A0A2K5LY92_CERAT Loading...

Chemerin-like receptor 1

AlphaFold DB , UniProt , Accession A0A2K5LY92, Species CERAT (Cercocebus atys, Sooty mangabey), Gene CMKLR1, Length 373 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	35.8	Very low	32.7	Very low	239 Å²	239	164.1 Å²	164.1	100%	1.177	81%	0.806	S	S	*	*				0	100.6	0	-145.9	168	-150.7	0	0	106
2	R	30.9	Very low	32.6	Very low	238 Å²	238	163.1 Å²	163.1	90%	0.898	80%	0.804	S	S	*	*			trans	58.7	113.2	132.4	-101.7	-173.3	-164.6	154	4.6	114.9
3	M	29.7	Very low	32.2	Very low	158 Å²	158	159.2 Å²	159.2	78%	0.778	80%	0.802	S	S	*	*				37.8	119.7	61.8	-89.6	-164.8	-95.2	0	0	111.2
4	E	34.9	Very low	32.1	Very low	162 Å²	162	163.1 Å²	163.1	76%	0.757	81%	0.805	S	S	*	*			cis	-165.9	-172.6	28.2	-100.3	159.8	154.5	0	0	108.8
5	D	33.3	Very low	31.9	Very low	137 Å²	137	156.6 Å²	156.6	73%	0.733	80%	0.796	S	S	*	*			trans	114.2	96.1	159.8	-58.7	-15.9	0	0	0	114.4
6	E	35	Very low	31.8	Very low	174 Å²	174	155.7 Å²	155.7	81%	0.813	79%	0.794	S	S	*	*				81.8	130.8	89.7	-86.7	-170.3	179.1	0	0	110.6
7	D	32.1	Very low	31.7	Very low	128 Å²	128	157.5 Å²	157.5	68%	0.684	80%	0.798	S	S	*	*			cis	-173.1	179.9	14.3	-149.2	-10.6	0	0	0	109.2
8	Y	31.3	Very low	31.7	Very low	200 Å²	200	160.2 Å²	160.2	78%	0.784	80%	0.799	S	S	*	*			trans	96.9	83.5	164.4	-77	-85.3	0	0	0	122.1
9	N	30	Very low	31.8	Very low	135 Å²	135	157.2 Å²	157.2	72%	0.722	79%	0.792	S	S	*	*				53.3	109.5	114.3	-128.9	7.5	0	0	0	120.5
10	T	32.1	Very low	31.9	Very low	138 Å²	138	155.5 Å²	155.5	85%	0.847	79%	0.786	S	S	*	*			trans	-152.9	117	131	-58.3	0	0	0	0	110
11	S	34.9	Very low	31.9	Very low	96 Å²	96	157.1 Å²	157.1	67%	0.671	78%	0.783	S	S	*	*			trans	-69.2	129	178.2	50.1	0	0	0	0	114
12	I	30.9	Very low	31.8	Very low	152 Å²	152	152.2 Å²	152.2	78%	0.779	76%	0.762	S	S	*	*			trans	-142.8	95	143.3	-56.9	-176.5	0	0	0	107.5
13	S	28.2	Very low	31.7	Very low	112 Å²	112	147 Å²	147	78%	0.783	75%	0.751	S	S	*	*			trans	-86	118.3	166.9	-179.2	0	0	0	0	107.9	G15	S13-G15 PolarHBondContact O-N 3.4Å; S13-G15 VanDerWaalsContact O-N 3.1Å
14	Y	30.6	Very low	31.7	Very low	215 Å²	215	144 Å²	144	84%	0.843	75%	0.746	S	S	*	*			trans	-69.2	100.3	160.6	-90.1	-94.4	0	0	0	107.4	D16	Y14-D16 PolarHBondContact O-N 3.43Å
15	G	28.4	Very low	31.7	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	74%	0.74	S	S	*	*			trans	-82.5	101.6	167	0	0	0	0	0	109	S13 E17	S13-G15 PolarHBondContact O-N 3.4Å; S13-G15 VanDerWaalsContact O-N 3.1Å; G15-E17 VanDerWaalsContact C-N 3.27Å; G15-E17 PolarHBondContact O-N 2.89Å; G15-E17 VanDerWaalsContact O-N 3.13Å
16	D	30.4	Very low	31.7	Very low	142 Å²	142	141.1 Å²	141.1	76%	0.759	74%	0.738	S	S	*	*			trans	-77.2	87.7	159.8	-84.2	-28.7	0	0	0	107.8	Y14 Y18	Y14-D16 PolarHBondContact O-N 3.43Å; D16-Y18 VanDerWaalsContact C-N 3.32Å; D16-Y18 PolarHBondContact O-N 3.18Å; D16-Y18 VanDerWaalsContact O-N 3.12Å
17	E	30.6	Very low	31.7	Very low	186 Å²	186	138.3 Å²	138.3	87%	0.869	73%	0.733	S	S	*	*			trans	-75.4	85.9	167	-163	169.4	-155.1	0	0	107.6	G15 P19	G15-E17 VanDerWaalsContact C-N 3.27Å; G15-E17 PolarHBondContact O-N 2.89Å; G15-E17 VanDerWaalsContact O-N 3.13Å; E17-P19 WeakPolarHBondContact O-CD 3.49Å
18	Y	32.2	Very low	32.2	Very low	206 Å²	206	137.7 Å²	137.7	81%	0.808	73%	0.729	S	S	*	*			trans	-71.8	119.8	164.1	-98	-91.8	0	0	0	107.7	D16 D20	D16-Y18 VanDerWaalsContact C-N 3.32Å; D16-Y18 PolarHBondContact O-N 3.18Å; D16-Y18 VanDerWaalsContact O-N 3.12Å; Y18-D20 PolarHBondContact O-N 3.23Å
19	P	33.4	Very low	32.9	Very low	104 Å²	104	135.4 Å²	135.4	68%	0.675	73%	0.725	S	S	*	*			trans	-65.2	126.4	178.6	25.2	-30.3	0	0	0	108.8	E17 Y21	E17-P19 WeakPolarHBondContact O-CD 3.49Å; P19-Y21 PolarHBondContact O-N 3.23Å
20	D	33.2	Very low	34.1	Very low	123 Å²	123	136.6 Å²	136.6	66%	0.658	73%	0.727	S	S	*	*			trans	-64.8	75	177.8	-151.9	-6.7	0	0	0	110.3	Y18 L22	Y18-D20 PolarHBondContact O-N 3.23Å; D20-L22 PolarHBondContact O-N 3.44Å
21	Y	31.7	Very low	35.5	Very low	189 Å²	189	132 Å²	132	74%	0.741	70%	0.696	S	S	*	*			trans	-82.9	-1.3	177.8	-144.3	-94.2	0	0	0	111.9	P19	P19-Y21 PolarHBondContact O-N 3.23Å
22	L	33.2	Very low	37.4	Very low	137 Å²	137	129.4 Å²	129.4	72%	0.717	68%	0.679	S	S	*	*	S	Bend	trans	-99.7	-12	-175.6	-153.4	71.5	0	0	0	113.3	D20 S24	D20-L22 PolarHBondContact O-N 3.44Å; L22-S24 VanDerWaalsContact C-N 3.31Å
23	D	29.5	Very low	39.6	Very low	127 Å²	127	127.8 Å²	127.8	68%	0.679	68%	0.678	S	S	*	*	S	Bend	trans	-84.7	-8.5	175.6	-143.4	29.3	0	0	0	112.7
24	S	30.9	Very low	42.2	Very low	95 Å²	95	128.3 Å²	128.3	66%	0.664	67%	0.671	S	S	*	*	S	Bend	trans	-99.4	-4.7	-179.7	-62.4	0	0	0	0	114.9	L22	L22-S24 VanDerWaalsContact C-N 3.31Å
25	I	33.8	Very low	44.7	Very low	125 Å²	125	122.7 Å²	122.7	64%	0.641	65%	0.653	S	S	*	*	S	Bend	trans	-98.8	-8.6	-179.3	-65.2	177.9	0	0	0	112.4
26	V	34.3	Very low	47.2	Very low	115 Å²	115	121.4 Å²	121.4	70%	0.697	64%	0.636	S	S	*	*			trans	-113.4	32.6	175	-160.5	0	0	0	0	111.3	L28	V26-L28 PolarHBondContact O-N 3.22Å
27	V	33.8	Very low	49.9	Very low	115 Å²	115	121.8 Å²	121.8	70%	0.697	63%	0.627	S	S	*	*			trans	-75.5	78	145.6	-174.2	0	0	0	0	105.3	E29	V27-E29 VanDerWaalsContact C-N 3.28Å; V27-E29 PolarHBondContact O-N 3.32Å
