-R236 WeakPolarHBondContact O-CB 3.37Å; L232-R236 VanDerWaalsContact O-CG 3.3Å; L232-R236 WeakPolarHBondContact O-CG 3.02Å; L232-R236 PolarHBondContact O-N 3.42Å; L232-F283 HydrophobicContact CD2-CD2 4.5Å; L232-F283 HydrophobicContact CD2-CE1 4.09Å; L232-F283 HydrophobicContact CD2-CE2 3.4Å; L232-F283 HydrophobicContact CD2-CZ 3.15Å; L232-F283 HydrophobicContact CG-CE2 3.62Å; L232-F283 HydrophobicContact CG-CZ 3.73Å
233	N	86	Confident	83.2	Confident	71 Å²	71	70.7 Å²	70.7	38%	0.38	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-40.7	-179.5	-74.6	-17.4	0	0	0	111.4	M229 C230 I231 R237	M229-N233 WeakPolarHBondContact O-CB 3.19Å; M229-N233 PolarHBondContact O-N 3.04Å; M229-N233 PolarHBondContact O-ND2 3.47Å; C230-N233 PolarHBondContact O-N 2.79Å; I231-N233 PolarHBondContact O-N 3Å; N233-R237 WeakPolarHBondContact O-CB 3.34Å; N233-R237 VanDerWaalsContact O-CG 3.23Å; N233-R237 WeakPolarHBondContact O-CG 3.3Å; N233-R237 PolarHBondContact O-N 3.23Å
234	T	81.7	Confident	81.9	Confident	33 Å²	33	72.9 Å²	72.9	20%	0.202	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-42.6	176.9	-59	0	0	0	0	111.7	C230 I231 L232 N238	C230-T234 WeakPolarHBondContact O-CB 3.29Å; C230-T234 PolarHBondContact O-N 2.47Å; C230-T234 PolarHBondContact O-OG1 3.37Å; I231-T234 PolarHBondContact O-N 3.16Å; L232-T234 VanDerWaalsContact C-N 3.3Å; L232-T234 PolarHBondContact O-N 3.31Å; T234-N238 WeakPolarHBondContact O-CB 3.04Å; T234-N238 PolarHBondContact O-N 3.38Å; T234-N238 PolarHBondContact O-ND2 2.89Å
235	V	77.8	Confident	80.6	Confident	34 Å²	34	78.4 Å²	78.4	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-48.4	177.1	172.8	0	0	0	0	110.5	I231 L232 R237 N238 T239	I231-V235 HydrophobicContact CG2-CG2 4.39Å; I231-V235 WeakPolarHBondContact O-CG2 3.23Å; I231-V235 PolarHBondContact O-N 3.37Å; L232-V235 PolarHBondContact O-N 2.98Å; V235-R237 PolarHBondContact O-N 2.98Å; V235-N238 PolarHBondContact O-N 2.98Å; V235-N238 VanDerWaalsContact O-N 3.17Å; V235-T239 PolarHBondContact O-N 3.48Å; V235-T239 PolarHBondContact O-OG1 2.79Å
236	R	81.7	Confident	79	Confident	145 Å²	145	79.2 Å²	79.2	55%	0.547	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-48	177.2	-73.6	175.8	-180	171.8	-1.4	111.9	L232 N238 T239 L240	L232-R236 WeakPolarHBondContact O-CB 3.37Å; L232-R236 VanDerWaalsContact O-CG 3.3Å; L232-R236 WeakPolarHBondContact O-CG 3.02Å; L232-R236 PolarHBondContact O-N 3.42Å; R236-N238 VanDerWaalsContact C-N 3.31Å; R236-N238 PolarHBondContact O-N 3.41Å; R236-T239 PolarHBondContact O-N 3.22Å; R236-L240 WeakPolarHBondContact O-CG 3.49Å; R236-L240 PolarHBondContact O-N 3.33Å
237	R	81.9	Confident	77.2	Confident	174 Å²	174	75.5 Å²	75.5	66%	0.657	37%	0.369	S	S	*	.	H	α-helix	trans	-59.3	-40.8	176.8	-75.4	176.3	-179.3	-171.8	0.4	112.3	N233 V235 R241	N233-R237 WeakPolarHBondContact O-CB 3.34Å; N233-R237 VanDerWaalsContact O-CG 3.23Å; N233-R237 WeakPolarHBondContact O-CG 3.3Å; N233-R237 PolarHBondContact O-N 3.23Å; V235-R237 PolarHBondContact O-N 2.98Å; R237-R241 WeakPolarHBondContact O-CG 3.39Å; R237-R241 PolarHBondContact O-N 3.49Å
238	N	76.8	Confident	75.4	Confident	30 Å²	30	81.5 Å²	81.5	16%	0.16	40%	0.396	C	S	.	.	H	α-helix	trans	-67.5	-39.7	177.7	-70.4	-33.2	0	0	0	112.1	T234 V235 R236 R241 I242	T234-N238 WeakPolarHBondContact O-CB 3.04Å; T234-N238 PolarHBondContact O-N 3.38Å; T234-N238 PolarHBondContact O-ND2 2.89Å; V235-N238 PolarHBondContact O-N 2.98Å; V235-N238 VanDerWaalsContact O-N 3.17Å; R236-N238 VanDerWaalsContact C-N 3.31Å; R236-N238 PolarHBondContact O-N 3.41Å; N238-R241 PolarHBondContact O-N 2.95Å; N238-I242 WeakPolarHBondContact O-CD1 3.41Å; N238-I242 VanDerWaalsContact O-CG1 3.27Å; N238-I242 WeakPolarHBondContact O-CG1 3.36Å; N238-I242 PolarHBondContact O-N 3.5Å; N238-I242 VanDerWaalsContact O-N 3.15Å
239	T	75.8	Confident	73.6	Confident	76 Å²	76	90.5 Å²	90.5	47%	0.466	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-43.7	175.7	-55.6	0	0	0	0	111.6	V235 R236 I242 H243	V235-T239 PolarHBondContact O-N 3.48Å; V235-T239 PolarHBondContact O-OG1 2.79Å; R236-T239 PolarHBondContact O-N 3.22Å; T239-I242 PolarHBondContact O-N 2.87Å; T239-H243 PolarHBondContact O-N 2.83Å
240	L	75.2	Confident	71.6	Confident	108 Å²	108	91.1 Å²	91.1	57%	0.565	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-42.1	177.2	-70.6	171	0	0	0	112.2	R236 I242 H243 N244	R236-L240 WeakPolarHBondContact O-CG 3.49Å; R236-L240 PolarHBondContact O-N 3.33Å; L240-I242 VanDerWaalsContact C-N 3.32Å; L240-I242 PolarHBondContact O-N 2.97Å; L240-H243 PolarHBondContact O-N 2.89Å; L240-N244 PolarHBondContact O-N 3.49Å
241	R	74.3	Confident	69.4	Low	164 Å²	164	94.3 Å²	94.3	62%	0.619	46%	0.464	S	S	*	.	H	α-helix	trans	-60.8	-39	174.7	-76.2	178.5	180	177.2	-1.9	112.8	R237 N238 H245	R237-R241 WeakPolarHBondContact O-CG 3.39Å; R237-R241 PolarHBondContact O-N 3.49Å; N238-R241 PolarHBondContact O-N 2.95Å; R241-H245 PolarHBondContact O-CD2 3.35Å; R241-H245 PolarHBondContact O-N 3.49Å; R241-H245 VanDerWaalsContact O-N 3.09Å
242	I	71.9	Confident	67.4	Low	78 Å²	78	101.6 Å²	101.6	40%	0.4	50%	0.502	S	S	.	.	H	α-helix	trans	-67.6	-41.7	177.3	-67.1	164.3	0	0	0	110.4	N238 T239 L240 T246 M276	N238-I242 WeakPolarHBondContact O-CD1 3.41Å; N238-I242 VanDerWaalsContact O-CG1 3.27Å; N238-I242 WeakPolarHBondContact O-CG1 3.36Å; N238-I242 PolarHBondContact O-N 3.5Å; N238-I242 VanDerWaalsContact O-N 3.15Å; T239-I242 PolarHBondContact O-N 2.87Å; L240-I242 VanDerWaalsContact C-N 3.32Å; L240-I242 PolarHBondContact O-N 2.97Å; I242-T246 WeakPolarHBondContact O-CB 3.27Å; I242-T246 PolarHBondContact O-N 3.35Å; I242-T246 PolarHBondContact O-OG1 2.81Å; I242-M276 HydrophobicContact CD1-CE 3.59Å
243	H	70.9	Confident	65.4	Low	131 Å²	131	106 Å²	106	61%	0.606	53%	0.532	S	S	*	.	H	α-helix	trans	-66	-44	178.9	-160.3	49.4	0	0	0	111.7	T239 L240 T246 S247	T239-H243 PolarHBondContact O-N 2.83Å; L240-H243 PolarHBondContact O-N 2.89Å; H243-T246 PolarHBondContact O-N 3.22Å; H243-S247 PolarHBondContact O-N 3.48Å
244	N	67.4	Low	63.5	Low	99 Å²	99	107.4 Å²	107.4	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-61.9	-44.7	176.8	-74.5	6.2	0	0	0	112.6	L240 T246 S247 E248	L240-N244 PolarHBondContact O-N 3.49Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 2.78Å; N244-S247 PolarHBondContact O-N 2.93Å; N244-E248 PolarHBondContact O-N 3.39Å
245	H	65.2	Low	61.8	Low	123 Å²	123	113.2 Å²	113.2	57%	0.569	58%	0.583	S	S	*	*	H	α-helix	trans	-67.2	-27.8	175.5	-81.9	-51.3	0	0	0	113.9	R241 E248 R249	R241-H245 PolarHBondContact O-CD2 3.35Å; R241-H245 PolarHBondContact O-N 3.49Å; R241-H245 VanDerWaalsContact O-N 3.09Å; H245-E248 IonicContact ND1-OE2 3.63Å; H245-R249 PolarHBondContact O-N 3.13Å
246	T	59	Low	60.1	Low	80 Å²	80	118.7 Å²	118.7	49%	0.491	61%	0.611	S	S	.	*	H	α-helix	trans	-72.1	-38.9	173.4	-48.9	0	0	0	0	110.1	I242 H243 N244 S250	I242-T246 WeakPolarHBondContact O-CB 3.27Å; I242-T246 PolarHBondContact O-N 3.35Å; I242-T246 PolarHBondContact O-OG1 2.81Å; H243-T246 PolarHBondContact O-N 3.22Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 2.78Å; T246-S250 PolarHBondContact O-N 3.39Å; T246-S250 PolarHBondContact O-OG 3.42Å; T246-S250 VanDerWaalsContact O-OG 3.13Å
247	S	54.7	Low	57.9	Low	66 Å²	66	120.9 Å²	120.9	46%	0.462	63%	0.628	S	S	.	*	H	α-helix	trans	-70.2	-39.5	177.7	-155.9	0	0	0	0	113	H243 N244 S250 C251	H243-S247 PolarHBondContact O-N 3.48Å; N244-S247 PolarHBondContact O-N 2.93Å; S247-S250 PolarHBondContact O-N 2.96Å; S247-C251 PolarHBondContact O-N 3.12Å
248	E	52	Low	56.2	Low	130 Å²	130	119.4 Å²	119.4	61%	0.607	64%	0.637	S	S	*	*	H	α-helix	trans	-65.6	-36.6	175.6	-78.2	178.3	166.6	0	0	112.5	N244 H245 S250 C251	N244-E248 PolarHBondContact O-N 3.39Å; H245-E248 IonicContact ND1-OE2 3.63Å; E248-S250 VanDerWaalsContact C-N 3.27Å; E248-S250 PolarHBondContact O-N 3.49Å; E248-C251 PolarHBondContact O-N 3.46Å
249	R	48.5	Very low	54.5	Low	224 Å²	224	123 Å²	123	85%	0.845	67%	0.665	S	S	*	*	H	α-helix	trans	-70.9	-20.5	173.8	-88.5	-179	175.1	165.7	-0.4	113.8	H245	H245-R249 PolarHBondContact O-N 3.13Å
250	S	45.8	Very low	52.6	Low	98 Å²	98	129.4 Å²	129.4	69%	0.685	69%	0.686	S	S	*	*	H	α-helix	trans	-86.4	-9.6	175.2	-63	0	0	0	0	113.4	T246 S247 E248	T246-S250 PolarHBondContact O-N 3.39Å; T246-S250 PolarHBondContact O-OG 3.42Å; T246-S250 VanDerWaalsContact O-OG 3.13Å; S247-S250 PolarHBondContact O-N 2.96Å; E248-S250 VanDerWaalsContact C-N 3.27Å; E248-S250 PolarHBondContact O-N 3.49Å
251	C	42	Very low	50.8	Low	94 Å²	94	133 Å²	133	64%	0.635	70%	0.703	S	S	*	*			trans	-114.3	32.7	-178.4	-74.2	0	0	0	0	113.6	S247 E248 P253	S247-C251 PolarHBondContact O-N 3.12Å; E248-C251 PolarHBondContact O-N 3.46Å; C251-P253 VanDerWaalsContact O-CD 3.3Å; C251-P253 WeakPolarHBondContact O-CD 3.43Å
252	L	43.9	Very low	48.8	Very low	153 Å²	153	136.4 Å²	136.4	80%	0.801	72%	0.715	S	S	*	*			trans	-97.7	95.9	155.2	-77.9	171.8	0	0	0	107.9
253	P	41.3	Very low	47.3	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	74%	0.735	S	S	*	*			trans	-73.3	140.3	170.6	6.3	10.8	0	0	0	109.1	C251 L255	C251-P253 VanDerWaalsContact O-CD 3.3Å; C251-P253 WeakPolarHBondContact O-CD 3.43Å; P253-L255 PolarHBondContact O-N 2.86Å
254	A	46	Very low	45.7	Very low	100 Å²	100	140.4 Å²	140.4	83%	0.826	75%	0.746	S	S	*	*			trans	-37.1	105.3	167.9	0	0	0	0	0	114
255	L	45.5	Very low	44.1	Very low	156 Å²	156	139 Å²	139	82%	0.817	76%	0.755	S	S	*	*			trans	-159.6	73.7	159.5	-121.1	151.3	0	0	0	110.1	P253	P253-L255 PolarHBondContact O-N 2.86Å
256	N	42	Very low	42.9	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	77%	0.77	S	S	*	*	S	Bend	trans	154	80.6	146.3	-81.1	-14	0	0	0	110.7
257	Q	36.9	Very low	41.8	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	79%	0.788	S	S	*	*			trans	-167.2	73.3	142	-115.5	175.8	0	0	0	109.9
258	V	45.3	Very low	41	Very low	142 Å²	142	153.1 Å²	153.1	86%	0.861	80%	0.804	S	S	*	*			trans	-78.8	134.1	152.4	177.4	0	0	0	0	106.3
259	S	41.5	Very low	40.2	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	81%	0.807	S	S	*	*			trans	85.3	81.4	176.1	75.1	0	0	0	0	118
260	K	35.8	Very low	39.5	Very low	212 Å²	212	146.6 Å²	146.6	92%	0.922	80%	0.802	S	S	*	*				-170.9	118.4	110.1	-103.8	175.2	-178	176.2	0	111.4
261	M	36.3	Very low	38.9	Very low	184 Å²	184	149.6 Å²	149.6	91%	0.906	80%	0.804	S	S	*	*			trans	-64	123.4	168.9	-162.8	109.5	166.7	0	0	110