28	L	42.3	Very low	52.7	Low	115 Å²	115	117 Å²	117	60%	0.602	61%	0.61	S	S	*	*			trans	-50.1	110.8	151.6	-145.9	110.2	0	0	0	102.8	V26 E30	V26-L28 PolarHBondContact O-N 3.22Å; L28-E30 HydrophobicContact CD2-CG 3.94Å; L28-E30 PolarHBondContact O-N 2.94Å
29	E	45.8	Very low	55.4	Low	151 Å²	151	108.5 Å²	108.5	71%	0.706	58%	0.579	S	S	*	*			trans	-63.9	79.8	167.1	-166.1	172.7	-169.7	0	0	104.7	V27 L31	V27-E29 VanDerWaalsContact C-N 3.28Å; V27-E29 PolarHBondContact O-N 3.32Å; E29-L31 VanDerWaalsContact C-N 3.26Å; E29-L31 PolarHBondContact O-N 3.4Å
30	E	56	Low	58.1	Low	161 Å²	161	105.8 Å²	105.8	75%	0.752	56%	0.556	S	S	*	*			trans	-59.8	103.9	167.6	-82.4	-142	156.8	0	0	103.5	L28 S32	L28-E30 HydrophobicContact CD2-CG 3.94Å; L28-E30 PolarHBondContact O-N 2.94Å; E30-S32 PolarHBondContact O-N 3.49Å; E30-S32 VanDerWaalsContact O-N 3.16Å
31	L	61.6	Low	60.9	Low	40 Å²	40	104.6 Å²	104.6	21%	0.209	55%	0.548	C	S	.	.			trans	-37.2	126.1	169.2	-173.4	71.7	0	0	0	108.2	E29 E35 A36 L296	E29-L31 VanDerWaalsContact C-N 3.26Å; E29-L31 PolarHBondContact O-N 3.4Å; L31-E35 HydrophobicContact CD1-CB 3.62Å; L31-E35 HydrophobicContact CD1-CG 4.33Å; L31-E35 WeakPolarHBondContact CD1-OE2 3.5Å; L31-E35 HydrophobicContact CD2-CB 4.13Å; L31-E35 HydrophobicContact CG-CB 3.61Å; L31-A36 HydrophobicContact CD2-CB 3.87Å; L31-L296 HydrophobicContact CD1-CD1 3.49Å; L31-L296 VanDerWaalsContact CD1-CD1 3.49Å; L31-L296 HydrophobicContact CD1-CD2 4.07Å; L31-L296 HydrophobicContact CD1-CG 3.94Å; L31-L296 HydrophobicContact CD2-CD1 4.29Å; L31-L296 HydrophobicContact CD2-CD2 3.38Å; L31-L296 HydrophobicContact CD2-CG 3.78Å; L31-L296 HydrophobicContact CG-CD1 4.49Å; L31-L296 HydrophobicContact CG-CD2 4.37Å; L31-L296 HydrophobicContact CG-CG 4.45Å
32	S	73.7	Confident	63.9	Low	43 Å²	43	100.9 Å²	100.9	30%	0.301	54%	0.536	S	S	.	.			trans	-54	143.3	-174.5	65.9	0	0	0	0	109.3	E30 L34 E35 A36	E30-S32 PolarHBondContact O-N 3.49Å; E30-S32 VanDerWaalsContact O-N 3.16Å; S32-L34 CarbonylContact O-C 3.57Å; S32-L34 PolarHBondContact O-N 3.37Å; S32-E35 WeakPolarHBondContact CB-OE2 2.86Å; S32-E35 PolarHBondContact N-OE2 2.95Å; S32-E35 PolarHBondContact O-N 3.31Å; S32-E35 WeakPolarHBondContact OG-CB 3.48Å; S32-E35 WeakPolarHBondContact OG-CG 3.45Å; S32-E35 PolarHBondContact OG-N 3.26Å; S32-E35 PolarHBondContact OG-OE2 2.94Å; S32-A36 PolarHBondContact O-N 2.94Å
33	P	77.4	Confident	66.7	Low	117 Å²	117	94.4 Å²	94.4	76%	0.76	50%	0.502	S	S	*	.	H	α-helix	trans	-56.8	-23.6	-177.4	17.6	-29.9	0	0	0	112.5	R37	P33-R37 WeakPolarHBondContact O-CB 3.38Å; P33-R37 PolarHBondContact O-N 3.46Å
34	L	83.4	Confident	69.8	Low	123 Å²	123	89.9 Å²	89.9	64%	0.644	48%	0.479	S	S	*	.	H	α-helix	trans	-69	-51.2	170.9	-177	63.5	0	0	0	112.4	S32 A36 R37 V38	S32-L34 CarbonylContact O-C 3.57Å; S32-L34 PolarHBondContact O-N 3.37Å; L34-A36 VanDerWaalsContact C-N 3.34Å; L34-A36 PolarHBondContact O-N 2.97Å; L34-R37 WeakPolarHBondContact O-CB 3.48Å; L34-R37 PolarHBondContact O-N 3.27Å; L34-R37 VanDerWaalsContact O-N 3.15Å; L34-V38 HydrophobicContact CD1-CG2 4.33Å; L34-V38 HydrophobicContact CG-CG2 4.44Å; L34-V38 VanDerWaalsContact O-CG2 3.32Å; L34-V38 WeakPolarHBondContact O-CG2 3.45Å; L34-V38 PolarHBondContact O-N 3.49Å
35	E	82.4	Confident	72.9	Confident	98 Å²	98	88.9 Å²	88.9	46%	0.458	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-38.6	179.2	-75.3	165.3	147.7	0	0	112.7	L31 S32 R37 V38 T39	L31-E35 HydrophobicContact CD1-CB 3.62Å; L31-E35 HydrophobicContact CD1-CG 4.33Å; L31-E35 WeakPolarHBondContact CD1-OE2 3.5Å; L31-E35 HydrophobicContact CD2-CB 4.13Å; L31-E35 HydrophobicContact CG-CB 3.61Å; S32-E35 WeakPolarHBondContact CB-OE2 2.86Å; S32-E35 PolarHBondContact N-OE2 2.95Å; S32-E35 PolarHBondContact O-N 3.31Å; S32-E35 WeakPolarHBondContact OG-CB 3.48Å; S32-E35 WeakPolarHBondContact OG-CG 3.45Å; S32-E35 PolarHBondContact OG-N 3.26Å; S32-E35 PolarHBondContact OG-OE2 2.94Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 2.92Å; E35-V38 PolarHBondContact O-N 2.92Å; E35-T39 VanDerWaalsContact O-CB 3.28Å; E35-T39 WeakPolarHBondContact O-CB 3.28Å; E35-T39 PolarHBondContact O-N 3.25Å; E35-T39 PolarHBondContact O-OG1 3.28Å
36	A	81.9	Confident	75.8	Confident	38 Å²	38	84.4 Å²	84.4	31%	0.314	45%	0.447	S	S	.	.	H	α-helix	trans	-60.8	-43.9	173.2	0	0	0	0	0	111.2	L31 S32 L34 R40	L31-A36 HydrophobicContact CD2-CB 3.87Å; S32-A36 PolarHBondContact O-N 2.94Å; L34-A36 VanDerWaalsContact C-N 3.34Å; L34-A36 PolarHBondContact O-N 2.97Å; A36-R40 WeakPolarHBondContact O-CB 3.37Å; A36-R40 PolarHBondContact O-N 3.27Å
37	R	87.4	Confident	78.7	Confident	150 Å²	150	79.1 Å²	79.1	57%	0.566	42%	0.415	S	S	*	.	H	α-helix	trans	-66.1	-44.5	177.1	175.5	177.8	-73.8	-163.7	-2.7	111.9	P33 L34 E35 R40 I41	P33-R37 WeakPolarHBondContact O-CB 3.38Å; P33-R37 PolarHBondContact O-N 3.46Å; L34-R37 WeakPolarHBondContact O-CB 3.48Å; L34-R37 PolarHBondContact O-N 3.27Å; L34-R37 VanDerWaalsContact O-N 3.15Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 2.92Å; R37-R40 PolarHBondContact O-N 3.06Å; R37-I41 HydrophobicContact CG-CD1 3.94Å; R37-I41 VanDerWaalsContact O-CG1 3.3Å; R37-I41 WeakPolarHBondContact O-CG1 3.47Å; R37-I41 PolarHBondContact O-N 3.37Å
38	V	89.7	Confident	81.6	Confident	85 Å²	85	76.1 Å²	76.1	52%	0.515	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-48.4	178.2	170.5	0	0	0	0	110.5	L34 E35 R40 I41 F42	L34-V38 HydrophobicContact CD1-CG2 4.33Å; L34-V38 HydrophobicContact CG-CG2 4.44Å; L34-V38 VanDerWaalsContact O-CG2 3.32Å; L34-V38 WeakPolarHBondContact O-CG2 3.45Å; L34-V38 PolarHBondContact O-N 3.49Å; E35-V38 PolarHBondContact O-N 2.92Å; V38-R40 VanDerWaalsContact C-N 3.33Å; V38-R40 PolarHBondContact O-N 3.27Å; V38-I41 PolarHBondContact O-N 3.31Å; V38-F42 WeakPolarHBondContact O-CB 3.41Å; V38-F42 PolarHBondContact O-N 3.04Å
39	T	87.8	Confident	84.1	Confident	27 Å²	27	75 Å²	75	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-57.5	-46.3	177	-59.9	0	0	0	0	111.1	E35 F42 L43 L296	E35-T39 VanDerWaalsContact O-CB 3.28Å; E35-T39 WeakPolarHBondContact O-CB 3.28Å; E35-T39 PolarHBondContact O-N 3.25Å; E35-T39 PolarHBondContact O-OG1 3.28Å; T39-F42 WeakPolarHBondContact O-CB 3.36Å; T39-F42 PolarHBondContact O-N 3.44Å; T39-L43 HydrophobicContact CG2-CD1 3.88Å; T39-L43 HydrophobicContact CG2-CG 4.33Å; T39-L43 WeakPolarHBondContact O-CB 3.37Å; T39-L43 WeakPolarHBondContact O-CG 3.38Å; T39-L43 PolarHBondContact O-N 2.79Å; T39-L296 HydrophobicContact CG2-CD2 3.98Å
40	R	90.1	Very high	86.4	Confident	48 Å²	48	68.1 Å²	68.1	18%	0.181	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-46.9	177.4	-175.8	-179.3	59.6	-122.4	-7.7	112.6	A36 R37 V38 F42 L43 V44 A99 D102	A36-R40 WeakPolarHBondContact O-CB 3.37Å; A36-R40 PolarHBondContact O-N 3.27Å; R37-R40 PolarHBondContact O-N 3.06Å; V38-R40 VanDerWaalsContact C-N 3.33Å; V38-R40 PolarHBondContact O-N 3.27Å; R40-F42 VanDerWaalsContact C-N 3.32Å; R40-F42 PolarHBondContact O-N 3.2Å; R40-L43 PolarHBondContact O-N 3.46Å; R40-V44 WeakPolarHBondContact O-CG2 3.29Å; R40-V44 PolarHBondContact O-N 3.06Å; R40-A99 WeakPolarHBondContact CD-O 3.38Å; R40-A99 WeakPolarHBondContact CG-O 3.33Å; R40-D102 IonicContact CZ-OD1 3.62Å; R40-D102 IonicContact NH1-OD1 2.65Å; R40-D102 PolarHBondContact NH1-OD1 3.17Å
41	I	93	Very high	88.3	Confident	97 Å²	97	61 Å²	61	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-46.4	177.4	-69	166.4	0	0	0	110	R37 V38 L43 V44 V45	R37-I41 HydrophobicContact CG-CD1 3.94Å; R37-I41 VanDerWaalsContact O-CG1 3.3Å; R37-I41 WeakPolarHBondContact O-CG1 3.47Å; R37-I41 PolarHBondContact O-N 3.37Å; V38-I41 PolarHBondContact O-N 3.31Å; I41-L43 PolarHBondContact O-N 2.99Å; I41-V44 PolarHBondContact O-N 2.85Å; I41-V45 WeakPolarHBondContact O-CG2 3.34Å; I41-V45 PolarHBondContact O-N 3.41Å
42	F	93.3	Very high	89.8	Confident	112 Å²	112	65.4 Å²	65.4	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-56.6	-48.7	176.1	173.2	-99.2	0	0	0	111.9	V38 T39 R40 V44 V45 V46 L300	V38-F42 WeakPolarHBondContact O-CB 3.41Å; V38-F42 PolarHBondContact O-N 3.04Å; T39-F42 WeakPolarHBondContact O-CB 3.36Å; T39-F42 PolarHBondContact O-N 3.44Å; R40-F42 VanDerWaalsContact C-N 3.32Å; R40-F42 PolarHBondContact O-N 3.2Å; F42-V44 PolarHBondContact O-N 2.88Å; F42-V45 PolarHBondContact O-N 3.04Å; F42-V46 HydrophobicContact CD1-CG2 4.29Å; F42-V46 HydrophobicContact CD2-CG2 4.28Å; F42-V46 HydrophobicContact CE1-CG2 3.87Å; F42-V46 HydrophobicContact CE2-CG2 3.86Å; F42-V46 HydrophobicContact CG-CG2 4.49Å; F42-V46 HydrophobicContact CZ-CG2 3.63Å; F42-V46 WeakPolarHBondContact O-CG2 3.43Å; F42-V46 PolarHBondContact O-N 3.33Å; F42-L300 HydrophobicContact CD1-CD2 4.18Å; F42-L300 HydrophobicContact CE1-CD2 4.01Å
43	L	92.6	Very high	90.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.7	-45.7	178.7	-71.1	169.2	0	0	0	112.1	T39 R40 I41 V45 V46 Y47 Y103 P299 L300 A303	T39-L43 HydrophobicContact CG2-CD1 3.88Å; T39-L43 HydrophobicContact CG2-CG 4.33Å; T39-L43 WeakPolarHBondContact O-CB 3.37Å; T39-L43 WeakPolarHBondContact O-CG 3.38Å; T39-L43 PolarHBondContact O-N 2.79Å; R40-L43 PolarHBondContact O-N 3.46Å; I41-L43 PolarHBondContact O-N 2.99Å; L43-V45 VanDerWaalsContact C-N 3.31Å; L43-V45 PolarHBondContact O-N 3.28Å; L43-V46 PolarHBondContact O-N 3.4Å; L43-Y47 HydrophobicContact CB-CD2 4.32Å; L43-Y47 HydrophobicContact CB-CE2 3.97Å; L43-Y47 HydrophobicContact CD2-CE2 4.45Å; L43-Y47 WeakPolarHBondContact O-CB 3.4Å; L43-Y47 WeakPolarHBondContact O-CD2 3.47Å; L43-Y47 VanDerWaalsContact O-CG 3.24Å; L43-Y47 PolarHBondContact O-N 3.42Å; L43-Y103 WeakPolarHBondContact CD1-OH 2.91Å; L43-P299 HydrophobicContact CD1-CB 3.6Å; L43-L300 HydrophobicContact CD2-CD2 4.21Å; L43-A303 HydrophobicContact CD2-CB 3.5Å; L43-A303 VanDerWaalsContact CD2-CB 3.5Å
44	V	95.1	Very high	91.5	Very high	32 Å²	32	60.9 Å²	60.9	19%	0.194	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-43.2	177	169.6	0	0	0	0	111	R40 I41 F42 S48 I96 A99 A100	R40-V44 WeakPolarHBondContact O-CG2 3.29Å; R40-V44 PolarHBondContact O-N 3.06Å; I41-V44 PolarHBondContact O-N 2.85Å; F42-V44 PolarHBondContact O-N 2.88Å; V44-S48 VanDerWaalsContact O-CB 3.31Å; V44-S48 WeakPolarHBondContact O-CB 3.44Å; V44-S48 PolarHBondContact O-N 3.29Å; V44-S48 PolarHBondContact O-OG 3.5Å; V44-I96 HydrophobicContact CG1-CG2 4.22Å; V44-A99 HydrophobicContact CG2-CB 3.91Å; V44-A100 HydrophobicContact CG2-CB 4.06Å