262	R	31.9	Very low	38.8	Very low	234 Å²	234	151.4 Å²	151.4	88%	0.883	81%	0.806	S	S	*	*				165	115.9	127	-94.1	176.6	171	178.4	-2.3	113.5
263	L	42.2	Very low	38.3	Very low	156 Å²	156	152.2 Å²	152.2	82%	0.817	80%	0.803	S	S	*	*				44	105.3	123.7	-131	83.8	0	0	0	118.9
264	T	36.1	Very low	38.4	Very low	138 Å²	138	151 Å²	151	85%	0.847	79%	0.794	S	S	*	*				151	138.5	119.3	41.4	0	0	0	0	110.9
265	G	33.5	Very low	38	Very low	68 Å²	68	150.3 Å²	150.3	70%	0.701	78%	0.776	S	S	*	*			trans	107.5	95.3	166.2	0	0	0	0	0	114.2	Q267	G265-Q267 PolarHBondContact O-N 3.43Å
266	L	41.1	Very low	37.8	Very low	169 Å²	169	145.6 Å²	145.6	89%	0.885	75%	0.751	S	S	*	*			trans	-67.8	64.6	170.8	-146.5	115.1	0	0	0	110.5	R268	L266-R268 PolarHBondContact O-N 3.47Å; L266-R268 VanDerWaalsContact O-N 3.14Å
267	Q	34.6	Very low	37.9	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	73%	0.731	S	S	*	*			trans	-89.1	85.7	-178.8	-150	158.1	9.6	0	0	109.2	G265	G265-Q267 PolarHBondContact O-N 3.43Å
268	R	38.3	Very low	38.1	Very low	210 Å²	210	138.8 Å²	138.8	79%	0.792	72%	0.718	S	S	*	*			trans	-45.5	131.8	162.2	-81.2	177.8	176.7	150	-0.2	108.2	L266	L266-R268 PolarHBondContact O-N 3.47Å; L266-R268 VanDerWaalsContact O-N 3.14Å
269	P	34.7	Very low	38.3	Very low	104 Å²	104	136.4 Å²	136.4	68%	0.675	70%	0.696	S	S	*	*			trans	-56.6	139.9	170.8	24.2	-31	0	0	0	107.7	H271	P269-H271 VanDerWaalsContact C-N 3.29Å; P269-H271 PolarHBondContact O-N 3.42Å
270	P	34.5	Very low	38.7	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	68%	0.684	S	S	*	*			trans	-63.5	101.5	174.9	26.2	-29.5	0	0	0	106.1	I272	P270-I272 HydrophobicContact CB-CG1 4.46Å; P270-I272 PolarHBondContact O-N 3.05Å
271	H	34.3	Very low	39.8	Very low	160 Å²	160	132.4 Å²	132.4	74%	0.741	67%	0.668	S	S	*	*			trans	-67.1	79.6	168.4	-146.9	-64.4	0	0	0	105.1	P269 K273	P269-H271 VanDerWaalsContact C-N 3.29Å; P269-H271 PolarHBondContact O-N 3.42Å; H271-K273 PolarHBondContact O-N 3.47Å
272	I	39.8	Very low	40.8	Very low	132 Å²	132	125.7 Å²	125.7	68%	0.677	64%	0.642	S	S	*	*			trans	-65.4	82.8	163.1	-57.9	177	0	0	0	103.4	P270 V274	P270-I272 HydrophobicContact CB-CG1 4.46Å; P270-I272 PolarHBondContact O-N 3.05Å; I272-V274 HydrophobicContact CG2-CG2 3.83Å; I272-V274 PolarHBondContact O-N 3.14Å
273	K	32.9	Very low	42.3	Very low	170 Å²	170	116 Å²	116	74%	0.739	61%	0.606	S	S	*	*			trans	-58.4	85.9	153	-77.4	-174.9	176.8	-179.1	0	103.6	H271 D275	H271-K273 PolarHBondContact O-N 3.47Å; K273-D275 VanDerWaalsContact C-N 3.3Å; K273-D275 PolarHBondContact O-N 3.49Å
274	V	42.7	Very low	43.7	Very low	90 Å²	90	111 Å²	111	55%	0.545	58%	0.582	S	S	.	*			trans	-51.7	111.7	161	179.6	0	0	0	0	102.5	I272 M276	I272-V274 HydrophobicContact CG2-CG2 3.83Å; I272-V274 PolarHBondContact O-N 3.14Å; V274-M276 HydrophobicContact CB-CE 4.37Å; V274-M276 HydrophobicContact CG1-CE 3.74Å; V274-M276 PolarHBondContact O-N 3.42Å
275	D	37.3	Very low	45.4	Very low	86 Å²	86	106.1 Å²	106.1	46%	0.46	55%	0.552	S	S	.	*			trans	-69.2	78.4	-164.6	-161.6	-5	0	0	0	109	K273 S277 F278	K273-D275 VanDerWaalsContact C-N 3.3Å; K273-D275 PolarHBondContact O-N 3.49Å; D275-S277 PolarHBondContact O-N 3.29Å; D275-S277 VanDerWaalsContact O-N 3.09Å; D275-S277 VanDerWaalsContact OD1-CB 3.3Å; D275-S277 WeakPolarHBondContact OD1-CB 3.32Å; D275-S277 PolarHBondContact OD1-N 2.99Å; D275-S277 PolarHBondContact OD1-OG 3.04Å; D275-F278 PolarHBondContact O-N 3.26Å; D275-F278 VanDerWaalsContact O-N 3.11Å; D275-F278 WeakPolarHBondContact OD2-CD2 3.2Å
276	M	42.8	Very low	47.3	Very low	57 Å²	57	103.5 Å²	103.5	28%	0.281	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-17.4	176.6	-76.2	-67	143.5	0	0	110.2	I242 V274 F278 K279 T280	I242-M276 HydrophobicContact CD1-CE 3.59Å; V274-M276 HydrophobicContact CB-CE 4.37Å; V274-M276 HydrophobicContact CG1-CE 3.74Å; V274-M276 PolarHBondContact O-N 3.42Å; M276-F278 PolarHBondContact O-N 2.02Å; M276-K279 PolarHBondContact O-N 3.03Å; M276-T280 PolarHBondContact O-N 2.9Å; M276-T280 PolarHBondContact O-OG1 2.83Å
277	S	42.4	Very low	49.2	Very low	54 Å²	54	97.7 Å²	97.7	38%	0.378	49%	0.492	S	S	.	.	H	α-helix	trans	-67.8	-30.3	175.4	88.5	0	0	0	0	113.4	D275 R281	D275-S277 PolarHBondContact O-N 3.29Å; D275-S277 VanDerWaalsContact O-N 3.09Å; D275-S277 VanDerWaalsContact OD1-CB 3.3Å; D275-S277 WeakPolarHBondContact OD1-CB 3.32Å; D275-S277 PolarHBondContact OD1-N 2.99Å; D275-S277 PolarHBondContact OD1-OG 3.04Å; S277-R281 WeakPolarHBondContact O-CD 3.5Å; S277-R281 VanDerWaalsContact O-CG 3.24Å; S277-R281 WeakPolarHBondContact O-CG 3.22Å
278	F	42.2	Very low	51.5	Low	143 Å²	143	91 Å²	91	63%	0.627	46%	0.461	S	S	*	.	H	α-helix	trans	-76.9	-36.5	173.4	-100.3	-90.6	0	0	0	112.1	D275 M276 R281 A282	D275-F278 PolarHBondContact O-N 3.26Å; D275-F278 VanDerWaalsContact O-N 3.11Å; D275-F278 WeakPolarHBondContact OD2-CD2 3.2Å; M276-F278 PolarHBondContact O-N 2.02Å; F278-R281 PolarHBondContact O-N 3.17Å; F278-A282 PolarHBondContact O-N 3.39Å
279	K	48.9	Very low	53.6	Low	92 Å²	92	82.1 Å²	82.1	40%	0.4	43%	0.429	S	S	.	.	H	α-helix	trans	-72.3	-36.8	-178.1	-137.2	171.4	-176	172.9	0	112.4	M276 F283	M276-K279 PolarHBondContact O-N 3.03Å; K279-F283 PolarHBondContact O-N 3.13Å
280	T	51.4	Low	56	Low	77 Å²	77	78.2 Å²	78.2	47%	0.472	40%	0.402	S	S	.	.	H	α-helix	trans	-68.9	-33.7	174.3	-50.2	0	0	0	0	112.4	M276 F283 T284	M276-T280 PolarHBondContact O-N 2.9Å; M276-T280 PolarHBondContact O-OG1 2.83Å; T280-F283 PolarHBondContact O-N 2.95Å; T280-T284 PolarHBondContact O-N 3.45Å; T280-T284 PolarHBondContact O-OG1 3.3Å
281	R	57.8	Low	58.5	Low	155 Å²	155	76.1 Å²	76.1	59%	0.585	39%	0.387	S	S	*	.	H	α-helix	trans	-69.1	-32.9	178.3	-75.7	172.6	-175.1	173	3.4	113.7	S277 F278 T285 R344	S277-R281 WeakPolarHBondContact O-CD 3.5Å; S277-R281 VanDerWaalsContact O-CG 3.24Å; S277-R281 WeakPolarHBondContact O-CG 3.22Å; F278-R281 PolarHBondContact O-N 3.17Å; R281-T285 PolarHBondContact O-OG1 3.33Å; R281-R344 PolarHBondContact O-NH2 3.12Å
282	A	57.7	Low	61.1	Low	43 Å²	43	69.8 Å²	69.8	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-71.5	-42.4	174.7	0	0	0	0	0	111.1	F278 T284 T285 I286	F278-A282 PolarHBondContact O-N 3.39Å; A282-T284 PolarHBondContact O-N 2.72Å; A282-T285 PolarHBondContact O-N 3.16Å; A282-T285 VanDerWaalsContact O-N 3.11Å; A282-I286 PolarHBondContact O-N 3.06Å
283	F	63.8	Low	63.5	Low	31 Å²	31	63.9 Å²	63.9	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-57.1	-48.3	176.9	172.4	-102.2	0	0	0	112.7	Y228 I231 L232 K279 T280 T285 I286 L287	Y228-F283 AromaticContact CD2-CE2 3.86Å; Y228-F283 HydrophobicContact CD2-CE2 3.86Å; Y228-F283 HydrophobicContact CD2-CZ 4.36Å; Y228-F283 HydrophobicContact CE2-CD2 4.32Å; Y228-F283 HydrophobicContact CE2-CE1 4.46Å; Y228-F283 AromaticContact CE2-CE2 3.23Å; Y228-F283 HydrophobicContact CE2-CE2 3.23Å; Y228-F283 AromaticContact CE2-CZ 3.31Å; Y228-F283 HydrophobicContact CE2-CZ 3.31Å; Y228-F283 AromaticContact CZ-CE2 3.98Å; Y228-F283 AromaticContact CZ-CZ 3.7Å; Y228-F283 WeakPolarHBondContact OH-CZ 3.38Å; I231-F283 HydrophobicContact CG2-CD2 3.78Å; I231-F283 HydrophobicContact CG2-CE2 4.32Å; L232-F283 HydrophobicContact CD2-CD2 4.5Å; L232-F283 HydrophobicContact CD2-CE1 4.09Å; L232-F283 HydrophobicContact CD2-CE2 3.4Å; L232-F283 HydrophobicContact CD2-CZ 3.15Å; L232-F283 HydrophobicContact CG-CE2 3.62Å; L232-F283 HydrophobicContact CG-CZ 3.73Å; K279-F283 PolarHBondContact O-N 3.13Å; T280-F283 PolarHBondContact O-N 2.95Å; F283-T285 PolarHBondContact O-N 3.02Å; F283-T285 VanDerWaalsContact O-N 3.16Å; F283-I286 PolarHBondContact O-N 3.38Å; F283-L287 HydrophobicContact CE1-CD2 4.43Å; F283-L287 PolarHBondContact O-N 3.01Å; F283-L287 VanDerWaalsContact O-N 3.08Å
284	T	70.8	Confident	66.2	Low	50 Å²	50	56.5 Å²	56.5	31%	0.307	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-21.1	-180	-50.8	0	0	0	0	111.9	T280 A282 I288 R344	T280-T284 PolarHBondContact O-N 3.45Å; T280-T284 PolarHBondContact O-OG1 3.3Å; A282-T284 PolarHBondContact O-N 2.72Å; T284-I288 HydrophobicContact CG2-CD1 4.36Å; T284-I288 VanDerWaalsContact O-CG1 3.25Å; T284-I288 WeakPolarHBondContact O-CG1 3.25Å; T284-I288 PolarHBondContact O-N 2.77Å; T284-R344 PolarHBondContact O-NH1 2.86Å
285	T	72.1	Confident	68.6	Low	36 Å²	36	56.1 Å²	56.1	22%	0.221	30%	0.301	C	S	.	.	H	α-helix	trans	-76.1	-44.9	-179.7	-56.3	0	0	0	0	109	R281 A282 F283 L287 I288 L289 R344	R281-T285 PolarHBondContact O-OG1 3.33Å; A282-T285 PolarHBondContact O-N 3.16Å; A282-T285 VanDerWaalsContact O-N 3.11Å; F283-T285 PolarHBondContact O-N 3.02Å; F283-T285 VanDerWaalsContact O-N 3.16Å; T285-L287 VanDerWaalsContact C-N 3.32Å; T285-L287 PolarHBondContact O-N 2.99Å; T285-I288 PolarHBondContact O-N 2.84Å; T285-L289 HydrophobicContact CG2-CD1 4.21Å; T285-L289 WeakPolarHBondContact O-CG 3.48Å; T285-L289 PolarHBondContact O-N 3.47Å; T285-R344 HydrophobicContact CG2-CB 4.31Å; T285-R344 HydrophobicContact CG2-CG 4.45Å; T285-R344 PolarHBondContact OG1-NE 3.1Å; T285-R344 PolarHBondContact OG1-NH2 3.03Å
286	I	74.1	Confident	71.2	Confident	14 Å²	14	52.2 Å²	52.2	7%	0.072	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-42.6	177.8	-58.9	161.9	0	0	0	110.2	R142 I146 I231 A282 F283 I288 L289 F290	R142-I286 HydrophobicContact CB-CD1 3.49Å; R142-I286 VanDerWaalsContact CB-CD1 3.49Å; R142-I286 HydrophobicContact CB-CG1 4.23Å; R142-I286 HydrophobicContact CG-CD1 3.67Å; R142-I286 HydrophobicContact CG-CG1 3.99Å; I146-I286 HydrophobicContact CD1-CD1 4.1Å; I231-I286 HydrophobicContact CD1-CD1 4.1Å; A282-I286 PolarHBondContact O-N 3.06Å; F283-I286 PolarHBondContact O-N 3.38Å; I286-I288 PolarHBondContact O-N 3.05Å; I286-L289 PolarHBondContact O-N 3.28Å; I286-F290 WeakPolarHBondContact O-CB 3.41Å; I286-F290 PolarHBondContact O-N 3.27Å
287	L	79.9	Confident	73.6	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.246	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-46.4	176	177.7	57.4	0	0	0	112.1	Y228 F283 T285 L289 F290 V291	Y228-L287 HydrophobicContact CE1-CD1 4.48Å; Y228-L287 HydrophobicContact CE2-CB 4.04Å; Y228-L287 HydrophobicContact CE2-CD1 3.76Å; Y228-L287 HydrophobicContact CE2-CG 4.34Å; Y228-L287 WeakPolarHBondContact OH-CD1 3.35Å; F283-L287 HydrophobicContact CE1-CD2 4.43Å; F283-L287 PolarHBondContact O-N 3.01Å; F283-L287 VanDerWaalsContact O-N 3.08Å; T285-L287 VanDerWaalsContact C-N 3.32Å; T285-L287 PolarHBondContact O-N 2.99Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 2.94Å; L287-F290 PolarHBondContact O-N 2.98Å; L287-V291 HydrophobicContact CD1-CG2 3.74Å; L287-V291 HydrophobicContact CG-CG2 4.37Å; L287-V291 WeakPolarHBondContact O-CB 3.3Å; L287-V291 VanDerWaalsContact O-CG2 3.31Å; L287-V291 WeakPolarHBondContact O-CG2 3.36Å; L287-V291 PolarHBondContact O-N 3.31Å