45	V	95.6	Very high	92	Very high	74 Å²	74	57.9 Å²	57.9	45%	0.448	30%	0.296	S	S	.	.	H	α-helix	trans	-63.2	-48.8	176.4	171.1	0	0	0	0	110.7	I41 F42 L43 S48 I49	I41-V45 WeakPolarHBondContact O-CG2 3.34Å; I41-V45 PolarHBondContact O-N 3.41Å; F42-V45 PolarHBondContact O-N 3.04Å; L43-V45 VanDerWaalsContact C-N 3.31Å; L43-V45 PolarHBondContact O-N 3.28Å; V45-S48 PolarHBondContact O-N 3.49Å; V45-I49 HydrophobicContact CG1-CD1 3.85Å; V45-I49 WeakPolarHBondContact O-CG1 3.44Å; V45-I49 PolarHBondContact O-N 3.33Å
46	V	94.3	Very high	92.4	Very high	32 Å²	32	57.9 Å²	57.9	19%	0.194	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-50.5	178.8	169.8	0	0	0	0	110.9	F42 L43 S48 I49 V50 A303	F42-V46 HydrophobicContact CD1-CG2 4.29Å; F42-V46 HydrophobicContact CD2-CG2 4.28Å; F42-V46 HydrophobicContact CE1-CG2 3.87Å; F42-V46 HydrophobicContact CE2-CG2 3.86Å; F42-V46 HydrophobicContact CG-CG2 4.49Å; F42-V46 HydrophobicContact CZ-CG2 3.63Å; F42-V46 WeakPolarHBondContact O-CG2 3.43Å; F42-V46 PolarHBondContact O-N 3.33Å; L43-V46 PolarHBondContact O-N 3.4Å; V46-S48 VanDerWaalsContact C-N 3.29Å; V46-S48 PolarHBondContact O-N 3.33Å; V46-I49 PolarHBondContact O-N 3.02Å; V46-V50 HydrophobicContact CG1-CG2 4.27Å; V46-V50 VanDerWaalsContact O-CG2 3.29Å; V46-V50 WeakPolarHBondContact O-CG2 3.31Å; V46-V50 PolarHBondContact O-N 3.3Å; V46-A303 HydrophobicContact CG1-CB 4.39Å
47	Y	94.6	Very high	92.7	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-37.7	178.8	-66.1	-43.8	0	0	0	112.5	L43 V50 C51 H95 A99 A303 I306	L43-Y47 HydrophobicContact CB-CD2 4.32Å; L43-Y47 HydrophobicContact CB-CE2 3.97Å; L43-Y47 HydrophobicContact CD2-CE2 4.45Å; L43-Y47 WeakPolarHBondContact O-CB 3.4Å; L43-Y47 WeakPolarHBondContact O-CD2 3.47Å; L43-Y47 VanDerWaalsContact O-CG 3.24Å; L43-Y47 PolarHBondContact O-N 3.42Å; Y47-V50 PolarHBondContact O-N 3.27Å; Y47-C51 WeakPolarHBondContact O-CB 3.46Å; Y47-C51 PolarHBondContact O-N 3.32Å; Y47-H95 AromaticContact CE2-CD2 3.62Å; Y47-H95 AromaticContact CE2-NE2 3.68Å; Y47-H95 AromaticContact CZ-CD2 3.66Å; Y47-H95 AromaticContact CZ-NE2 3.51Å; Y47-H95 PolarHBondContact OH-NE2 2.73Å; Y47-A99 HydrophobicContact CD2-CB 4.39Å; Y47-A99 HydrophobicContact CE2-CB 4.33Å; Y47-A303 HydrophobicContact CE1-CB 3.77Å; Y47-I306 HydrophobicContact CD1-CB 4.49Å; Y47-I306 HydrophobicContact CD1-CD1 4.33Å; Y47-I306 HydrophobicContact CD1-CG2 3.94Å; Y47-I306 HydrophobicContact CE1-CB 4.18Å; Y47-I306 HydrophobicContact CE1-CD1 3.7Å; Y47-I306 HydrophobicContact CE1-CG1 4.45Å; Y47-I306 HydrophobicContact CE1-CG2 4.12Å
48	S	96	Very high	92.9	Very high	51 Å²	51	49.9 Å²	49.9	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-42.7	177.1	-59.7	0	0	0	0	112	V44 V45 V46 C51 F52	V44-S48 VanDerWaalsContact O-CB 3.31Å; V44-S48 WeakPolarHBondContact O-CB 3.44Å; V44-S48 PolarHBondContact O-N 3.29Å; V44-S48 PolarHBondContact O-OG 3.5Å; V45-S48 PolarHBondContact O-N 3.49Å; V46-S48 VanDerWaalsContact C-N 3.29Å; V46-S48 PolarHBondContact O-N 3.33Å; S48-C51 PolarHBondContact O-N 3.05Å; S48-F52 WeakPolarHBondContact O-CB 3.29Å; S48-F52 PolarHBondContact O-N 2.9Å
49	I	94.6	Very high	93	Very high	91 Å²	91	46.4 Å²	46.4	47%	0.467	25%	0.247	S	C	.	.	H	α-helix	trans	-63.9	-47.5	175.2	-68.1	167.8	0	0	0	110.4	V45 V46 C51 F52 L53	V45-I49 HydrophobicContact CG1-CD1 3.85Å; V45-I49 WeakPolarHBondContact O-CG1 3.44Å; V45-I49 PolarHBondContact O-N 3.33Å; V46-I49 PolarHBondContact O-N 3.02Å; I49-C51 VanDerWaalsContact C-N 3.34Å; I49-C51 PolarHBondContact O-N 3.39Å; I49-F52 PolarHBondContact O-N 2.91Å; I49-L53 HydrophobicContact CG2-CD1 3.62Å; I49-L53 HydrophobicContact CG2-CG 4.23Å; I49-L53 WeakPolarHBondContact O-CB 3.32Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.47Å; I49-L53 PolarHBondContact O-N 3.43Å
50	V	93.9	Very high	93	Very high	7 Å²	7	47.6 Å²	47.6	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-45	178.6	172.4	0	0	0	0	110.9	V46 Y47 L53 G54 L92 I306 A307 C310	V46-V50 HydrophobicContact CG1-CG2 4.27Å; V46-V50 VanDerWaalsContact O-CG2 3.29Å; V46-V50 WeakPolarHBondContact O-CG2 3.31Å; V46-V50 PolarHBondContact O-N 3.3Å; Y47-V50 PolarHBondContact O-N 3.27Å; V50-L53 PolarHBondContact O-N 2.93Å; V50-G54 WeakPolarHBondContact O-CA 3.36Å; V50-G54 PolarHBondContact O-N 3.21Å; V50-L92 HydrophobicContact CB-CD2 4.38Å; V50-L92 HydrophobicContact CG1-CD2 4Å; V50-I306 HydrophobicContact CG1-CG2 3.92Å; V50-A307 HydrophobicContact CG2-CB 3.86Å; V50-C310 HydrophobicContact CG1-CB 4.12Å
51	C	95.4	Very high	92.8	Very high	13 Å²	13	45.4 Å²	45.4	9%	0.088	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-51.2	177.1	-177.9	0	0	0	0	111.4	Y47 S48 I49 G54 I55 L92 I96	Y47-C51 WeakPolarHBondContact O-CB 3.46Å; Y47-C51 PolarHBondContact O-N 3.32Å; S48-C51 PolarHBondContact O-N 3.05Å; I49-C51 VanDerWaalsContact C-N 3.34Å; I49-C51 PolarHBondContact O-N 3.39Å; C51-G54 PolarHBondContact O-N 3.36Å; C51-I55 WeakPolarHBondContact O-CB 3.46Å; C51-I55 VanDerWaalsContact O-CG1 3.31Å; C51-I55 WeakPolarHBondContact O-CG1 3.36Å; C51-I55 PolarHBondContact O-N 2.93Å; C51-L92 HydrophobicContact CB-CB 4.49Å; C51-L92 HydrophobicContact CB-CD2 3.83Å; C51-L92 HydrophobicContact CB-CG 4.3Å; C51-I96 HydrophobicContact CB-CD1 3.9Å