288	I	83.3	Confident	76.1	Confident	48 Å²	48	50.9 Å²	50.9	25%	0.246	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-41.8	178.6	-70.4	-177.4	0	0	0	111.1	T284 T285 I286 G292 I340 W343	T284-I288 HydrophobicContact CG2-CD1 4.36Å; T284-I288 VanDerWaalsContact O-CG1 3.25Å; T284-I288 WeakPolarHBondContact O-CG1 3.25Å; T284-I288 PolarHBondContact O-N 2.77Å; T285-I288 PolarHBondContact O-N 2.84Å; I286-I288 PolarHBondContact O-N 3.05Å; I288-G292 WeakPolarHBondContact O-CA 3.22Å; I288-G292 PolarHBondContact O-N 3.24Å; I288-I340 HydrophobicContact CG2-CD1 3.85Å; I288-I340 HydrophobicContact CG2-CG1 4.05Å; I288-I340 HydrophobicContact CG2-CG2 4.43Å; I288-W343 HydrophobicContact CD1-CE3 4.44Å; I288-W343 HydrophobicContact CD1-CH2 4.32Å; I288-W343 HydrophobicContact CD1-CZ3 3.57Å
289	L	81.8	Confident	78.7	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-42.8	177	-67.6	174.3	0	0	0	111.7	L135 T285 I286 L287 F293 I340	L135-L289 HydrophobicContact CD2-CD2 4.43Å; T285-L289 HydrophobicContact CG2-CD1 4.21Å; T285-L289 WeakPolarHBondContact O-CG 3.48Å; T285-L289 PolarHBondContact O-N 3.47Å; I286-L289 PolarHBondContact O-N 3.28Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 2.94Å; L289-F293 VanDerWaalsContact O-CB 3.25Å; L289-F293 WeakPolarHBondContact O-CB 3.28Å; L289-F293 PolarHBondContact O-N 3.16Å; L289-I340 HydrophobicContact CD2-CD1 4.41Å; L289-I340 HydrophobicContact CD2-CG2 4.21Å
290	F	84.9	Confident	80.9	Confident	23 Å²	23	42.9 Å²	42.9	10%	0.101	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-47.2	177.3	170.1	-109.4	0	0	0	112.7	F221 M224 L225 I286 L287 F293 S294	F221-F290 AromaticContact CD2-CE2 3.75Å; F221-F290 HydrophobicContact CD2-CE2 3.75Å; F221-F290 HydrophobicContact CD2-CZ 4.05Å; F221-F290 AromaticContact CE2-CE2 3.73Å; F221-F290 HydrophobicContact CE2-CE2 3.73Å; F221-F290 AromaticContact CE2-CZ 3.53Å; F221-F290 HydrophobicContact CE2-CZ 3.53Å; F221-F290 HydrophobicContact CG-CE2 4.49Å; F221-F290 HydrophobicContact CZ-CE2 4.46Å; F221-F290 HydrophobicContact CZ-CZ 4Å; M224-F290 HydrophobicContact CB-CD2 3.7Å; M224-F290 HydrophobicContact CB-CE2 4.13Å; M224-F290 HydrophobicContact SD-CD2 4.48Å; L225-F290 HydrophobicContact CB-CE2 4.23Å; L225-F290 HydrophobicContact CB-CZ 4.18Å; L225-F290 HydrophobicContact CD1-CE1 4.43Å; L225-F290 HydrophobicContact CD1-CZ 4.03Å; I286-F290 WeakPolarHBondContact O-CB 3.41Å; I286-F290 PolarHBondContact O-N 3.27Å; L287-F290 PolarHBondContact O-N 2.98Å; F290-F293 PolarHBondContact O-N 3Å; F290-S294 WeakPolarHBondContact O-CB 3.49Å; F290-S294 PolarHBondContact O-N 3.2Å; F290-S294 PolarHBondContact O-OG 3.17Å
291	V	87.8	Confident	83	Confident	69 Å²	69	39.5 Å²	39.5	42%	0.418	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-44.6	178	172.3	0	0	0	0	110.1	L287 F293 S294 V295	L287-V291 HydrophobicContact CD1-CG2 3.74Å; L287-V291 HydrophobicContact CG-CG2 4.37Å; L287-V291 WeakPolarHBondContact O-CB 3.3Å; L287-V291 VanDerWaalsContact O-CG2 3.31Å; L287-V291 WeakPolarHBondContact O-CG2 3.36Å; L287-V291 PolarHBondContact O-N 3.31Å; V291-F293 PolarHBondContact O-N 2.93Å; V291-S294 PolarHBondContact O-N 3.03Å; V291-V295 HydrophobicContact CG1-CG2 4.18Å; V291-V295 WeakPolarHBondContact O-CB 3.25Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 2.95Å
292	G	88.5	Confident	84.8	Confident	26 Å²	26	35.4 Å²	35.4	27%	0.268	21%	0.212	S	C	.	.	H	α-helix	trans	-58.5	-48	176.1	0	0	0	0	0	112	I288 S294 C296	I288-G292 WeakPolarHBondContact O-CA 3.22Å; I288-G292 PolarHBondContact O-N 3.24Å; G292-S294 PolarHBondContact O-N 3.26Å; G292-C296 VanDerWaalsContact O-CB 3.25Å; G292-C296 WeakPolarHBondContact O-CB 3.11Å; G292-C296 PolarHBondContact O-N 2.87Å; G292-C296 PolarHBondContact O-SG 3.3Å
293	F	89.6	Confident	86.5	Confident	8 Å²	8	34 Å²	34	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-55.5	-51.2	173	166.4	-95.5	0	0	0	111.6	V132 L135 V216 F217 P220 F221 M224 L289 F290 V291 V295 C296 W297	V132-F293 HydrophobicContact CG1-CE2 4.11Å; V132-F293 HydrophobicContact CG2-CD2 4.38Å; V132-F293 HydrophobicContact CG2-CE2 3.76Å; L135-F293 HydrophobicContact CD1-CB 4.39Å; L135-F293 HydrophobicContact CD1-CD2 4.14Å; V216-F293 WeakPolarHBondContact O-CE2 3.47Å; V216-F293 VanDerWaalsContact O-CZ 3.24Å; V216-F293 WeakPolarHBondContact O-CZ 3.39Å; F217-F293 HydrophobicContact CD2-CE1 4.13Å; F217-F293 HydrophobicContact CD2-CZ 4.13Å; F217-F293 HydrophobicContact CE2-CE1 4.3Å; P220-F293 HydrophobicContact CB-CE1 4.45Å; P220-F293 HydrophobicContact CB-CE2 4.49Å; P220-F293 HydrophobicContact CB-CZ 3.88Å; F221-F293 HydrophobicContact CB-CE1 4.19Å; M224-F293 HydrophobicContact CE-CD1 3.7Å; M224-F293 HydrophobicContact CE-CD2 4.02Å; M224-F293 HydrophobicContact CE-CE1 3.64Å; M224-F293 HydrophobicContact CE-CE2 3.99Å; M224-F293 HydrophobicContact CE-CG 3.9Å; M224-F293 HydrophobicContact CE-CZ 3.8Å; M224-F293 HydrophobicContact SD-CD1 4.24Å; M224-F293 HydrophobicContact SD-CG 4.43Å; L289-F293 VanDerWaalsContact O-CB 3.25Å; L289-F293 WeakPolarHBondContact O-CB 3.28Å; L289-F293 PolarHBondContact O-N 3.16Å; F290-F293 PolarHBondContact O-N 3Å; V291-F293 PolarHBondContact O-N 2.93Å; F293-V295 PolarHBondContact O-N 3.38Å; F293-C296 PolarHBondContact O-N 3.36Å; F293-W297 AromaticContact CD2-CD1 3.27Å; F293-W297 HydrophobicContact CD2-CG 4.18Å; F293-W297 AromaticContact CD2-NE1 3.87Å; F293-W297 HydrophobicContact CE2-CB 4.35Å; F293-W297 AromaticContact CE2-CD1 3.45Å; F293-W297 VanDerWaalsContact CE2-CD1 3.45Å; F293-W297 AromaticContact CE2-CG 3.99Å; F293-W297 HydrophobicContact CE2-CG 3.99Å; F293-W297 VanDerWaalsContact O-CB 3.29Å; F293-W297 WeakPolarHBondContact O-CB 3.21Å; F293-W297 PolarHBondContact O-N 3Å
294	S	90.8	Very high	87.8	Confident	16 Å²	16	33.6 Å²	33.6	11%	0.112	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-46.6	-175.1	-56.6	0	0	0	0	112.1	F221 F290 V291 G292 L298	F221-S294 WeakPolarHBondContact CE2-OG 3.29Å; F290-S294 WeakPolarHBondContact O-CB 3.49Å; F290-S294 PolarHBondContact O-N 3.2Å; F290-S294 PolarHBondContact O-OG 3.17Å; V291-S294 PolarHBondContact O-N 3.03Å; G292-S294 PolarHBondContact O-N 3.26Å; S294-L298 WeakPolarHBondContact O-CB 3.35Å; S294-L298 PolarHBondContact O-N 2.64Å
295	V	92.1	Very high	89	Confident	81 Å²	81	33.1 Å²	33.1	49%	0.491	20%	0.195	S	C	.	.	H	α-helix	trans	-65.6	-41	178.7	172.5	0	0	0	0	110.8	V291 F293 P299 L329	V291-V295 HydrophobicContact CG1-CG2 4.18Å; V291-V295 WeakPolarHBondContact O-CB 3.25Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 2.95Å; F293-V295 PolarHBondContact O-N 3.38Å; V295-P299 WeakPolarHBondContact O-CD 3.4Å; V295-L329 HydrophobicContact CG1-CD1 4.46Å; V295-L329 HydrophobicContact CG1-CD2 4.43Å; V295-L329 WeakPolarHBondContact O-CD2 3.29Å
296	C	92.8	Very high	90	Very high	4 Å²	4	35 Å²	35	3%	0.027	20%	0.203	C	C	.	.	H	α-helix	trans	-72.4	-31.9	-178.2	-63.6	0	0	0	0	113.5	G292 F293 L329 S330 K333	G292-C296 VanDerWaalsContact O-CB 3.25Å; G292-C296 WeakPolarHBondContact O-CB 3.11Å; G292-C296 PolarHBondContact O-N 2.87Å; G292-C296 PolarHBondContact O-SG 3.3Å; F293-C296 PolarHBondContact O-N 3.36Å; C296-L329 WeakPolarHBondContact CB-O 2.84Å; C296-L329 PolarHBondContact SG-O 3.36Å; C296-S330 WeakPolarHBondContact O-CA 3.11Å; C296-S330 PolarHBondContact O-N 2.99Å; C296-K333 HydrophobicContact CB-CB 4.36Å
297	W	93.9	Very high	90.7	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-104.4	-29.6	-170.2	-78.6	112	0	0	0	115.5	V128 V216 F217 F293 H300 T301 K333	V128-W297 HydrophobicContact CB-CH2 3.75Å; V128-W297 HydrophobicContact CB-CZ2 3.95Å; V128-W297 HydrophobicContact CG1-CH2 3.1Å; V128-W297 HydrophobicContact CG1-CZ2 3.31Å; V128-W297 HydrophobicContact CG1-CZ3 3.84Å; V128-W297 HydrophobicContact CG2-CH2 3.29Å; V128-W297 HydrophobicContact CG2-CZ2 3.69Å; V128-W297 HydrophobicContact CG2-CZ3 4.44Å; V216-W297 HydrophobicContact CG1-CD2 3.91Å; V216-W297 HydrophobicContact CG1-CE3 3.68Å; V216-W297 HydrophobicContact CG1-CH2 4.32Å; V216-W297 HydrophobicContact CG1-CZ2 4.39Å; V216-W297 HydrophobicContact CG1-CZ3 3.93Å; F217-W297 HydrophobicContact CD2-CB 3.88Å; F217-W297 HydrophobicContact CE2-CB 4.41Å; F293-W297 AromaticContact CD2-CD1 3.27Å; F293-W297 HydrophobicContact CD2-CG 4.18Å; F293-W297 AromaticContact CD2-NE1 3.87Å; F293-W297 HydrophobicContact CE2-CB 4.35Å; F293-W297 AromaticContact CE2-CD1 3.45Å; F293-W297 VanDerWaalsContact CE2-CD1 3.45Å; F293-W297 AromaticContact CE2-CG 3.99Å; F293-W297 HydrophobicContact CE2-CG 3.99Å; F293-W297 VanDerWaalsContact O-CB 3.29Å; F293-W297 WeakPolarHBondContact O-CB 3.21Å; F293-W297 PolarHBondContact O-N 3Å; W297-H300 HydrophobicContact CE3-CB 4.4Å; W297-H300 AromaticContact CZ3-ND1 3.98Å; W297-H300 PolarHBondContact O-N 3.04Å; W297-T301 WeakPolarHBondContact O-CB 3.36Å; W297-T301 PolarHBondContact O-N 3.48Å; W297-T301 PolarHBondContact O-OG1 3.49Å; W297-K333 VanDerWaalsContact NE1-NZ 3.13Å
298	L	94.9	Very high	91.1	Very high	83 Å²	83	32.2 Å²	32.2	44%	0.435	19%	0.189	S	C	.	.	H	α-helix	trans	-58.8	-49.4	-177.4	174.4	66.2	0	0	0	111.6	F217 S294 H300 T301 V302	F217-L298 HydrophobicContact CD1-CD1 4.5Å; F217-L298 HydrophobicContact CE1-CD1 3.63Å; F217-L298 HydrophobicContact CE2-CB 3.73Å; F217-L298 HydrophobicContact CE2-CD1 4.31Å; F217-L298 HydrophobicContact CZ-CB 3.72Å; F217-L298 HydrophobicContact CZ-CD1 3.52Å; F217-L298 HydrophobicContact CZ-CG 4.14Å; S294-L298 WeakPolarHBondContact O-CB 3.35Å; S294-L298 PolarHBondContact O-N 2.64Å; L298-H300 PolarHBondContact O-N 3.14Å; L298-T301 PolarHBondContact O-N 3.4Å; L298-V302 HydrophobicContact CD1-CG2 3.95Å; L298-V302 HydrophobicContact CG-CG2 4.45Å; L298-V302 WeakPolarHBondContact O-CG2 3.42Å; L298-V302 PolarHBondContact O-N 3.06Å
299	P	95.9	Very high	91.5	Very high	48 Å²	48	34.6 Å²	34.6	31%	0.312	20%	0.198	S	C	.	.	H	α-helix	trans	-63.8	-41.7	-178.3	-27.4	41.7	0	0	0	112.6	V295 T301 V302 V303 A326 L329	V295-P299 WeakPolarHBondContact O-CD 3.4Å; P299-T301 VanDerWaalsContact C-N 3.32Å; P299-T301 PolarHBondContact O-N 3.47Å; P299-V302 PolarHBondContact O-N 2.82Å; P299-V303 WeakPolarHBondContact O-CB 3.4Å; P299-V303 VanDerWaalsContact O-CG2 3.29Å; P299-V303 WeakPolarHBondContact O-CG2 3.26Å; P299-V303 PolarHBondContact O-N 3.44Å; P299-A326 HydrophobicContact CB-CB 4.24Å; P299-L329 HydrophobicContact CB-CD2 4.26Å; P299-L329 HydrophobicContact CG-CD2 3.66Å
300	H	94.4	Very high	91.9	Very high	19 Å²	19	35.4 Å²	35.4	9%	0.088	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-41.8	176.6	-176.3	-80.9	0	0	0	112	Y124 W125 W297 L298 S304	Y124-H300 AromaticContact CE1-CE1 3.85Å; Y124-H300 AromaticContact CE1-NE2 3.86Å; Y124-H300 AromaticContact CZ-NE2 3.72Å; Y124-H300 PolarHBondContact OH-CD2 3.1Å; Y124-H300 PolarHBondContact OH-CE1 3.32Å; Y124-H300 VanDerWaalsContact OH-CE1 3.29Å; Y124-H300 PolarHBondContact OH-NE2 3.44Å; W125-H300 AromaticContact CH2-CE1 3.54Å; W125-H300 AromaticContact CH2-ND1 3.99Å; W125-H300 AromaticContact CZ2-CE1 3.91Å; W297-H300 HydrophobicContact CE3-CB 4.4Å; W297-H300 AromaticContact CZ3-ND1 3.98Å; W297-H300 PolarHBondContact O-N 3.04Å; L298-H300 PolarHBondContact O-N 3.14Å; H300-S304 PolarHBondContact CE1-OG 3.12Å; H300-S304 VanDerWaalsContact O-CB 3.3Å; H300-S304 WeakPolarHBondContact O-CB 3.44Å; H300-S304 PolarHBondContact O-N 3.34Å; H300-S304 PolarHBondContact O-OG 3.41Å
301	T	95.1	Very high	92	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-46.2	179	-54.4	0	0	0	0	111.2	A213 F217 F218 W297 L298 P299 S304 L305	A213-T301 HydrophobicContact CB-CG2 3.71Å; F217-T301 HydrophobicContact CB-CG2 3.91Å; F217-T301 WeakPolarHBondContact CB-OG1 3.29Å; F217-T301 HydrophobicContact CD1-CG2 4.42Å; F217-T301 HydrophobicContact CG-CG2 4.32Å; F218-T301 HydrophobicContact CE2-CG2 4.23Å; W297-T301 WeakPolarHBondContact O-CB 3.36Å; W297-T301 PolarHBondContact O-N 3.48Å; W297-T301 PolarHBondContact O-OG1 3.49Å; L298-T301 PolarHBondContact O-N 3.4Å; P299-T301 VanDerWaalsContact C-N 3.32Å; P299-T301 PolarHBondContact O-N 3.47Å; T301-S304 PolarHBondContact O-N 2.89Å; T301-L305 HydrophobicContact CG2-CD1 4.27Å; T301-L305 WeakPolarHBondContact O-CG 2.96Å; T301-L305 PolarHBondContact O-N 3.31Å
302	V	95.8	Very high	92.1	Very high	70 Å²	70	46.7 Å²	46.7	42%	0.424	25%	0.247	S	C	.	.	H	α-helix	trans	-61.3	-48.5	178	171.7	0	0	0	0	110.8	L298 P299 S304 L305 L306	L298-V302 HydrophobicContact CD1-CG2 3.95Å; L298-V302 HydrophobicContact CG-CG2 4.45Å; L298-V302 WeakPolarHBondContact O-CG2 3.42Å; L298-V302 PolarHBondContact O-N 3.06Å; P299-V302 PolarHBondContact O-N 2.82Å; V302-S304 VanDerWaalsContact C-N 3.34Å; V302-S304 PolarHBondContact O-N 2.94Å; V302-L305 PolarHBondContact O-N 3.41Å; V302-L306 HydrophobicContact CG1-CD1 3.89Å; V302-L306 HydrophobicContact CG1-CG 4.39Å; V302-L306 WeakPolarHBondContact O-CG 3.44Å; V302-L306 PolarHBondContact O-N 2.9Å
303	V	94.4	Very high	92.2	Very high	13 Å²	13	47.4 Å²	47.4	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-40.1	179.7	174.4	0	0	0	0	111.6	P299 L305 L306 A307 F313 F319 V322 A326	P299-V303 WeakPolarHBondContact O-CB 3.4Å; P299-V303 VanDerWaalsContact O-CG2 3.29Å; P299-V303 WeakPolarHBondContact O-CG2 3.26Å; P299-V303 PolarHBondContact O-N 3.44Å; V303-L305 PolarHBondContact O-N 2.91Å; V303-L306 PolarHBondContact O-N 2.93Å; V303-A307 VanDerWaalsContact O-CB 3.28Å; V303-A307 WeakPolarHBondContact O-CB 3.41Å; V303-A307 PolarHBondContact O-N 3.18Å; V303-F313 HydrophobicContact CG1-CE1 4.15Å; V303-F313 HydrophobicContact CG1-CZ 4.32Å; V303-F319 HydrophobicContact CG1-CE2 4.48Å; V303-V322 HydrophobicContact CG2-CG1 3.59Å; V303-A326 HydrophobicContact CB-CB 4.3Å; V303-A326 HydrophobicContact CG2-CB 3.97Å
304	S	91.8	Very high	92.1	Very high	23 Å²	23	47.1 Å²	47.1	16%	0.161	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-40	177.6	-60.1	0	0	0	0	112.4	H300 T301 V302 V308	H300-S304 PolarHBondContact CE1-OG 3.12Å; H300-S304 VanDerWaalsContact O-CB 3.3Å; H300-S304 WeakPolarHBondContact O-CB 3.44Å; H300-S304 PolarHBondContact O-N 3.34Å; H300-S304 PolarHBondContact O-OG 3.41Å; T301-S304 PolarHBondContact O-N 2.89Å; V302-S304 VanDerWaalsContact C-N 3.34Å; V302-S304 PolarHBondContact O-N 2.94Å; S304-V308 WeakPolarHBondContact O-CG2 3.46Å; S304-V308 PolarHBondContact O-N 3.29Å
305	L	94.2	Very high	91.9	Very high	39 Å²	39	50.9 Å²	50.9	20%	0.204	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-47.3	174.9	-70.6	170.2	0	0	0	110.8	T209 V210 A213 F218 T301 V302 V303 A307 V308 F309	T209-L305 HydrophobicContact CG2-CD2 4.33Å; V210-L305 HydrophobicContact CG2-CD2 4.15Å; A213-L305 HydrophobicContact CB-CD1 4.2Å; A213-L305 HydrophobicContact CB-CD2 3.98Å; A213-L305 HydrophobicContact CB-CG 4.19Å; F218-L305 HydrophobicContact CE2-CD1 4.23Å; F218-L305 HydrophobicContact CZ-CD1 4.47Å; T301-L305 HydrophobicContact CG2-CD1 4.27Å; T301-L305 WeakPolarHBondContact O-CG 2.96Å; T301-L305 PolarHBondContact O-N 3.31Å; V302-L305 PolarHBondContact O-N 3.41Å; V303-L305 PolarHBondContact O-N 2.91Å; L305-A307 VanDerWaalsContact C-N 3.29Å; L305-A307 PolarHBondContact O-N 3.04Å; L305-V308 PolarHBondContact O-N 3.27Å; L305-V308 VanDerWaalsContact O-N 3.16Å; L305-F309 HydrophobicContact CD2-CD2 4.46Å; L305-F309 HydrophobicContact CD2-CE2 4.04Å; L305-F309 VanDerWaalsContact O-CD2 3.29Å; L305-F309 WeakPolarHBondContact O-CD2 3.18Å; L305-F309 PolarHBondContact O-N 3.21Å
306	L	93.4	Very high	91.6	Very high	75 Å²	75	48.4 Å²	48.4	39%	0.393	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-39.8	177.3	-70.6	174.2	0	0	0	112.2	V302 V303 V308 S310 F313	V302-L306 HydrophobicContact CG1-CD1 3.89Å; V302-L306 HydrophobicContact CG1-CG 4.39Å; V302-L306 WeakPolarHBondContact O-CG 3.44Å; V302-L306 PolarHBondContact O-N 2.9Å; V303-L306 PolarHBondContact O-N 2.93Å; L306-V308 PolarHBondContact O-N 3.44Å; L306-S310 WeakPolarHBondContact O-CB 3.21Å; L306-S310 PolarHBondContact O-N 2.86Å; L306-F313 HydrophobicContact CB-CD1 3.5Å; L306-F313 HydrophobicContact CB-CE1 3.65Å; L306-F313 HydrophobicContact CB-CG 4.13Å; L306-F313 HydrophobicContact CB-CZ 4.41Å; L306-F313 HydrophobicContact CD1-CE1 4.42Å; L306-F313 HydrophobicContact CD1-CZ 4.39Å
307	A	89	Confident	91.2	Very high	3 Å²	3	51.9 Å²	51.9	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-57	-38.6	177.2	0	0	0	0	0	112.4	Y199 V303 L305 Y314 F319	Y199-A307 VanDerWaalsContact CA-O 3.22Å; Y199-A307 WeakPolarHBondContact CA-O 3.29Å; Y199-A307 PolarHBondContact N-O 3.44Å; V303-A307 VanDerWaalsContact O-CB 3.28Å; V303-A307 WeakPolarHBondContact O-CB 3.41Å; V303-A307 PolarHBondContact O-N 3.18Å; L305-A307 VanDerWaalsContact C-N 3.29Å; L305-A307 PolarHBondContact O-N 3.04Å; A307-Y314 HydrophobicContact CB-CD2 4.19Å; A307-F319 HydrophobicContact CB-CE2 3.63Å; A307-F319 HydrophobicContact CB-CZ 4.11Å
308	V	88.9	Confident	91	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-89.2	-33.3	-172.6	166.7	0	0	0	0	112.4	G198 R206 T209 S304 L305 L306	G198-V308 WeakPolarHBondContact O-CG2 3.49Å; R206-V308 HydrophobicContact CB-CG1 4.23Å; R206-V308 HydrophobicContact CG-CG1 3.72Å; T209-V308 HydrophobicContact CG2-CB 4.19Å; T209-V308 HydrophobicContact CG2-CG1 4.46Å; T209-V308 HydrophobicContact CG2-CG2 3.83Å; T209-V308 WeakPolarHBondContact OG1-CG2 3.44Å; S304-V308 WeakPolarHBondContact O-CG2 3.46Å; S304-V308 PolarHBondContact O-N 3.29Å; L305-V308 PolarHBondContact O-N 3.27Å; L305-V308 VanDerWaalsContact O-N 3.16Å; L306-V308 PolarHBondContact O-N 3.44Å
309	F	90.8	Very high	90.7	Very high	99 Å²	99	52.8 Å²	52.8	43%	0.434	27%	0.267	S	S	.	.	H	α-helix	trans	-95.6	-27.9	-177.1	-74.9	-79.2	0	0	0	114.4	R206 V210 L305	R206-F309 HydrophobicContact CB-CE1 4.06Å; R206-F309 HydrophobicContact CB-CZ 3.98Å; R206-F309 HydrophobicContact CG-CE1 4.15Å; R206-F309 HydrophobicContact CG-CZ 4.43Å; V210-F309 HydrophobicContact CG2-CE2 3.75Å; V210-F309 HydrophobicContact CG2-CZ 3.7Å; L305-F309 HydrophobicContact CD2-CD2 4.46Å; L305-F309 HydrophobicContact CD2-CE2 4.04Å; L305-F309 VanDerWaalsContact O-CD2 3.29Å; L305-F309 WeakPolarHBondContact O-CD2 3.18Å; L305-F309 PolarHBondContact O-N 3.21Å
310	S	90.7	Very high	90.3	Very high	38 Å²	38	50.9 Å²	50.9	27%	0.266	25%	0.254	S	S	.	.			trans	-110.6	105.3	-175.6	178.3	0	0	0	0	111.5	L306 Q312 F313 Y314	L306-S310 WeakPolarHBondContact O-CB 3.21Å; L306-S310 PolarHBondContact O-N 2.86Å; S310-Q312 VanDerWaalsContact C-N 3.27Å; S310-Q312 PolarHBondContact O-N 2.98Å; S310-F313 PolarHBondContact O-N 3.33Å; S310-F313 WeakPolarHBondContact OG-CB 3.5Å; S310-F313 PolarHBondContact OG-N 2.82Å; S310-F313 VanDerWaalsContact OG-N 3.12Å; S310-Y314 WeakPolarHBondContact O-CB 3.41Å; S310-Y314 PolarHBondContact O-N 3.46Å
311	R	87.9	Confident	90	Very high	158 Å²	158	52.7 Å²	52.7	60%	0.596	27%	0.267	S	S	*	.	H	α-helix	trans	-56.7	-44.2	172.1	-168.9	173.9	174.1	-174.7	-3.1	111.1	Y199 F313 Y314 Y315	Y199-R311 HydrophobicContact CD1-CG 4.45Å; Y199-R311 HydrophobicContact CD2-CB 4.15Å; Y199-R311 HydrophobicContact CE1-CB 4.21Å; Y199-R311 HydrophobicContact CE1-CG 4.09Å; Y199-R311 HydrophobicContact CE2-CB 3.62Å; Y199-R311 HydrophobicContact CE2-CG 4.36Å; R311-F313 VanDerWaalsContact C-N 3.35Å; R311-F313 PolarHBondContact O-N 3.32Å; R311-Y314 PolarHBondContact O-N 2.78Å; R311-Y315 HydrophobicContact CG-CD2 3.66Å; R311-Y315 HydrophobicContact CG-CE2 3.77Å; R311-Y315 VanDerWaalsContact O-CD2 3.3Å; R311-Y315 WeakPolarHBondContact O-CD2 3.49Å; R311-Y315 PolarHBondContact O-N 3.44Å
312	Q	89.6	Confident	89.8	Confident	172 Å²	172	55.2 Å²	55.2	80%	0.804	28%	0.282	S	S	*	.	H	α-helix	trans	-64.1	-39	-178.4	-171.5	170.7	15.3	0	0	112.3	S310 S316	S310-Q312 VanDerWaalsContact C-N 3.27Å; S310-Q312 PolarHBondContact O-N 2.98Å; Q312-S316 VanDerWaalsContact O-CB 3.26Å; Q312-S316 WeakPolarHBondContact O-CB 3.48Å; Q312-S316 PolarHBondContact O-N 3.48Å