52	F	94.3	Very high	92.6	Very high	131 Å²	131	42.6 Å²	42.6	58%	0.575	23%	0.23	S	C	*	.	H	α-helix	trans	-60.7	-50.1	179.8	177.2	-101.8	0	0	0	112.2	S48 I49 G54 L56	S48-F52 WeakPolarHBondContact O-CB 3.29Å; S48-F52 PolarHBondContact O-N 2.9Å; I49-F52 PolarHBondContact O-N 2.91Å; F52-G54 VanDerWaalsContact C-N 3.34Å; F52-L56 HydrophobicContact CD1-CD1 4.06Å; F52-L56 HydrophobicContact CD2-CD1 4.01Å; F52-L56 HydrophobicContact CE1-CD1 3.51Å; F52-L56 HydrophobicContact CE2-CD1 3.47Å; F52-L56 VanDerWaalsContact CE2-CD1 3.47Å; F52-L56 HydrophobicContact CE2-CG 4.36Å; F52-L56 HydrophobicContact CG-CD1 4.29Å; F52-L56 HydrophobicContact CZ-CD1 3.2Å; F52-L56 HydrophobicContact CZ-CG 4.47Å; F52-L56 WeakPolarHBondContact O-CB 3.48Å; F52-L56 WeakPolarHBondContact O-CG 3.41Å; F52-L56 PolarHBondContact O-N 3.3Å; F52-L56 VanDerWaalsContact O-N 3.12Å
53	L	92.4	Very high	92.2	Very high	66 Å²	66	41.9 Å²	41.9	35%	0.346	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-36.4	179.3	-66.6	177.2	0	0	0	112	I49 V50 G57 C310 I314	I49-L53 HydrophobicContact CG2-CD1 3.62Å; I49-L53 HydrophobicContact CG2-CG 4.23Å; I49-L53 WeakPolarHBondContact O-CB 3.32Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.47Å; I49-L53 PolarHBondContact O-N 3.43Å; V50-L53 PolarHBondContact O-N 2.93Å; L53-G57 WeakPolarHBondContact O-CA 3.35Å; L53-G57 PolarHBondContact O-N 3.26Å; L53-C310 HydrophobicContact CB-CB 3.96Å; L53-I314 HydrophobicContact CD1-CD1 4.12Å
54	G	92.7	Very high	91.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-47.7	179.4	0	0	0	0	0	112.3	V50 C51 F52 N58	V50-G54 WeakPolarHBondContact O-CA 3.36Å; V50-G54 PolarHBondContact O-N 3.21Å; C51-G54 PolarHBondContact O-N 3.36Å; F52-G54 VanDerWaalsContact C-N 3.34Å; G54-N58 WeakPolarHBondContact O-CB 3.33Å; G54-N58 PolarHBondContact O-N 2.97Å; G54-N58 PolarHBondContact O-ND2 3.45Å
55	I	93.9	Very high	90.9	Very high	59 Å²	59	40.4 Å²	40.4	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-50.1	177	-68.3	172.8	0	0	0	110.4	C51 G59 F86 N89	C51-I55 WeakPolarHBondContact O-CB 3.46Å; C51-I55 VanDerWaalsContact O-CG1 3.31Å; C51-I55 WeakPolarHBondContact O-CG1 3.36Å; C51-I55 PolarHBondContact O-N 2.93Å; I55-G59 WeakPolarHBondContact O-CA 3.49Å; I55-G59 PolarHBondContact O-N 3.28Å; I55-F86 HydrophobicContact CG2-CE2 4Å; I55-N89 HydrophobicContact CG1-CB 4.04Å
56	L	91.3	Very high	90.2	Very high	99 Å²	99	39.6 Å²	39.6	52%	0.518	22%	0.217	S	C	.	.	H	α-helix	trans	-67.2	-48.4	-178.5	-71.7	179.8	0	0	0	112.5	F52 L60	F52-L56 HydrophobicContact CD1-CD1 4.06Å; F52-L56 HydrophobicContact CD2-CD1 4.01Å; F52-L56 HydrophobicContact CE1-CD1 3.51Å; F52-L56 HydrophobicContact CE2-CD1 3.47Å; F52-L56 VanDerWaalsContact CE2-CD1 3.47Å; F52-L56 HydrophobicContact CE2-CG 4.36Å; F52-L56 HydrophobicContact CG-CD1 4.29Å; F52-L56 HydrophobicContact CZ-CD1 3.2Å; F52-L56 HydrophobicContact CZ-CG 4.47Å; F52-L56 WeakPolarHBondContact O-CB 3.48Å; F52-L56 WeakPolarHBondContact O-CG 3.41Å; F52-L56 PolarHBondContact O-N 3.3Å; F52-L56 VanDerWaalsContact O-N 3.12Å; L56-L60 VanDerWaalsContact O-CB 3.3Å; L56-L60 WeakPolarHBondContact O-CB 3.24Å; L56-L60 PolarHBondContact O-N 2.82Å
57	G	88.9	Confident	89.4	Confident	17 Å²	17	45.9 Å²	45.9	18%	0.175	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-54	-175.8	0	0	0	0	0	112	L53 L60 V61	L53-G57 WeakPolarHBondContact O-CA 3.35Å; L53-G57 PolarHBondContact O-N 3.26Å; G57-L60 PolarHBondContact O-N 2.73Å; G57-V61 WeakPolarHBondContact O-CG2 3.42Å; G57-V61 PolarHBondContact O-N 2.84Å; G57-V61 VanDerWaalsContact O-N 3.11Å
58	N	92.2	Very high	88.3	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.011	27%	0.267	C	S	.	.	H	α-helix	trans	-70.2	-35.7	-179.1	-64	-57.6	0	0	0	111.5	G54 L60 V61 I62 A82 D85 F86 S309 P313	G54-N58 WeakPolarHBondContact O-CB 3.33Å; G54-N58 PolarHBondContact O-N 2.97Å; G54-N58 PolarHBondContact O-ND2 3.45Å; N58-L60 VanDerWaalsContact C-N 3.35Å; N58-L60 PolarHBondContact O-N 2.96Å; N58-V61 PolarHBondContact O-N 3.48Å; N58-I62 VanDerWaalsContact O-CG1 3.29Å; N58-I62 WeakPolarHBondContact O-CG1 3.45Å; N58-I62 PolarHBondContact O-N 3.28Å; N58-A82 HydrophobicContact CB-CB 4.34Å; N58-D85 WeakPolarHBondContact ND2-CB 3.18Å; N58-F86 HydrophobicContact CB-CB 4.01Å; N58-S309 PolarHBondContact ND2-O 2.96Å; N58-P313 WeakPolarHBondContact OD1-CD 3.43Å; N58-P313 WeakPolarHBondContact OD1-CG 3.47Å
59	G	91.1	Very high	87.2	Confident	12 Å²	12	50.3 Å²	50.3	12%	0.124	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-43.5	172.5	0	0	0	0	0	112.6	I55 V61 I62 I63	I55-G59 WeakPolarHBondContact O-CA 3.49Å; I55-G59 PolarHBondContact O-N 3.28Å; G59-V61 PolarHBondContact O-N 2.9Å; G59-I62 PolarHBondContact O-N 3.16Å; G59-I63 VanDerWaalsContact O-CG1 3.32Å; G59-I63 WeakPolarHBondContact O-CG1 3.31Å; G59-I63 PolarHBondContact O-N 2.98Å
60	L	87.4	Confident	86.3	Confident	53 Å²	53	54.4 Å²	54.4	28%	0.277	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-43.5	174.8	-178.8	65	0	0	0	111.9	L56 G57 N58 I62 I63 I64 L330 L334	L56-L60 VanDerWaalsContact O-CB 3.3Å; L56-L60 WeakPolarHBondContact O-CB 3.24Å; L56-L60 PolarHBondContact O-N 2.82Å; G57-L60 PolarHBondContact O-N 2.73Å; N58-L60 VanDerWaalsContact C-N 3.35Å; N58-L60 PolarHBondContact O-N 2.96Å; L60-I62 VanDerWaalsContact C-N 3.34Å; L60-I62 PolarHBondContact O-N 2.94Å; L60-I63 PolarHBondContact O-N 3.3Å; L60-I64 HydrophobicContact CD1-CD1 3.85Å; L60-I64 HydrophobicContact CD1-CG1 4.18Å; L60-I64 HydrophobicContact CD2-CD1 4.4Å; L60-I64 HydrophobicContact CG-CD1 3.78Å; L60-I64 HydrophobicContact CG-CG1 4.43Å; L60-I64 WeakPolarHBondContact O-CB 3.38Å; L60-I64 VanDerWaalsContact O-CG1 3.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.42Å; L60-I64 PolarHBondContact O-N 2.94Å; L60-L330 HydrophobicContact CD2-CD2 3.67Å; L60-L330 HydrophobicContact CD2-CG 4.25Å; L60-L334 HydrophobicContact CD2-CD1 3.97Å; L60-L334 HydrophobicContact CG-CD1 4.49Å