313	F	90.3	Very high	89.6	Confident	40 Å²	40	52.4 Å²	52.4	18%	0.175	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-45.3	174.7	179.7	-106.2	0	0	0	111.3	V303 L306 S310 R311 Y315 S316 F319 V322	V303-F313 HydrophobicContact CG1-CE1 4.15Å; V303-F313 HydrophobicContact CG1-CZ 4.32Å; L306-F313 HydrophobicContact CB-CD1 3.5Å; L306-F313 HydrophobicContact CB-CE1 3.65Å; L306-F313 HydrophobicContact CB-CG 4.13Å; L306-F313 HydrophobicContact CB-CZ 4.41Å; L306-F313 HydrophobicContact CD1-CE1 4.42Å; L306-F313 HydrophobicContact CD1-CZ 4.39Å; S310-F313 PolarHBondContact O-N 3.33Å; S310-F313 WeakPolarHBondContact OG-CB 3.5Å; S310-F313 PolarHBondContact OG-N 2.82Å; S310-F313 VanDerWaalsContact OG-N 3.12Å; R311-F313 VanDerWaalsContact C-N 3.35Å; R311-F313 PolarHBondContact O-N 3.32Å; F313-Y315 VanDerWaalsContact C-N 3.26Å; F313-Y315 PolarHBondContact O-N 3.48Å; F313-S316 WeakPolarHBondContact O-CB 3.46Å; F313-S316 PolarHBondContact O-N 2.82Å; F313-F319 AromaticContact CD1-CD2 3.93Å; F313-F319 HydrophobicContact CD1-CD2 3.93Å; F313-F319 HydrophobicContact CD1-CE2 4.47Å; F313-F319 AromaticContact CE1-CD2 3.53Å; F313-F319 HydrophobicContact CE1-CD2 3.53Å; F313-F319 HydrophobicContact CE1-CE2 4.03Å; F313-F319 HydrophobicContact CZ-CD2 4.12Å; F313-V322 HydrophobicContact CZ-CG1 4.19Å
314	Y	87.1	Confident	89.3	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-67.9	-18.7	-179	-173.4	-99.5	0	0	0	114	W191 Y199 A307 S310 R311 F319	W191-Y314 WeakPolarHBondContact CH2-O 3.12Å; W191-Y314 WeakPolarHBondContact CZ3-O 3.34Å; Y199-Y314 VanDerWaalsContact CB-CD1 3.42Å; A307-Y314 HydrophobicContact CB-CD2 4.19Å; S310-Y314 WeakPolarHBondContact O-CB 3.41Å; S310-Y314 PolarHBondContact O-N 3.46Å; R311-Y314 PolarHBondContact O-N 2.78Å; Y314-F319 HydrophobicContact CD2-CD2 4.37Å; Y314-F319 AromaticContact CD2-CE1 3.94Å; Y314-F319 HydrophobicContact CD2-CE1 3.94Å; Y314-F319 AromaticContact CD2-CE2 3.84Å; Y314-F319 HydrophobicContact CD2-CE2 3.84Å; Y314-F319 AromaticContact CD2-CZ 3.57Å; Y314-F319 HydrophobicContact CD2-CZ 3.57Å; Y314-F319 AromaticContact CE2-CE1 3.72Å; Y314-F319 HydrophobicContact CE2-CE1 3.72Å; Y314-F319 HydrophobicContact CE2-CE2 4.31Å; Y314-F319 AromaticContact CE2-CZ 3.57Å; Y314-F319 HydrophobicContact CE2-CZ 3.57Å
315	Y	86.2	Confident	89.3	Confident	95 Å²	95	53.3 Å²	53.3	37%	0.373	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	9.4	173	-68.1	-73.6	0	0	0	113.1	W191 R311 F313	W191-Y315 HydrophobicContact CB-CD1 4.09Å; W191-Y315 HydrophobicContact CB-CE1 4.1Å; W191-Y315 AromaticContact CD1-CD1 3.77Å; W191-Y315 HydrophobicContact CD2-CD1 4.05Å; W191-Y315 VanDerWaalsContact CE2-C 3.5Å; W191-Y315 AromaticContact CG-CD1 3.66Å; W191-Y315 HydrophobicContact CG-CD1 3.66Å; W191-Y315 HydrophobicContact CG-CE1 4.18Å; W191-Y315 VanDerWaalsContact CZ2-CA 3.44Å; W191-Y315 WeakPolarHBondContact CZ2-O 3.36Å; W191-Y315 PolarHBondContact NE1-O 3.44Å; R311-Y315 HydrophobicContact CG-CD2 3.66Å; R311-Y315 HydrophobicContact CG-CE2 3.77Å; R311-Y315 VanDerWaalsContact O-CD2 3.3Å; R311-Y315 WeakPolarHBondContact O-CD2 3.49Å; R311-Y315 PolarHBondContact O-N 3.44Å; F313-Y315 VanDerWaalsContact C-N 3.26Å; F313-Y315 PolarHBondContact O-N 3.48Å
316	S	87	Confident	89.3	Confident	29 Å²	29	51.7 Å²	51.7	20%	0.203	27%	0.27	C	S	.	.	S	Bend	trans	-84.9	136.5	178.2	170.4	0	0	0	0	112.4	W191 Q312 F313 I318 F319	W191-S316 WeakPolarHBondContact CH2-O 3.3Å; W191-S316 WeakPolarHBondContact CZ2-O 3.47Å; Q312-S316 VanDerWaalsContact O-CB 3.26Å; Q312-S316 WeakPolarHBondContact O-CB 3.48Å; Q312-S316 PolarHBondContact O-N 3.48Å; F313-S316 WeakPolarHBondContact O-CB 3.46Å; F313-S316 PolarHBondContact O-N 2.82Å; S316-I318 PolarHBondContact O-N 3.08Å; S316-I318 PolarHBondContact OG-N 3.45Å; S316-F319 WeakPolarHBondContact O-CB 3.38Å; S316-F319 PolarHBondContact O-N 3.16Å
317	P	84.6	Confident	89.2	Confident	77 Å²	77	49 Å²	49	50%	0.5	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-14.6	-179.4	24.6	-35.7	0	0	0	114.2	P37 P321	P37-P317 WeakPolarHBondContact CG-O 2.97Å; P317-P321 WeakPolarHBondContact O-CD 2.63Å
318	I	88.1	Confident	89.4	Confident	102 Å²	102	50.5 Å²	50.5	52%	0.523	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.8	177.7	-60.7	168.5	0	0	0	112.4	S316 Y320 P321 V322	S316-I318 PolarHBondContact O-N 3.08Å; S316-I318 PolarHBondContact OG-N 3.45Å; I318-Y320 PolarHBondContact O-N 2.77Å; I318-P321 VanDerWaalsContact O-CD 3.26Å; I318-P321 WeakPolarHBondContact O-CD 3.47Å; I318-P321 VanDerWaalsContact O-CG 3.28Å; I318-P321 WeakPolarHBondContact O-CG 3.46Å; I318-V322 HydrophobicContact CG2-CG2 3.56Å; I318-V322 WeakPolarHBondContact O-CB 3.43Å; I318-V322 VanDerWaalsContact O-CG2 3.29Å; I318-V322 WeakPolarHBondContact O-CG2 3.4Å; I318-V322 PolarHBondContact O-N 2.86Å; I318-V322 VanDerWaalsContact O-N 3.16Å
319	F	89.2	Confident	89.6	Confident	1 Å²	1	53 Å²	53	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-57.3	-51	-176.4	174.1	-105.3	0	0	0	113.1	W191 A192 V196 V303 A307 F313 Y314 S316 V322 S323	W191-F319 HydrophobicContact CE3-CD1 4.25Å; W191-F319 HydrophobicContact CH2-CB 3.31Å; W191-F319 AromaticContact CH2-CD1 3.87Å; W191-F319 HydrophobicContact CH2-CD1 3.87Å; W191-F319 AromaticContact CH2-CG 3.89Å; W191-F319 HydrophobicContact CH2-CG 3.89Å; W191-F319 HydrophobicContact CZ3-CB 3.63Å; W191-F319 AromaticContact CZ3-CD1 3.21Å; W191-F319 HydrophobicContact CZ3-CD1 3.21Å; W191-F319 AromaticContact CZ3-CE1 3.97Å; W191-F319 HydrophobicContact CZ3-CE1 3.97Å; W191-F319 AromaticContact CZ3-CG 3.64Å; W191-F319 HydrophobicContact CZ3-CG 3.64Å; A192-F319 HydrophobicContact CB-CD1 4.04Å; A192-F319 HydrophobicContact CB-CE1 3.95Å; V196-F319 HydrophobicContact CG2-CE1 4.4Å; V196-F319 HydrophobicContact CG2-CZ 4.13Å; V303-F319 HydrophobicContact CG1-CE2 4.48Å; A307-F319 HydrophobicContact CB-CE2 3.63Å; A307-F319 HydrophobicContact CB-CZ 4.11Å; F313-F319 AromaticContact CD1-CD2 3.93Å; F313-F319 HydrophobicContact CD1-CD2 3.93Å; F313-F319 HydrophobicContact CD1-CE2 4.47Å; F313-F319 AromaticContact CE1-CD2 3.53Å; F313-F319 HydrophobicContact CE1-CD2 3.53Å; F313-F319 HydrophobicContact CE1-CE2 4.03Å; F313-F319 HydrophobicContact CZ-CD2 4.12Å; Y314-F319 HydrophobicContact CD2-CD2 4.37Å; Y314-F319 AromaticContact CD2-CE1 3.94Å; Y314-F319 HydrophobicContact CD2-CE1 3.94Å; Y314-F319 AromaticContact CD2-CE2 3.84Å; Y314-F319 HydrophobicContact CD2-CE2 3.84Å; Y314-F319 AromaticContact CD2-CZ 3.57Å; Y314-F319 HydrophobicContact CD2-CZ 3.57Å; Y314-F319 AromaticContact CE2-CE1 3.72Å; Y314-F319 HydrophobicContact CE2-CE1 3.72Å; Y314-F319 HydrophobicContact CE2-CE2 4.31Å; Y314-F319 AromaticContact CE2-CZ 3.57Å; Y314-F319 HydrophobicContact CE2-CZ 3.57Å; S316-F319 WeakPolarHBondContact O-CB 3.38Å; S316-F319 PolarHBondContact O-N 3.16Å; F319-V322 PolarHBondContact O-N 2.79Å; F319-S323 WeakPolarHBondContact O-CB 3.48Å; F319-S323 PolarHBondContact O-N 3.15Å
320	Y	86.8	Confident	89.7	Confident	9 Å²	9	48.3 Å²	48.3	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-53.2	-174.4	177.7	-113.7	0	0	0	112.2	P37 I39 P193 Q194 I318 V322 S323 I324	P37-Y320 HydrophobicContact CG-CD1 4.44Å; I39-Y320 HydrophobicContact CD1-CD1 3.87Å; I39-Y320 HydrophobicContact CD1-CE1 3.62Å; P193-Y320 HydrophobicContact CG-CD2 4.05Å; P193-Y320 HydrophobicContact CG-CE1 4.25Å; P193-Y320 HydrophobicContact CG-CE2 3.51Å; Q194-Y320 HydrophobicContact CB-CE2 4.44Å; Q194-Y320 HydrophobicContact CG-CD2 4.31Å; I318-Y320 PolarHBondContact O-N 2.77Å; Y320-V322 VanDerWaalsContact C-N 3.33Å; Y320-V322 PolarHBondContact O-N 2.9Å; Y320-S323 PolarHBondContact O-N 3.41Å; Y320-I324 HydrophobicContact CD1-CD1 4.19Å; Y320-I324 HydrophobicContact CD2-CD1 3.76Å; Y320-I324 HydrophobicContact CD2-CG1 4.28Å; Y320-I324 HydrophobicContact CE1-CD1 3.63Å; Y320-I324 HydrophobicContact CE2-CD1 3.13Å; Y320-I324 HydrophobicContact CE2-CG1 3.97Å; Y320-I324 HydrophobicContact CG-CD1 4.25Å; Y320-I324 WeakPolarHBondContact O-CB 3.49Å; Y320-I324 PolarHBondContact O-N 2.83Å; Y320-I324 VanDerWaalsContact OH-CD1 3.25Å; Y320-I324 WeakPolarHBondContact OH-CD1 3.26Å
321	P	88.3	Confident	89.9	Confident	57 Å²	57	46.8 Å²	46.8	37%	0.37	24%	0.242	S	C	.	.	H	α-helix	trans	-63.4	-36.4	177.2	22.8	-32.2	0	0	0	113	P317 I318 G325	P317-P321 WeakPolarHBondContact O-CD 2.63Å; I318-P321 VanDerWaalsContact O-CD 3.26Å; I318-P321 WeakPolarHBondContact O-CD 3.47Å; I318-P321 VanDerWaalsContact O-CG 3.28Å; I318-P321 WeakPolarHBondContact O-CG 3.46Å; P321-G325 PolarHBondContact O-N 3.04Å
322	V	91.9	Very high	90.1	Very high	58 Å²	58	41.6 Å²	41.6	35%	0.352	23%	0.226	S	C	.	.	H	α-helix	trans	-69.4	-43.4	178.1	169.4	0	0	0	0	112	V303 F313 I318 F319 Y320 G325 A326	V303-V322 HydrophobicContact CG2-CG1 3.59Å; F313-V322 HydrophobicContact CZ-CG1 4.19Å; I318-V322 HydrophobicContact CG2-CG2 3.56Å; I318-V322 WeakPolarHBondContact O-CB 3.43Å; I318-V322 VanDerWaalsContact O-CG2 3.29Å; I318-V322 WeakPolarHBondContact O-CG2 3.4Å; I318-V322 PolarHBondContact O-N 2.86Å; I318-V322 VanDerWaalsContact O-N 3.16Å; F319-V322 PolarHBondContact O-N 2.79Å; Y320-V322 VanDerWaalsContact C-N 3.33Å; Y320-V322 PolarHBondContact O-N 2.9Å; V322-G325 PolarHBondContact O-N 3.5Å; V322-A326 WeakPolarHBondContact O-CB 3.38Å; V322-A326 PolarHBondContact O-N 2.99Å
323	S	90.7	Very high	90.1	Very high	11 Å²	11	34.3 Å²	34.3	8%	0.077	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-46.5	178.1	-179.4	0	0	0	0	111.6	Q194 F319 Y320 A326 L327	Q194-S323 VanDerWaalsContact NE2-CB 3.33Å; Q194-S323 PolarHBondContact NE2-OG 2.87Å; Q194-S323 VanDerWaalsContact NE2-OG 3.15Å; Q194-S323 PolarHBondContact OE1-OG 3.36Å; F319-S323 WeakPolarHBondContact O-CB 3.48Å; F319-S323 PolarHBondContact O-N 3.15Å; Y320-S323 PolarHBondContact O-N 3.41Å; S323-A326 PolarHBondContact O-N 3.21Å; S323-L327 WeakPolarHBondContact O-CB 3.36Å; S323-L327 PolarHBondContact O-N 3.29Å
324	I	89.1	Confident	90.2	Very high	14 Å²	14	32.4 Å²	32.4	7%	0.072	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-47.6	174	-75.7	176.4	0	0	0	110.8	V105 Y320 A326 L327 W328	V105-I324 HydrophobicContact CG2-CD1 4.04Å; V105-I324 HydrophobicContact CG2-CG2 4.39Å; Y320-I324 HydrophobicContact CD1-CD1 4.19Å; Y320-I324 HydrophobicContact CD2-CD1 3.76Å; Y320-I324 HydrophobicContact CD2-CG1 4.28Å; Y320-I324 HydrophobicContact CE1-CD1 3.63Å; Y320-I324 HydrophobicContact CE2-CD1 3.13Å; Y320-I324 HydrophobicContact CE2-CG1 3.97Å; Y320-I324 HydrophobicContact CG-CD1 4.25Å; Y320-I324 WeakPolarHBondContact O-CB 3.49Å; Y320-I324 PolarHBondContact O-N 2.83Å; Y320-I324 VanDerWaalsContact OH-CD1 3.25Å; Y320-I324 WeakPolarHBondContact OH-CD1 3.26Å; I324-A326 VanDerWaalsContact C-N 3.29Å; I324-A326 PolarHBondContact O-N 2.97Å; I324-L327 PolarHBondContact O-N 2.95Å; I324-W328 HydrophobicContact CG2-CG 4.44Å; I324-W328 WeakPolarHBondContact O-CB 3.38Å; I324-W328 PolarHBondContact O-N 3.34Å
325	G	91.6	Very high	90.4	Very high	40 Å²	40	33.1 Å²	33.1	41%	0.412	19%	0.188	S	C	.	.	H	α-helix	trans	-58.3	-42.2	178.9	0	0	0	0	0	112.4	P321 V322 W328 L329	P321-G325 PolarHBondContact O-N 3.04Å; V322-G325 PolarHBondContact O-N 3.5Å; G325-W328 WeakPolarHBondContact O-CB 3.37Å; G325-W328 PolarHBondContact O-N 3.28Å; G325-L329 WeakPolarHBondContact O-CB 3.25Å; G325-L329 PolarHBondContact O-N 2.9Å
326	A	94.1	Very high	90.5	Very high	6 Å²	6	33.2 Å²	33.2	5%	0.05	19%	0.19	C	C	.	.	H	α-helix	trans	-67.7	-40.7	176.6	0	0	0	0	0	112.7	P299 V303 V322 S323 I324 L329 S330	P299-A326 HydrophobicContact CB-CB 4.24Å; V303-A326 HydrophobicContact CB-CB 4.3Å; V303-A326 HydrophobicContact CG2-CB 3.97Å; V322-A326 WeakPolarHBondContact O-CB 3.38Å; V322-A326 PolarHBondContact O-N 2.99Å; S323-A326 PolarHBondContact O-N 3.21Å; I324-A326 VanDerWaalsContact C-N 3.29Å; I324-A326 PolarHBondContact O-N 2.97Å; A326-L329 PolarHBondContact O-N 3.3Å; A326-S330 PolarHBondContact O-N 3.43Å; A326-S330 VanDerWaalsContact O-N 3.1Å
327	L	91.9	Very high	90.5	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-42.8	175.2	-176.1	62	0	0	0	111.6	T101 Y124 S323 I324 L329 S330 Y331	T101-L327 HydrophobicContact CG2-CD2 3.66Å; Y124-L327 HydrophobicContact CE2-CD1 3.94Å; S323-L327 WeakPolarHBondContact O-CB 3.36Å; S323-L327 PolarHBondContact O-N 3.29Å; I324-L327 PolarHBondContact O-N 2.95Å; L327-L329 PolarHBondContact O-N 2.74Å; L327-S330 WeakPolarHBondContact O-CB 3.46Å; L327-S330 PolarHBondContact O-N 3.25Å; L327-S330 VanDerWaalsContact O-N 3.14Å; L327-S330 PolarHBondContact O-OG 2.98Å; L327-Y331 HydrophobicContact CD1-CE1 4.17Å; L327-Y331 HydrophobicContact CD1-CE2 4.16Å; L327-Y331 HydrophobicContact CD2-CE2 4.11Å; L327-Y331 HydrophobicContact CG-CD2 4.27Å; L327-Y331 HydrophobicContact CG-CE2 3.75Å; L327-Y331 PolarHBondContact O-N 2.97Å
328	W	92	Very high	90.5	Very high	36 Å²	36	29 Å²	29	14%	0.136	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-46.2	174.1	-90.8	55.2	0	0	0	112.9	L47 I50 M51 M54 I324 G325 S330 Y331 L332	L47-W328 HydrophobicContact CB-CH2 3.86Å; L47-W328 HydrophobicContact CB-CZ2 3.64Å; L47-W328 HydrophobicContact CD2-CH2 3.47Å; L47-W328 VanDerWaalsContact CD2-CH2 3.47Å; L47-W328 HydrophobicContact CD2-CZ2 3.77Å; L47-W328 HydrophobicContact CD2-CZ3 4.01Å; L47-W328 HydrophobicContact CG-CH2 4.27Å; L47-W328 HydrophobicContact CG-CZ2 4.26Å; L47-W328 WeakPolarHBondContact O-CH2 3.36Å; L47-W328 WeakPolarHBondContact O-CZ2 2.99Å; I50-W328 HydrophobicContact CB-CH2 3.78Å; I50-W328 HydrophobicContact CB-CZ3 4.02Å; I50-W328 HydrophobicContact CG2-CH2 3.81Å; I50-W328 HydrophobicContact CG2-CZ3 3.51Å; M51-W328 HydrophobicContact CB-CZ2 4.38Å; M51-W328 HydrophobicContact CG-CD2 4.23Å; M51-W328 HydrophobicContact CG-CH2 3.7Å; M51-W328 HydrophobicContact CG-CZ2 3.08Å; M51-W328 HydrophobicContact CG-CZ3 4.46Å; M51-W328 HydrophobicContact SD-CD2 4.18Å; M51-W328 VanDerWaalsContact SD-CE2 3.54Å; M51-W328 HydrophobicContact SD-CG 4.42Å; M51-W328 HydrophobicContact SD-CZ2 3.91Å; M51-W328 PolarHBondContact SD-NE1 3.19Å; M54-W328 HydrophobicContact CE-CD2 3.98Å; M54-W328 HydrophobicContact CE-CE3 3.62Å; M54-W328 HydrophobicContact CE-CH2 4.28Å; M54-W328 HydrophobicContact CE-CZ3 3.79Å; I324-W328 HydrophobicContact CG2-CG 4.44Å; I324-W328 WeakPolarHBondContact O-CB 3.38Å; I324-W328 PolarHBondContact O-N 3.34Å; G325-W328 WeakPolarHBondContact O-CB 3.37Å; G325-W328 PolarHBondContact O-N 3.28Å; W328-S330 PolarHBondContact O-N 3.17Å; W328-Y331 CarbonylContact O-C 3.6Å; W328-Y331 WeakPolarHBondContact O-CB 3.38Å; W328-Y331 PolarHBondContact O-N 2.71Å; W328-L332 PolarHBondContact O-N 3.35Å
329	L	93.2	Very high	90.4	Very high	51 Å²	51	28.3 Å²	28.3	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-62.5	-34.2	178	-168.1	64.2	0	0	0	111.2	V295 C296 P299 G325 A326 L327 L332	V295-L329 HydrophobicContact CG1-CD1 4.46Å; V295-L329 HydrophobicContact CG1-CD2 4.43Å; V295-L329 WeakPolarHBondContact O-CD2 3.29Å; C296-L329 WeakPolarHBondContact CB-O 2.84Å; C296-L329 PolarHBondContact SG-O 3.36Å; P299-L329 HydrophobicContact CB-CD2 4.26Å; P299-L329 HydrophobicContact CG-CD2 3.66Å; G325-L329 WeakPolarHBondContact O-CB 3.25Å; G325-L329 PolarHBondContact O-N 2.9Å; A326-L329 PolarHBondContact O-N 3.3Å; L327-L329 PolarHBondContact O-N 2.74Å; L329-L332 HydrophobicContact CD1-CD2 4.2Å; L329-L332 WeakPolarHBondContact O-CB 3.14Å; L329-L332 PolarHBondContact O-N 3.5Å
330	S	93.3	Very high	90.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-65.6	-39.8	172.4	90.2	0	0	0	0	112	Y124 C296 A326 L327 W328 K333	Y124-S330 PolarHBondContact OH-OG 3.21Å; C296-S330 WeakPolarHBondContact O-CA 3.11Å; C296-S330 PolarHBondContact O-N 2.99Å; A326-S330 PolarHBondContact O-N 3.43Å; A326-S330 VanDerWaalsContact O-N 3.1Å; L327-S330 WeakPolarHBondContact O-CB 3.46Å; L327-S330 PolarHBondContact O-N 3.25Å; L327-S330 VanDerWaalsContact O-N 3.14Å; L327-S330 PolarHBondContact O-OG 2.98Å; W328-S330 PolarHBondContact O-N 3.17Å; S330-K333 PolarHBondContact O-NZ 2.99Å
331	Y	93.8	Very high	89.8	Confident	7 Å²	7	29 Å²	29	3%	0.027	17%	0.166	C	C	.	.	H	α-helix	trans	-70.1	-30.8	178	-72.2	-24.7	0	0	0	113.1	M51 M98 T101 Y124 L327 W328 K333 T334	M51-Y331 HydrophobicContact SD-CD2 4.25Å; M98-Y331 VanDerWaalsContact CE-CB 3.42Å; M98-Y331 HydrophobicContact CE-CD1 3.59Å; M98-Y331 HydrophobicContact CE-CD2 4.45Å; M98-Y331 HydrophobicContact CE-CE1 4.42Å; M98-Y331 HydrophobicContact CE-CG 3.59Å; M98-Y331 HydrophobicContact CG-CD1 3.94Å; M98-Y331 HydrophobicContact CG-CD2 3.89Å; M98-Y331 HydrophobicContact CG-CE1 3.99Å; M98-Y331 HydrophobicContact CG-CE2 3.95Å; M98-Y331 HydrophobicContact CG-CG 3.88Å; M98-Y331 HydrophobicContact SD-CD1 4.5Å; M98-Y331 HydrophobicContact SD-CD2 4.49Å; M98-Y331 HydrophobicContact SD-CG 4.17Å; T101-Y331 HydrophobicContact CG2-CE2 4.09Å; T101-Y331 PolarHBondContact OG1-OH 2.68Å; Y124-Y331 HydrophobicContact CD2-CE1 4.04Å; Y124-Y331 HydrophobicContact CE2-CD1 4.48Å; Y124-Y331 AromaticContact CE2-CE1 3.72Å; Y124-Y331 HydrophobicContact CE2-CE1 3.72Å; L327-Y331 HydrophobicContact CD1-CE1 4.17Å; L327-Y331 HydrophobicContact CD1-CE2 4.16Å; L327-Y331 HydrophobicContact CD2-CE2 4.11Å; L327-Y331 HydrophobicContact CG-CD2 4.27Å; L327-Y331 HydrophobicContact CG-CE2 3.75Å; L327-Y331 PolarHBondContact O-N 2.97Å; W328-Y331 CarbonylContact O-C 3.6Å; W328-Y331 WeakPolarHBondContact O-CB 3.38Å; W328-Y331 PolarHBondContact O-N 2.71Å; Y331-K333 PolarHBondContact O-N 2.87Å; Y331-T334 PolarHBondContact O-N 3.47Å; Y331-T334 PolarHBondContact O-OG1 3.02Å
332	L	92.3	Very high	89.4	Confident	48 Å²	48	28.2 Å²	28.2	25%	0.251	16%	0.161	S	C	.	.	H	α-helix	trans	-56.8	-23.5	179	-166.3	62.9	0	0	0	113	M54 W328 L329 T334 V335 F336	M54-L332 HydrophobicContact SD-CD1 4.04Å; W328-L332 PolarHBondContact O-N 3.35Å; L329-L332 HydrophobicContact CD1-CD2 4.2Å; L329-L332 WeakPolarHBondContact O-CB 3.14Å; L329-L332 PolarHBondContact O-N 3.5Å; L332-T334 PolarHBondContact O-N 2.97Å; L332-V335 PolarHBondContact O-N 3.32Å; L332-F336 HydrophobicContact CB-CE2 4.37Å; L332-F336 HydrophobicContact CD1-CE1 4.49Å; L332-F336 HydrophobicContact CD1-CE2 4.26Å; L332-F336 HydrophobicContact CD1-CZ 4.06Å; L332-F336 HydrophobicContact CD2-CD2 4.32Å; L332-F336 HydrophobicContact CD2-CE2 3.33Å; L332-F336 HydrophobicContact CD2-CZ 3.51Å; L332-F336 HydrophobicContact CG-CD2 3.89Å; L332-F336 HydrophobicContact CG-CE1 4.37Å; L332-F336 HydrophobicContact CG-CE2 3.33Å; L332-F336 HydrophobicContact CG-CZ 3.6Å; L332-F336 WeakPolarHBondContact O-CD2 3.41Å; L332-F336 PolarHBondContact O-N 3.11Å
333	K	90	Very high	88.8	Confident	20 Å²	20	33.7 Å²	33.7	9%	0.087	18%	0.175	C	C	.	.	H	α-helix	trans	-54.9	-39.2	173	96	170.1	113.7	-73.3	0	112.5	C296 W297 S330 Y331 V335 F336 N337	C296-K333 HydrophobicContact CB-CB 4.36Å; W297-K333 VanDerWaalsContact NE1-NZ 3.13Å; S330-K333 PolarHBondContact O-NZ 2.99Å; Y331-K333 PolarHBondContact O-N 2.87Å; K333-V335 PolarHBondContact O-N 3.44Å; K333-F336 PolarHBondContact O-N 3.38Å; K333-N337 VanDerWaalsContact O-CG 3.24Å; K333-N337 PolarHBondContact O-N 2.98Å
334	T	92.3	Very high	88.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-29.2	-173.4	69.8	0	0	0	0	111.1	N62 D90 L93 M98 Y331 L332 P338	N62-T334 PolarHBondContact ND2-O 2.9Å; D90-T334 HydrophobicContact CB-CG2 3.92Å; L93-T334 HydrophobicContact CB-CG2 4.38Å; L93-T334 HydrophobicContact CD1-CG2 4.32Å; M98-T334 HydrophobicContact CE-CG2 3.43Å; M98-T334 VanDerWaalsContact CE-CG2 3.43Å; M98-T334 WeakPolarHBondContact CE-OG1 3.42Å; Y331-T334 PolarHBondContact O-N 3.47Å; Y331-T334 PolarHBondContact O-OG1 3.02Å; L332-T334 PolarHBondContact O-N 2.97Å; T334-P338 WeakPolarHBondContact O-CD 3.07Å
335	V	91.5	Very high	87.4	Confident	17 Å²	17	36.9 Å²	36.9	10%	0.103	19%	0.188	C	C	.	.	H	α-helix	trans	-77.2	-42.4	175.5	179.7	0	0	0	0	110.7	M54 I57 L332 K333	M54-V335 HydrophobicContact CB-CG2 3.87Å; M54-V335 HydrophobicContact CG-CG2 4.1Å; I57-V335 HydrophobicContact CB-CG1 4.35Å; I57-V335 HydrophobicContact CG2-CG1 3.81Å; L332-V335 PolarHBondContact O-N 3.32Å; K333-V335 PolarHBondContact O-N 3.44Å
336	F	88.5	Confident	86.6	Confident	96 Å²	96	42.1 Å²	42.1	42%	0.421	20%	0.195	S	C	.	.	H	α-helix	trans	-72.6	-32.5	-176.8	-68.8	-34.9	0	0	0	114	L332 K333 V339 I340	L332-F336 HydrophobicContact CB-CE2 4.37Å; L332-F336 HydrophobicContact CD1-CE1 4.49Å; L332-F336 HydrophobicContact CD1-CE2 4.26Å; L332-F336 HydrophobicContact CD1-CZ 4.06Å; L332-F336 HydrophobicContact CD2-CD2 4.32Å; L332-F336 HydrophobicContact CD2-CE2 3.33Å; L332-F336 HydrophobicContact CD2-CZ 3.51Å; L332-F336 HydrophobicContact CG-CD2 3.89Å; L332-F336 HydrophobicContact CG-CE1 4.37Å; L332-F336 HydrophobicContact CG-CE2 3.33Å; L332-F336 HydrophobicContact CG-CZ 3.6Å; L332-F336 WeakPolarHBondContact O-CD2 3.41Å; L332-F336 PolarHBondContact O-N 3.11Å; K333-F336 PolarHBondContact O-N 3.38Å; F336-V339 WeakPolarHBondContact O-CB 3.4Å; F336-V339 PolarHBondContact O-N 3.32Å; F336-V339 VanDerWaalsContact O-N 3.16Å; F336-I340 HydrophobicContact CB-CD1 4.2Å; F336-I340 VanDerWaalsContact O-CG1 3.25Å; F336-I340 WeakPolarHBondContact O-CG1 3.49Å; F336-I340 PolarHBondContact O-N 2.95Å