61	V	85.6	Confident	85.5	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-45.4	176.4	174.3	0	0	0	0	110.7	G57 N58 G59 I63 I64 A65 A82 P313 L334	G57-V61 WeakPolarHBondContact O-CG2 3.42Å; G57-V61 PolarHBondContact O-N 2.84Å; G57-V61 VanDerWaalsContact O-N 3.11Å; N58-V61 PolarHBondContact O-N 3.48Å; G59-V61 PolarHBondContact O-N 2.9Å; V61-I63 PolarHBondContact O-N 3.47Å; V61-I64 PolarHBondContact O-N 3.02Å; V61-A65 WeakPolarHBondContact O-CB 3.33Å; V61-A65 PolarHBondContact O-N 3.48Å; V61-A82 HydrophobicContact CB-CB 3.96Å; V61-A82 HydrophobicContact CG1-CB 3.65Å; V61-P313 HydrophobicContact CG2-CB 4.39Å; V61-P313 HydrophobicContact CG2-CG 4.35Å; V61-L334 HydrophobicContact CG2-CD2 3.93Å
62	I	89.6	Confident	85	Confident	38 Å²	38	59 Å²	59	20%	0.195	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-47.5	177.9	-67.7	164.9	0	0	0	110.9	N58 G59 L60 T66 L79 A82 V83 F86	N58-I62 VanDerWaalsContact O-CG1 3.29Å; N58-I62 WeakPolarHBondContact O-CG1 3.45Å; N58-I62 PolarHBondContact O-N 3.28Å; G59-I62 PolarHBondContact O-N 3.16Å; L60-I62 VanDerWaalsContact C-N 3.34Å; L60-I62 PolarHBondContact O-N 2.94Å; I62-T66 WeakPolarHBondContact O-CB 3.25Å; I62-T66 PolarHBondContact O-N 3.08Å; I62-T66 PolarHBondContact O-OG1 3.46Å; I62-L79 HydrophobicContact CB-CD1 4.37Å; I62-L79 HydrophobicContact CG1-CD1 4.25Å; I62-L79 HydrophobicContact CG2-CD1 4.21Å; I62-A82 HydrophobicContact CG1-CB 3.89Å; I62-V83 HydrophobicContact CD1-CG2 4.04Å; I62-V83 HydrophobicContact CG1-CG2 4.08Å; I62-F86 HydrophobicContact CD1-CB 3.73Å; I62-F86 HydrophobicContact CD1-CD1 4.34Å; I62-F86 HydrophobicContact CD1-CD2 4.42Å; I62-F86 HydrophobicContact CD1-CG 3.92Å
63	I	85.3	Confident	84.6	Confident	96 Å²	96	53.3 Å²	53.3	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-48	179.5	-68.8	166.7	0	0	0	110.5	G59 L60 V61 T66 F67	G59-I63 VanDerWaalsContact O-CG1 3.32Å; G59-I63 WeakPolarHBondContact O-CG1 3.31Å; G59-I63 PolarHBondContact O-N 2.98Å; L60-I63 PolarHBondContact O-N 3.3Å; V61-I63 PolarHBondContact O-N 3.47Å; I63-T66 PolarHBondContact O-N 3.34Å; I63-F67 HydrophobicContact CG2-CD2 4.19Å; I63-F67 WeakPolarHBondContact O-CD2 3.47Å; I63-F67 PolarHBondContact O-N 2.93Å
64	I	80.3	Confident	84.1	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-50.4	-179	-69.2	174.5	0	0	0	110.8	L60 V61 T66 K68 M69 F331 L334 V335 L338	L60-I64 HydrophobicContact CD1-CD1 3.85Å; L60-I64 HydrophobicContact CD1-CG1 4.18Å; L60-I64 HydrophobicContact CD2-CD1 4.4Å; L60-I64 HydrophobicContact CG-CD1 3.78Å; L60-I64 HydrophobicContact CG-CG1 4.43Å; L60-I64 WeakPolarHBondContact O-CB 3.38Å; L60-I64 VanDerWaalsContact O-CG1 3.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.42Å; L60-I64 PolarHBondContact O-N 2.94Å; V61-I64 PolarHBondContact O-N 3.02Å; I64-T66 PolarHBondContact O-N 3.01Å; I64-K68 WeakPolarHBondContact O-CA 3.44Å; I64-K68 PolarHBondContact O-N 3.47Å; I64-M69 HydrophobicContact CG2-CG 3.96Å; I64-M69 HydrophobicContact CG2-SD 3.97Å; I64-M69 WeakPolarHBondContact O-CG 3.33Å; I64-M69 PolarHBondContact O-N 2.96Å; I64-F331 HydrophobicContact CD1-CD2 3.93Å; I64-F331 HydrophobicContact CD1-CE2 3.9Å; I64-F331 HydrophobicContact CG1-CD2 4.28Å; I64-F331 HydrophobicContact CG1-CE2 3.77Å; I64-L334 HydrophobicContact CD1-CB 3.98Å; I64-L334 HydrophobicContact CD1-CD1 4.12Å; I64-V335 HydrophobicContact CG2-CG2 3.69Å; I64-L338 HydrophobicContact CG2-CD1 4.43Å
65	A	79.8	Confident	83.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-26.2	-177.8	0	0	0	0	0	113	V61 K71 L79	V61-A65 WeakPolarHBondContact O-CB 3.33Å; V61-A65 PolarHBondContact O-N 3.48Å; A65-K71 PolarHBondContact O-NZ 3.24Å; A65-L79 HydrophobicContact CB-CB 4.34Å; A65-L79 HydrophobicContact CB-CD1 4.2Å
66	T	81.3	Confident	83.5	Confident	56 Å²	56	47.9 Å²	47.9	34%	0.344	24%	0.238	S	C	.	.	H	α-helix	trans	-83.3	-47.5	179.1	-57.5	0	0	0	0	112.2	I62 I63 I64	I62-T66 WeakPolarHBondContact O-CB 3.25Å; I62-T66 PolarHBondContact O-N 3.08Å; I62-T66 PolarHBondContact O-OG1 3.46Å; I63-T66 PolarHBondContact O-N 3.34Å; I64-T66 PolarHBondContact O-N 3.01Å
67	F	77.6	Confident	83.4	Confident	164 Å²	164	43.7 Å²	43.7	72%	0.719	22%	0.215	S	C	*	.	H	α-helix	trans	-103.8	-23.6	-168	-64.4	-70.8	0	0	0	114.8	I63	I63-F67 HydrophobicContact CG2-CD2 4.19Å; I63-F67 WeakPolarHBondContact O-CD2 3.47Å; I63-F67 PolarHBondContact O-N 2.93Å
68	K	70.8	Confident	83.2	Confident	126 Å²	126	44 Å²	44	55%	0.548	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-0.9	-168.2	-65	-164	175.2	-173.4	0	114.7	I64 F331	I64-K68 WeakPolarHBondContact O-CA 3.44Å; I64-K68 PolarHBondContact O-N 3.47Å; K68-F331 HydrophobicContact CD-CE1 4.19Å; K68-F331 HydrophobicContact CD-CE2 3.67Å; K68-F331 HydrophobicContact CD-CZ 3.15Å; K68-F331 HydrophobicContact CG-CZ 4.49Å