337	N	86.6	Confident	85.6	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.059	22%	0.221	C	C	.	.	H	α-helix	trans	-55.2	-54.8	-176	-79	-13.1	0	0	0	113.1	D90 K333 V339 I340 Y341	D90-N337 PolarHBondContact OD2-ND2 3.05Å; K333-N337 VanDerWaalsContact O-CG 3.24Å; K333-N337 PolarHBondContact O-N 2.98Å; N337-V339 VanDerWaalsContact C-N 3.32Å; N337-V339 PolarHBondContact O-N 3.22Å; N337-I340 PolarHBondContact O-N 3.46Å; N337-Y341 HydrophobicContact CB-CE2 4.01Å; N337-Y341 WeakPolarHBondContact O-CD1 2.96Å; N337-Y341 WeakPolarHBondContact O-CD2 3.26Å; N337-Y341 WeakPolarHBondContact O-CE2 3.28Å; N337-Y341 PolarHBondContact O-N 3.16Å
338	P	85.3	Confident	84.8	Confident	8 Å²	8	47.6 Å²	47.6	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-39	174.8	-26.3	34.3	0	0	0	114.2	G61 N62 V65 T334 Y341 C342	G61-P338 VanDerWaalsContact C-CG 3.44Å; N62-P338 HydrophobicContact CB-CG 4.34Å; N62-P338 VanDerWaalsContact CG-CG 3.47Å; N62-P338 WeakPolarHBondContact OD1-CD 3.41Å; N62-P338 VanDerWaalsContact OD1-CG 3.29Å; N62-P338 WeakPolarHBondContact OD1-CG 3.48Å; V65-P338 HydrophobicContact CG2-CB 4.42Å; T334-P338 WeakPolarHBondContact O-CD 3.07Å; P338-Y341 PolarHBondContact O-N 2.84Å; P338-C342 WeakPolarHBondContact O-CB 3.16Å; P338-C342 PolarHBondContact O-N 3.33Å; P338-C342 PolarHBondContact O-SG 2.83Å; P338-C342 VanDerWaalsContact O-SG 3.33Å
339	V	85	Confident	84.3	Confident	86 Å²	86	51 Å²	51	52%	0.521	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-44.4	179.2	177	0	0	0	0	110.1	F336 N337 Y341 C342 W343	F336-V339 WeakPolarHBondContact O-CB 3.4Å; F336-V339 PolarHBondContact O-N 3.32Å; F336-V339 VanDerWaalsContact O-N 3.16Å; N337-V339 VanDerWaalsContact C-N 3.32Å; N337-V339 PolarHBondContact O-N 3.22Å; V339-Y341 VanDerWaalsContact C-N 3.35Å; V339-Y341 PolarHBondContact O-N 2.86Å; V339-C342 PolarHBondContact O-N 2.95Å; V339-W343 VanDerWaalsContact O-CB 3.3Å; V339-W343 WeakPolarHBondContact O-CB 3.46Å; V339-W343 PolarHBondContact O-N 3.39Å
340	I	83.8	Confident	83.6	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.108	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-45.3	175.4	-66.5	163.4	0	0	0	109.8	I288 L289 F336 N337 W343 R344	I288-I340 HydrophobicContact CG2-CD1 3.85Å; I288-I340 HydrophobicContact CG2-CG1 4.05Å; I288-I340 HydrophobicContact CG2-CG2 4.43Å; L289-I340 HydrophobicContact CD2-CD1 4.41Å; L289-I340 HydrophobicContact CD2-CG2 4.21Å; F336-I340 HydrophobicContact CB-CD1 4.2Å; F336-I340 VanDerWaalsContact O-CG1 3.25Å; F336-I340 WeakPolarHBondContact O-CG1 3.49Å; F336-I340 PolarHBondContact O-N 2.95Å; N337-I340 PolarHBondContact O-N 3.46Å; I340-W343 PolarHBondContact O-N 3.4Å; I340-R344 HydrophobicContact CG2-CG 4.03Å; I340-R344 WeakPolarHBondContact O-CB 3.29Å; I340-R344 WeakPolarHBondContact O-CG 3.47Å; I340-R344 PolarHBondContact O-N 2.83Å
341	Y	81.3	Confident	82.8	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.02	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-46.8	-179.7	-52.1	-28.6	0	0	0	112.2	V65 L83 L86 N337 P338 V339 W343 R344 I345	V65-Y341 HydrophobicContact CG1-CD2 4.15Å; V65-Y341 HydrophobicContact CG1-CE2 4.39Å; V65-Y341 HydrophobicContact CG2-CD2 3.83Å; V65-Y341 HydrophobicContact CG2-CE2 4.5Å; L83-Y341 HydrophobicContact CD2-CD1 4.1Å; L83-Y341 HydrophobicContact CD2-CE1 3.57Å; L83-Y341 HydrophobicContact CD2-CE2 4.47Å; L86-Y341 WeakPolarHBondContact CD2-OH 3.02Å; N337-Y341 HydrophobicContact CB-CE2 4.01Å; N337-Y341 WeakPolarHBondContact O-CD1 2.96Å; N337-Y341 WeakPolarHBondContact O-CD2 3.26Å; N337-Y341 WeakPolarHBondContact O-CE2 3.28Å; N337-Y341 PolarHBondContact O-N 3.16Å; P338-Y341 PolarHBondContact O-N 2.84Å; V339-Y341 VanDerWaalsContact C-N 3.35Å; V339-Y341 PolarHBondContact O-N 2.86Å; Y341-W343 VanDerWaalsContact C-N 3.3Å; Y341-W343 PolarHBondContact O-N 2.84Å; Y341-R344 PolarHBondContact O-N 2.94Å; Y341-I345 HydrophobicContact CD1-CD1 4.49Å; Y341-I345 WeakPolarHBondContact O-CA 3.46Å; Y341-I345 WeakPolarHBondContact O-CB 3.5Å; Y341-I345 PolarHBondContact O-N 2.91Å
342	C	79	Confident	81.9	Confident	39 Å²	39	53.4 Å²	53.4	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-61.3	-37	177.1	-73.8	0	0	0	0	112.5	P338 V339 R349 C352	P338-C342 WeakPolarHBondContact O-CB 3.16Å; P338-C342 PolarHBondContact O-N 3.33Å; P338-C342 PolarHBondContact O-SG 2.83Å; P338-C342 VanDerWaalsContact O-SG 3.33Å; V339-C342 PolarHBondContact O-N 2.95Å; C342-R349 VanDerWaalsContact O-CB 3.3Å; C342-R349 WeakPolarHBondContact O-CB 3.13Å; C342-C352 PolarHBondContact SG-SG 2.9Å
343	W	79.8	Confident	81.1	Confident	173 Å²	173	55.3 Å²	55.3	66%	0.655	25%	0.251	S	S	*	.	H	α-helix	trans	-76.4	-39	179.1	-176.9	44.4	0	0	0	112.4	I288 V339 I340 Y341	I288-W343 HydrophobicContact CD1-CE3 4.44Å; I288-W343 HydrophobicContact CD1-CH2 4.32Å; I288-W343 HydrophobicContact CD1-CZ3 3.57Å; V339-W343 VanDerWaalsContact O-CB 3.3Å; V339-W343 WeakPolarHBondContact O-CB 3.46Å; V339-W343 PolarHBondContact O-N 3.39Å; I340-W343 PolarHBondContact O-N 3.4Å; Y341-W343 VanDerWaalsContact C-N 3.3Å; Y341-W343 PolarHBondContact O-N 2.84Å
344	R	75.2	Confident	80.4	Confident	46 Å²	46	60.4 Å²	60.4	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-95.9	-30.6	-168.2	-58.5	-54.6	-62.5	-89.5	-2.7	114.2	R281 T284 T285 I340 Y341	R281-R344 PolarHBondContact O-NH2 3.12Å; T284-R344 PolarHBondContact O-NH1 2.86Å; T285-R344 HydrophobicContact CG2-CB 4.31Å; T285-R344 HydrophobicContact CG2-CG 4.45Å; T285-R344 PolarHBondContact OG1-NE 3.1Å; T285-R344 PolarHBondContact OG1-NH2 3.03Å; I340-R344 HydrophobicContact CG2-CG 4.03Å; I340-R344 WeakPolarHBondContact O-CB 3.29Å; I340-R344 WeakPolarHBondContact O-CG 3.47Å; I340-R344 PolarHBondContact O-N 2.83Å; Y341-R344 PolarHBondContact O-N 2.94Å
345	I	75.6	Confident	79.3	Confident	47 Å²	47	64.1 Å²	64.1	24%	0.241	29%	0.291	C	S	.	.			trans	-104.8	101.6	-175.5	-52.6	174.8	0	0	0	108.8	L83 Y341 K347 F348 R349	L83-I345 HydrophobicContact CD1-CD1 3.48Å; L83-I345 VanDerWaalsContact CD1-CD1 3.48Å; Y341-I345 HydrophobicContact CD1-CD1 4.49Å; Y341-I345 WeakPolarHBondContact O-CA 3.46Å; Y341-I345 WeakPolarHBondContact O-CB 3.5Å; Y341-I345 PolarHBondContact O-N 2.91Å; I345-K347 VanDerWaalsContact C-N 3.34Å; I345-K347 PolarHBondContact O-N 3.31Å; I345-F348 HydrophobicContact CB-CB 3.72Å; I345-F348 HydrophobicContact CD1-CD2 4.48Å; I345-F348 HydrophobicContact CG2-CB 3.75Å; I345-F348 HydrophobicContact CG2-CD2 4.24Å; I345-F348 HydrophobicContact CG2-CG 4.46Å; I345-F348 WeakPolarHBondContact O-CA 3.28Å; I345-F348 VanDerWaalsContact O-CB 3.25Å; I345-F348 WeakPolarHBondContact O-CB 3.38Å; I345-F348 PolarHBondContact O-N 2.89Å; I345-R349 PolarHBondContact O-N 3.42Å
346	R	74.3	Confident	78.2	Confident	149 Å²	149	66.9 Å²	66.9	56%	0.562	31%	0.305	S	S	*	.	H	α-helix	trans	-54.6	-45	-176.6	-177.4	178	171.3	-177.6	-0.8	113.3	F348 R349 E350	R346-F348 PolarHBondContact O-N 2.82Å; R346-R349 WeakPolarHBondContact O-CB 3.43Å; R346-R349 PolarHBondContact O-N 3.22Å; R346-E350 WeakPolarHBondContact CG-OE1 3.29Å; R346-E350 IonicContact CZ-OE1 2.79Å; R346-E350 IonicContact NE-OE1 3.41Å; R346-E350 PolarHBondContact NE-OE1 3.2Å; R346-E350 IonicContact NH2-OE1 3.46Å; R346-E350 PolarHBondContact NH2-OE1 2.85Å; R346-E350 WeakPolarHBondContact O-CG 3.02Å; R346-E350 PolarHBondContact O-N 3.28Å
347	K	73	Confident	77.1	Confident	139 Å²	139	66 Å²	66	60%	0.604	31%	0.308	S	S	*	.	H	α-helix	trans	-60.4	-35.3	177.4	-68.4	-172.4	176.2	-176.2	0	112.2	M75 I345 A351	M75-K347 HydrophobicContact CE-CB 3.98Å; M75-K347 HydrophobicContact SD-CB 4.06Å; M75-K347 HydrophobicContact SD-CD 4.13Å; I345-K347 VanDerWaalsContact C-N 3.34Å; I345-K347 PolarHBondContact O-N 3.31Å; K347-A351 WeakPolarHBondContact O-CB 3.35Å; K347-A351 PolarHBondContact O-N 3.03Å
348	F	75.6	Confident	75.6	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-71.7	-44.2	178.8	-127.4	-79.6	0	0	0	110.9	V65 I68 V69 M75 I345 R346 E350 A351 C352	V65-F348 HydrophobicContact CB-CE1 3.98Å; V65-F348 HydrophobicContact CB-CZ 4.05Å; V65-F348 HydrophobicContact CG1-CE1 4.01Å; V65-F348 HydrophobicContact CG1-CZ 3.62Å; V65-F348 HydrophobicContact CG2-CE1 3.74Å; V65-F348 HydrophobicContact CG2-CZ 4.24Å; I68-F348 HydrophobicContact CB-CE1 4.06Å; I68-F348 HydrophobicContact CB-CZ 4Å; I68-F348 HydrophobicContact CD1-CD1 3.81Å; I68-F348 HydrophobicContact CD1-CE1 3.59Å; I68-F348 HydrophobicContact CD1-CZ 4.39Å; I68-F348 HydrophobicContact CG1-CE1 4.41Å; I68-F348 HydrophobicContact CG2-CE1 4.1Å; I68-F348 HydrophobicContact CG2-CE2 4.15Å; I68-F348 HydrophobicContact CG2-CZ 3.89Å; V69-F348 HydrophobicContact CG2-CE2 3.94Å; V69-F348 HydrophobicContact CG2-CZ 3.96Å; M75-F348 HydrophobicContact CE-CD2 3.85Å; M75-F348 HydrophobicContact CE-CE2 4.2Å; I345-F348 HydrophobicContact CB-CB 3.72Å; I345-F348 HydrophobicContact CD1-CD2 4.48Å; I345-F348 HydrophobicContact CG2-CB 3.75Å; I345-F348 HydrophobicContact CG2-CD2 4.24Å; I345-F348 HydrophobicContact CG2-CG 4.46Å; I345-F348 WeakPolarHBondContact O-CA 3.28Å; I345-F348 VanDerWaalsContact O-CB 3.25Å; I345-F348 WeakPolarHBondContact O-CB 3.38Å; I345-F348 PolarHBondContact O-N 2.89Å; R346-F348 PolarHBondContact O-N 2.82Å; F348-E350 VanDerWaalsContact C-N 3.33Å; F348-E350 PolarHBondContact O-N 2.87Å; F348-A351 PolarHBondContact O-N 3.32Å; F348-C352 PolarHBondContact O-N 3.48Å; F348-C352 PolarHBondContact O-SG 3.16Å
349	R	80.9	Confident	74.3	Confident	107 Å²	107	79 Å²	79	40%	0.404	38%	0.377	S	S	.	.	H	α-helix	trans	-57.5	-45	172.7	-166.2	175.1	63	-166.7	1.5	112.7	C342 I345 R346 C352 Q353	C342-R349 VanDerWaalsContact O-CB 3.3Å; C342-R349 WeakPolarHBondContact O-CB 3.13Å; I345-R349 PolarHBondContact O-N 3.42Å; R346-R349 WeakPolarHBondContact O-CB 3.43Å; R346-R349 PolarHBondContact O-N 3.22Å; R349-C352 PolarHBondContact O-N 3.49Å; R349-Q353 VanDerWaalsContact O-CG 3.32Å; R349-Q353 WeakPolarHBondContact O-CG 3.48Å; R349-Q353 PolarHBondContact O-N 3.39Å; R349-Q353 VanDerWaalsContact O-N 3.1Å
350	E	79.5	Confident	72.9	Confident	86 Å²	86	78.6 Å²	78.6	40%	0.402	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-42	178.2	-73.1	167.6	-177.8	0	0	110.9	R346 F348 Q353 E354	R346-E350 WeakPolarHBondContact CG-OE1 3.29Å; R346-E350 IonicContact CZ-OE1 2.79Å; R346-E350 IonicContact NE-OE1 3.41Å; R346-E350 PolarHBondContact NE-OE1 3.2Å; R346-E350 IonicContact NH2-OE1 3.46Å; R346-E350 PolarHBondContact NH2-OE1 2.85Å; R346-E350 WeakPolarHBondContact O-CG 3.02Å; R346-E350 PolarHBondContact O-N 3.28Å; F348-E350 VanDerWaalsContact C-N 3.33Å; F348-E350 PolarHBondContact O-N 2.87Å; E350-Q353 PolarHBondContact O-N 3.45Å; E350-E354 PolarHBondContact O-N 2.95Å