69	M	72.2	Confident	83.1	Confident	22 Å²	22	45 Å²	45	11%	0.108	22%	0.217	C	C	.	.	S	Bend	trans	-123.1	142.8	-176.8	-62.7	-160.1	71.2	0	0	112.1	I64 T75 L338	I64-M69 HydrophobicContact CG2-CG 3.96Å; I64-M69 HydrophobicContact CG2-SD 3.97Å; I64-M69 WeakPolarHBondContact O-CG 3.33Å; I64-M69 PolarHBondContact O-N 2.96Å; M69-T75 HydrophobicContact CB-CG2 4.3Å; M69-T75 HydrophobicContact CE-CG2 3.85Å; M69-T75 HydrophobicContact SD-CG2 4.21Å; M69-L338 HydrophobicContact CE-CB 3.13Å; M69-L338 HydrophobicContact CE-CG 4.43Å; M69-L338 WeakPolarHBondContact CE-O 3.31Å; M69-L338 HydrophobicContact SD-CB 3.25Å; M69-L338 WeakPolarHBondContact SD-CB 3.14Å; M69-L338 HydrophobicContact SD-CD1 3.47Å; M69-L338 WeakPolarHBondContact SD-CD1 3.42Å; M69-L338 HydrophobicContact SD-CG 3.99Å
70	K	75.1	Confident	83.2	Confident	178 Å²	178	45.4 Å²	45.4	77%	0.774	22%	0.216	S	C	*	.			trans	-64.1	139	168.7	-65.8	-175	179.9	-177.9	0	109	T72 T75	K70-T72 PolarHBondContact O-N 2.96Å; K70-T72 VanDerWaalsContact O-N 3.08Å; K70-T75 PolarHBondContact O-OG1 3Å
71	K	78.6	Confident	83.4	Confident	90 Å²	90	43 Å²	43	39%	0.391	20%	0.204	S	C	.	.			trans	-68.8	107.1	176.6	-60.8	-61.2	-176.3	-175.5	0	109.5	A65	A65-K71 PolarHBondContact O-NZ 3.24Å
72	T	84.6	Confident	83.7	Confident	25 Å²	25	43.1 Å²	43.1	15%	0.153	21%	0.205	C	C	.	.			trans	-122.1	163.9	172.6	67.8	0	0	0	0	109.9	K70 N74 T75 V76 T342	K70-T72 PolarHBondContact O-N 2.96Å; K70-T72 VanDerWaalsContact O-N 3.08Å; T72-N74 VanDerWaalsContact C-N 3.3Å; T72-N74 PolarHBondContact O-N 3.17Å; T72-T75 PolarHBondContact N-OG1 3.43Å; T72-T75 PolarHBondContact O-N 3.41Å; T72-T75 VanDerWaalsContact O-N 3.15Å; T72-T75 PolarHBondContact O-OG1 3.27Å; T72-T75 VanDerWaalsContact OG1-CG2 3.31Å; T72-T75 WeakPolarHBondContact OG1-CG2 3.48Å; T72-T75 PolarHBondContact OG1-N 3.39Å; T72-T75 PolarHBondContact OG1-OG1 3.4Å; T72-V76 WeakPolarHBondContact O-CG2 3.46Å; T72-V76 PolarHBondContact O-N 2.88Å; T72-V76 VanDerWaalsContact O-N 3.1Å; T72-T342 HydrophobicContact CG2-CG2 4.5Å
73	V	86.4	Confident	84	Confident	12 Å²	12	43.8 Å²	43.8	7%	0.073	21%	0.211	C	C	.	.	H	α-helix	trans	-55.2	-44.6	178.1	169.5	0	0	0	0	111.8	T75 V76 W77 R151 S152 V153 A156	V73-T75 PolarHBondContact O-N 2.76Å; V73-V76 WeakPolarHBondContact O-CB 3.46Å; V73-V76 PolarHBondContact O-N 2.92Å; V73-W77 HydrophobicContact CG1-CZ2 3.87Å; V73-W77 VanDerWaalsContact O-CD1 3.3Å; V73-W77 PolarHBondContact O-N 2.93Å; V73-R151 HydrophobicContact CB-CG 4.33Å; V73-R151 HydrophobicContact CG1-CG 4.36Å; V73-R151 HydrophobicContact CG2-CG 3.86Å; V73-S152 WeakPolarHBondContact CG2-O 3.36Å; V73-V153 HydrophobicContact CG2-CG2 4.45Å; V73-A156 HydrophobicContact CB-CB 4.4Å; V73-A156 HydrophobicContact CG1-CB 4.05Å; V73-A156 HydrophobicContact CG2-CB 4.18Å
74	N	82.2	Confident	84.4	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-43	177.2	-61.8	-44.1	0	0	0	112.9	T72 V76 W77 F78 R137 R151 D341	T72-N74 VanDerWaalsContact C-N 3.3Å; T72-N74 PolarHBondContact O-N 3.17Å; N74-V76 PolarHBondContact O-N 3.26Å; N74-W77 PolarHBondContact O-N 3.42Å; N74-F78 HydrophobicContact CB-CD2 4.41Å; N74-F78 HydrophobicContact CB-CE2 4.25Å; N74-F78 WeakPolarHBondContact O-CD2 3.41Å; N74-F78 PolarHBondContact O-N 3.24Å; N74-R137 PolarHBondContact ND2-NH2 3.05Å; N74-R137 PolarHBondContact OD1-NH2 3.47Å; N74-R151 PolarHBondContact OD1-NH2 2.96Å; N74-D341 WeakPolarHBondContact ND2-CB 3.38Å; N74-D341 PolarHBondContact ND2-OD2 3.4Å
75	T	83.6	Confident	85.1	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-30.2	178.4	58.8	0	0	0	0	111.9	M69 K70 T72 V73 L79	M69-T75 HydrophobicContact CB-CG2 4.3Å; M69-T75 HydrophobicContact CE-CG2 3.85Å; M69-T75 HydrophobicContact SD-CG2 4.21Å; K70-T75 PolarHBondContact O-OG1 3Å; T72-T75 PolarHBondContact N-OG1 3.43Å; T72-T75 PolarHBondContact O-N 3.41Å; T72-T75 VanDerWaalsContact O-N 3.15Å; T72-T75 PolarHBondContact O-OG1 3.27Å; T72-T75 VanDerWaalsContact OG1-CG2 3.31Å; T72-T75 WeakPolarHBondContact OG1-CG2 3.48Å; T72-T75 PolarHBondContact OG1-N 3.39Å; T72-T75 PolarHBondContact OG1-OG1 3.4Å; V73-T75 PolarHBondContact O-N 2.76Å; T75-L79 WeakPolarHBondContact O-CB 3.22Å; T75-L79 PolarHBondContact O-N 2.95Å
76	V	89.4	Confident	85.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-44.4	175	174.4	0	0	0	0	111	T72 V73 N74 L79 N80 V153 A156 Y157	T72-V76 WeakPolarHBondContact O-CG2 3.46Å; T72-V76 PolarHBondContact O-N 2.88Å; T72-V76 VanDerWaalsContact O-N 3.1Å; V73-V76 WeakPolarHBondContact O-CB 3.46Å; V73-V76 PolarHBondContact O-N 2.92Å; N74-V76 PolarHBondContact O-N 3.26Å; V76-L79 PolarHBondContact O-N 3.29Å; V76-N80 PolarHBondContact O-N 3.29Å; V76-N80 PolarHBondContact O-ND2 3.46Å; V76-V153 HydrophobicContact CG2-CG1 4.02Å; V76-A156 HydrophobicContact CB-CB 4.2Å; V76-A156 HydrophobicContact CG1-CB 4.04Å; V76-Y157 HydrophobicContact CG1-CD1 3.93Å; V76-Y157 HydrophobicContact CG1-CE1 3.96Å; V76-Y157 HydrophobicContact CG1-CG 4.24Å; V76-Y157 HydrophobicContact CG2-CD2 4.27Å; V76-Y157 HydrophobicContact CG2-CE1 4.22Å; V76-Y157 HydrophobicContact CG2-CE2 3.76Å