351	A	75	Confident	71.5	Confident	12 Å²	12	83.4 Å²	83.4	10%	0.099	39%	0.394	C	S	.	.	H	α-helix	trans	-65.8	-43.5	174.3	0	0	0	0	0	112.5	I68 K347 F348 Q353 E354 F355	I68-A351 HydrophobicContact CD1-CB 3.79Å; I68-A351 HydrophobicContact CG1-CB 3.94Å; I68-A351 HydrophobicContact CG2-CB 3.78Å; K347-A351 WeakPolarHBondContact O-CB 3.35Å; K347-A351 PolarHBondContact O-N 3.03Å; F348-A351 PolarHBondContact O-N 3.32Å; A351-Q353 PolarHBondContact O-N 3.19Å; A351-E354 WeakPolarHBondContact O-CB 3.37Å; A351-E354 PolarHBondContact O-N 3.41Å; A351-F355 VanDerWaalsContact O-CD2 3.23Å; A351-F355 WeakPolarHBondContact O-CD2 3.22Å; A351-F355 PolarHBondContact O-N 3.26Å
352	C	75.3	Confident	70	Confident	12 Å²	12	91 Å²	91	8%	0.081	43%	0.434	C	S	.	.	H	α-helix	trans	-58.6	-36	175.4	-69.1	0	0	0	0	112.3	I68 C342 F348 R349 E354 F355 I356	I68-C352 WeakPolarHBondContact CD1-SG 3.18Å; C342-C352 PolarHBondContact SG-SG 2.9Å; F348-C352 PolarHBondContact O-N 3.48Å; F348-C352 PolarHBondContact O-SG 3.16Å; R349-C352 PolarHBondContact O-N 3.49Å; C352-E354 PolarHBondContact O-N 3.32Å; C352-F355 PolarHBondContact O-N 2.95Å; C352-F355 VanDerWaalsContact O-N 3.14Å; C352-I356 WeakPolarHBondContact O-CG1 3.25Å; C352-I356 PolarHBondContact O-N 3.34Å
353	Q	75.1	Confident	68.4	Low	88 Å²	88	94.1 Å²	94.1	41%	0.411	46%	0.455	S	S	.	.	H	α-helix	trans	-68.7	-15.7	176.5	-72.9	176.3	-5.1	0	0	114.2	R349 E350 A351	R349-Q353 VanDerWaalsContact O-CG 3.32Å; R349-Q353 WeakPolarHBondContact O-CG 3.48Å; R349-Q353 PolarHBondContact O-N 3.39Å; R349-Q353 VanDerWaalsContact O-N 3.1Å; E350-Q353 PolarHBondContact O-N 3.45Å; A351-Q353 PolarHBondContact O-N 3.19Å
354	E	75.3	Confident	66.6	Low	126 Å²	126	91.5 Å²	91.5	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-78.2	-34.3	171.7	-161.2	-178.9	159.9	0	0	110.8	K72 E350 A351 C352	K72-E354 IonicContact NZ-OE1 3.53Å; K72-E354 PolarHBondContact NZ-OE1 2.91Å; K72-E354 IonicContact NZ-OE2 2.87Å; K72-E354 PolarHBondContact NZ-OE2 3.4Å; E350-E354 PolarHBondContact O-N 2.95Å; A351-E354 WeakPolarHBondContact O-CB 3.37Å; A351-E354 PolarHBondContact O-N 3.41Å; C352-E354 PolarHBondContact O-N 3.32Å
355	F	70.3	Confident	64.9	Low	78 Å²	78	100 Å²	100	34%	0.342	49%	0.493	S	S	.	.	H	α-helix	trans	-88.4	-20.6	-179.5	-68.4	-78.7	0	0	0	114.3	I68 Q71 A351 C352	I68-F355 HydrophobicContact CG1-CD2 4.15Å; I68-F355 HydrophobicContact CG1-CE2 3.82Å; Q71-F355 VanDerWaalsContact OE1-CZ 3.29Å; A351-F355 VanDerWaalsContact O-CD2 3.23Å; A351-F355 WeakPolarHBondContact O-CD2 3.22Å; A351-F355 PolarHBondContact O-N 3.26Å; C352-F355 PolarHBondContact O-N 2.95Å; C352-F355 VanDerWaalsContact O-N 3.14Å
356	I	68.6	Low	63.6	Low	76 Å²	76	106 Å²	106	39%	0.39	52%	0.522	S	S	.	.	S	Bend	trans	-73.5	124.8	175.2	-67.5	166.8	0	0	0	109.5	C352 C360	C352-I356 WeakPolarHBondContact O-CG1 3.25Å; C352-I356 PolarHBondContact O-N 3.34Å; I356-C360 HydrophobicContact CG2-CB 3.96Å
357	P	63.7	Low	61.8	Low	77 Å²	77	104.7 Å²	104.7	50%	0.5	53%	0.532	S	S	.	.			trans	-53	143.4	176.4	-23.7	32.1	0	0	0	111.5	S359 C360	P357-S359 PolarHBondContact O-N 2.95Å; P357-C360 PolarHBondContact O-N 2.94Å
358	K	56.6	Low	60.2	Low	185 Å²	185	101.3 Å²	101.3	80%	0.804	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-55.4	-23.8	-179.6	-69.7	178.9	-178.6	173.7	0	112.9
359	S	58.2	Low	58.7	Low	108 Å²	108	112.6 Å²	112.6	76%	0.755	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-76.2	-17.8	177.8	32	0	0	0	0	115.6	P357	P357-S359 PolarHBondContact O-N 2.95Å
360	C	54.4	Low	56.7	Low	77 Å²	77	112.8 Å²	112.8	52%	0.52	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-107.5	19.9	-177.8	-69.2	0	0	0	0	114.1	I356 P357 L362	I356-C360 HydrophobicContact CG2-CB 3.96Å; P357-C360 PolarHBondContact O-N 2.94Å; C360-L362 VanDerWaalsContact C-N 3.28Å; C360-L362 PolarHBondContact O-N 2.76Å
361	R	55	Low	54.8	Low	121 Å²	121	117.2 Å²	117.2	46%	0.457	62%	0.618	S	S	.	*			trans	-75.1	73.5	179.8	-65.5	-175	-168.9	-98.4	-10.3	111.8	C363	R361-C363 VanDerWaalsContact C-N 3.31Å
362	L	50	Low	53	Low	165 Å²	165	127.6 Å²	127.6	86%	0.864	66%	0.655	S	S	*	*			trans	-78.7	-7.5	172.2	-95.9	94.3	0	0	0	114.2	C360	C360-L362 VanDerWaalsContact C-N 3.28Å; C360-L362 PolarHBondContact O-N 2.76Å
363	C	44.3	Very low	51	Low	104 Å²	104	137.8 Å²	137.8	70%	0.703	69%	0.692	S	S	*	*	S	Bend	trans	-90.6	125	175.1	-71.3	0	0	0	0	111.2	R361 R365	R361-C363 VanDerWaalsContact C-N 3.31Å; C363-R365 PolarHBondContact O-N 2.95Å
364	P	41.7	Very low	49.4	Very low	119 Å²	119	139.8 Å²	139.8	77%	0.773	71%	0.71	S	S	*	*			trans	-57.9	135.3	174.4	-17.9	28.4	0	0	0	110.6	M366	P364-M366 PolarHBondContact O-N 3.28Å
365	R	39.9	Very low	47.3	Very low	223 Å²	223	144.7 Å²	144.7	84%	0.842	72%	0.722	S	S	*	*			trans	-61.2	98.3	165.6	-83	178.4	168.1	154.2	-4.6	108.1	C363 P367	C363-R365 PolarHBondContact O-N 2.95Å; R365-P367 WeakPolarHBondContact O-CD 3.49Å
366	M	49.3	Very low	45.8	Very low	174 Å²	174	146.2 Å²	146.2	86%	0.857	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-57.6	122.7	158.3	-83.6	-95.2	-151.7	0	0	107.3	P364 G368	P364-M366 PolarHBondContact O-N 3.28Å; M366-G368 PolarHBondContact O-N 3.31Å
367	P	37	Very low	44.1	Very low	121 Å²	121	147.1 Å²	147.1	79%	0.786	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-54.5	118.5	178.7	-22.8	31.5	0	0	0	109.1	R365 R369	R365-P367 WeakPolarHBondContact O-CD 3.49Å; P367-R369 PolarHBondContact O-N 2.67Å; P367-R369 VanDerWaalsContact O-N 3.11Å
368	G	38.3	Very low	42.6	Very low	69 Å²	69	150.9 Å²	150.9	71%	0.711	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-55.4	120.5	175.3	0	0	0	0	0	108.8	M366 S370	M366-G368 PolarHBondContact O-N 3.31Å; G368-S370 PolarHBondContact O-N 2.92Å
369	R	44.3	Very low	41.5	Very low	236 Å²	236	149 Å²	149	89%	0.891	77%	0.766	S	S	*	*			trans	-52	114.9	162.6	-94.4	-178	175.6	175.6	-0.2	106.9	P367 H371	P367-R369 PolarHBondContact O-N 2.67Å; P367-R369 VanDerWaalsContact O-N 3.11Å; R369-H371 PolarHBondContact O-N 2.94Å
370	S	38.7	Very low	40.3	Very low	111 Å²	111	154.4 Å²	154.4	78%	0.776	77%	0.772	S	S	*	*			trans	-43.3	124.3	175.9	37.8	0	0	0	0	110.1	G368 R372	G368-S370 PolarHBondContact O-N 2.92Å; S370-R372 PolarHBondContact O-N 3.49Å
371	H	39.3	Very low	39.2	Very low	179 Å²	179	156.9 Å²	156.9	83%	0.829	78%	0.784	S	S	*	*			trans	-56.3	103.6	165.3	-110.8	-103.4	0	0	0	107.3	R369 R373	R369-H371 PolarHBondContact O-N 2.94Å; H371-R373 VanDerWaalsContact C-N 3.31Å; H371-R373 PolarHBondContact O-N 3.36Å
372	R	37.5	Very low	38	Very low	231 Å²	231	157 Å²	157	87%	0.872	80%	0.802	S	S	*	*			trans	-68.8	99.4	164.9	-157.4	178.2	-163.7	-177.4	4	105.9	S370 V374	S370-R372 PolarHBondContact O-N 3.49Å; R372-V374 PolarHBondContact O-N 3.18Å
373	R	34.5	Very low	37.1	Very low	226 Å²	226	153.9 Å²	153.9	85%	0.853	79%	0.794	S	S	*	*			trans	-58.9	101.8	173.2	-163.2	-177.6	-76.1	-166.3	-2	106.8	H371 R375	H371-R373 VanDerWaalsContact C-N 3.31Å; H371-R373 PolarHBondContact O-N 3.36Å; R373-R375 PolarHBondContact O-N 2.95Å; R373-R375 VanDerWaalsContact O-N 3.12Å
374	V	41.1	Very low	36.6	Very low	130 Å²	130	157.7 Å²	157.7	79%	0.788	80%	0.802	S	S	*	*			trans	-68.2	106.5	169.8	177	0	0	0	0	105.8	R372	R372-V374 PolarHBondContact O-N 3.18Å
375	R	30.7	Very low	36.1	Very low	228 Å²	228	158.2 Å²	158.2	86%	0.86	80%	0.803	S	S	*	*			trans	-69.9	126	163.3	-86	-177	177.2	172.6	-1	107.2	R373	R373-R375 PolarHBondContact O-N 2.95Å; R373-R375 VanDerWaalsContact O-N 3.12Å
376	P	38.6	Very low	35.9	Very low	111 Å²	111	156.7 Å²	156.7	72%	0.721	81%	0.805	S	S	*	*			trans	-75.6	156	168.3	27.2	-20.7	0	0	0	109.9
377	S	32.3	Very low	35.2	Very low	95 Å²	95	154.2 Å²	154.2	66%	0.664	81%	0.805	S	S	*	*			trans	68.9	96	163.7	46.2	0	0	0	0	119.1
378	N	32.1	Very low	35.1	Very low	155 Å²	155	153.1 Å²	153.1	83%	0.829	81%	0.807	S	S	*	*				-105.8	108.2	128.3	-82.2	-4.1	0	0	0	106.7	Y380	N378-Y380 PolarHBondContact O-N 3.26Å
379	I	35.3	Very low	34.8	Very low	145 Å²	145	160.1 Å²	160.1	74%	0.744	84%	0.835	S	S	*	*			trans	-70	119.2	169.6	-69.4	162.6	0	0	0	106.1	V381	I379-V381 PolarHBondContact O-N 2.98Å
380	Y	32.8	Very low	34.3	Very low	223 Å²	223	156.3 Å²	156.3	88%	0.875	83%	0.832	S	S	*	*			trans	-75.8	106.9	168.5	-71.7	-88.4	0	0	0	107.6	N378 C382	N378-Y380 PolarHBondContact O-N 3.26Å; Y380-C382 PolarHBondContact O-N 2.83Å
381	V	31	Very low	34.1	Very low	129 Å²	129	158.7 Å²	158.7	78%	0.782	84%	0.835	S	S	*	*			trans	-73.3	116.4	163.5	176.6	0	0	0	0	106.6	I379 S383	I379-V381 PolarHBondContact O-N 2.98Å; V381-S383 PolarHBondContact O-N 3.26Å
382	C	29.6	Very low	33.8	Very low	123 Å²	123	157.6 Å²	157.6	83%	0.831	84%	0.835	S	S	*	*			trans	-79.9	109.8	169.6	-151	0	0	0	0	106.5	Y380	Y380-C382 PolarHBondContact O-N 2.83Å
383	S	31.6	Very low	33.6	Very low	99 Å²	99	153.2 Å²	153.2	69%	0.692	83%	0.833	S	S	*	*			trans	-83.8	112.7	165.6	69.5	0	0	0	0	108.1	V381 T385	V381-S383 PolarHBondContact O-N 3.26Å; S383-T385 PolarHBondContact O-N 2.98Å
384	E	32.6	Very low	33.5	Very low	185 Å²	185	148.7 Å²	148.7	86%	0.864	83%	0.832	S	S	*	*			trans	-58.2	114.1	162.7	-80.9	176.8	138.7	0	0	108.9	Q386	E384-Q386 PolarHBondContact O-N 3.23Å
385	T	32.6	Very low	33	Very low	130 Å²	130	149.9 Å²	149.9	80%	0.798	84%	0.835	S	S	*	*			trans	-73.8	101.5	159.1	37.5	0	0	0	0	107.8	S383 S387	S383-T385 PolarHBondContact O-N 2.98Å; T385-S387 PolarHBondContact O-N 3.26Å
386	Q	34.5	Very low	33.2	Very low	190 Å²	190	144.4 Å²	144.4	89%	0.888	83%	0.833	S	S	*	*			trans	-69.6	113.4	162.5	-116.4	174.2	-1.7	0	0	108.5	E384 A388	E384-Q386 PolarHBondContact O-N 3.23Å; Q386-A388 PolarHBondContact O-N 3.06Å
387	S	35.5	Very low	32.8	Very low	122 Å²	122	146.9 Å²	146.9	85%	0.853	84%	0.842	S	S	*	*			trans	-65.6	121.6	159.9	-60.2	0	0	0	0	108.5	T385	T385-S387 PolarHBondContact O-N 3.26Å
388	A	33.7	Very low	32.8	Very low	99 Å²	99	151.3 Å²	151.3	82%	0.818	86%	0.856	S	S	*	*			trans	-117.1	123.1	160.2	0	0	0	0	0	107.7	Q386	Q386-A388 PolarHBondContact O-N 3.06Å
389	V	32.6	Very low	32.9	Very low	215 Å²	215	150.9 Å²	150.9	100%	1.303	86%	0.859	S	S	*	*			trans	-69.3	0	164.1	170.2	0	0	0	0	109.2

Retrieved 389 of 389 residues in 409.4 ms (Link to these results)

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