77	W	88.2	Confident	86.5	Confident	10 Å²	10	42.9 Å²	42.9	4%	0.038	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-50.6	177	-56.4	141.6	0	0	0	112.1	V73 N74 L79 N80 L81 L129 V132 I133 A156 A159 C160	V73-W77 HydrophobicContact CG1-CZ2 3.87Å; V73-W77 VanDerWaalsContact O-CD1 3.3Å; V73-W77 PolarHBondContact O-N 2.93Å; N74-W77 PolarHBondContact O-N 3.42Å; W77-L79 PolarHBondContact O-N 2.93Å; W77-N80 PolarHBondContact O-N 3.23Å; W77-L81 PolarHBondContact O-N 3.03Å; W77-L129 HydrophobicContact CE3-CD2 4.07Å; W77-V132 HydrophobicContact CE3-CG1 4.46Å; W77-V132 HydrophobicContact CH2-CG1 3.48Å; W77-V132 VanDerWaalsContact CH2-CG1 3.48Å; W77-V132 HydrophobicContact CZ2-CG1 3.69Å; W77-V132 HydrophobicContact CZ3-CG1 3.9Å; W77-I133 HydrophobicContact CB-CD1 3.87Å; W77-I133 HydrophobicContact CB-CG1 3.67Å; W77-I133 HydrophobicContact CG-CG1 3.77Å; W77-A156 HydrophobicContact CH2-CB 3.81Å; W77-A156 HydrophobicContact CZ2-CB 3.84Å; W77-A156 HydrophobicContact CZ3-CB 4.24Å; W77-A156 WeakPolarHBondContact CZ3-O 3.21Å; W77-A159 HydrophobicContact CH2-CB 3.69Å; W77-A159 HydrophobicContact CZ3-CB 4.01Å; W77-C160 VanDerWaalsContact CE3-SG 3.53Å; W77-C160 WeakPolarHBondContact CZ3-SG 3.25Å
78	F	85.8	Confident	87.3	Confident	25 Å²	25	35.6 Å²	35.6	11%	0.11	17%	0.169	C	C	.	.	H	α-helix	trans	-67.8	-35.1	-179.6	-66.9	-54.6	0	0	0	112.7	N74 L81 A82 Y316 L338	N74-F78 HydrophobicContact CB-CD2 4.41Å; N74-F78 HydrophobicContact CB-CE2 4.25Å; N74-F78 WeakPolarHBondContact O-CD2 3.41Å; N74-F78 PolarHBondContact O-N 3.24Å; F78-L81 PolarHBondContact O-N 2.9Å; F78-A82 WeakPolarHBondContact O-CB 3.18Å; F78-A82 PolarHBondContact O-N 3.37Å; F78-Y316 HydrophobicContact CD1-CE1 4.02Å; F78-Y316 HydrophobicContact CD1-CE2 4.35Å; F78-Y316 AromaticContact CD1-CZ 3.61Å; F78-Y316 WeakPolarHBondContact CD1-OH 3.47Å; F78-Y316 AromaticContact CE1-CE1 3.56Å; F78-Y316 HydrophobicContact CE1-CE1 3.56Å; F78-Y316 AromaticContact CE1-CZ 3.61Å; F78-Y316 VanDerWaalsContact CE1-OH 3.22Å; F78-Y316 WeakPolarHBondContact CE1-OH 3.41Å; F78-Y316 HydrophobicContact CZ-CE1 4.22Å; F78-L338 HydrophobicContact CB-CD2 3.82Å; F78-L338 HydrophobicContact CD2-CD2 3.33Å; F78-L338 HydrophobicContact CE2-CD2 4.02Å; F78-L338 HydrophobicContact CG-CD2 3.71Å
79	L	89.9	Confident	88.5	Confident	21 Å²	21	29.6 Å²	29.6	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-47.6	173.8	177.1	63.4	0	0	0	111.1	I62 A65 T75 V76 W77 L81 A82 V83	I62-L79 HydrophobicContact CB-CD1 4.37Å; I62-L79 HydrophobicContact CG1-CD1 4.25Å; I62-L79 HydrophobicContact CG2-CD1 4.21Å; A65-L79 HydrophobicContact CB-CB 4.34Å; A65-L79 HydrophobicContact CB-CD1 4.2Å; T75-L79 WeakPolarHBondContact O-CB 3.22Å; T75-L79 PolarHBondContact O-N 2.95Å; V76-L79 PolarHBondContact O-N 3.29Å; W77-L79 PolarHBondContact O-N 2.93Å; L79-L81 VanDerWaalsContact C-N 3.33Å; L79-L81 PolarHBondContact O-N 3Å; L79-A82 PolarHBondContact O-N 3.08Å; L79-V83 HydrophobicContact CD1-CG2 4.23Å; L79-V83 HydrophobicContact CG-CG2 4.48Å; L79-V83 WeakPolarHBondContact O-CB 3.33Å; L79-V83 VanDerWaalsContact O-CG2 3.25Å; L79-V83 WeakPolarHBondContact O-CG2 3.34Å; L79-V83 PolarHBondContact O-N 3.48Å
80	N	93.4	Very high	89.6	Confident	22 Å²	22	31.9 Å²	31.9	12%	0.118	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-37.7	179.6	-81.9	-91.5	0	0	0	112.2	V76 W77 V83 A84 L129 C160 W164	V76-N80 PolarHBondContact O-N 3.29Å; V76-N80 PolarHBondContact O-ND2 3.46Å; W77-N80 PolarHBondContact O-N 3.23Å; N80-V83 PolarHBondContact O-N 3.49Å; N80-A84 PolarHBondContact O-N 3.35Å; N80-L129 HydrophobicContact CB-CD1 3.98Å; N80-L129 HydrophobicContact CB-CD2 4.11Å; N80-C160 PolarHBondContact ND2-SG 3.3Å; N80-W164 PolarHBondContact OD1-NE1 2.87Å
81	L	91.9	Very high	90.5	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-47.7	174.6	-172.7	65.2	0	0	0	110.8	W77 F78 L79 V83 A84 D85 L129	W77-L81 PolarHBondContact O-N 3.03Å; F78-L81 PolarHBondContact O-N 2.9Å; L79-L81 VanDerWaalsContact C-N 3.33Å; L79-L81 PolarHBondContact O-N 3Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.47Å; L81-A84 PolarHBondContact O-N 3.31Å; L81-D85 PolarHBondContact O-N 3.28Å; L81-L129 HydrophobicContact CB-CD1 3.96Å; L81-L129 HydrophobicContact CD1-CB 4.5Å; L81-L129 HydrophobicContact CD1-CD1 4.14Å
82	A	92.3	Very high	91.2	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.033	12%	0.117	C	C	.	.	H	α-helix	trans	-64.1	-36.1	177.3	0	0	0	0	0	112.6	N58 V61 I62 F78 L79 F86	N58-A82 HydrophobicContact CB-CB 4.34Å; V61-A82 HydrophobicContact CB-CB 3.96Å; V61-A82 HydrophobicContact CG1-CB 3.65Å; I62-A82 HydrophobicContact CG1-CB 3.89Å; F78-A82 WeakPolarHBondContact O-CB 3.18Å; F78-A82 PolarHBondContact O-N 3.37Å; L79-A82 PolarHBondContact O-N 3.08Å; A82-F86 WeakPolarHBondContact O-CB 3.21Å; A82-F86 PolarHBondContact O-N 2.89Å
83	V	94.8	Very high	91.8	Very high	52 Å²	52	23.7 Å²	23.7	32%	0.315	13%	0.126	S	C	.	.	H	α-helix	trans	-65.1	-44.2	175.6	168.7	0	0	0	0	111.3	I62 L79 N80 L81 F86 L87 W164	I62-V83 HydrophobicContact CD1-CG2 4.04Å; I62-V83 HydrophobicContact CG1-CG2 4.08Å; L79-V83 HydrophobicContact CD1-CG2 4.23Å; L79-V83 HydrophobicContact CG-CG2 4.48Å; L79-V83 WeakPolarHBondContact O-CB 3.33Å; L79-V83 VanDerWaalsContact O-CG2 3.25Å; L79-V83 WeakPolarHBondContact O-CG2 3.34Å; L79-V83 PolarHBondContact O-N 3.48Å; N80-V83 PolarHBondContact O-N 3.49Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.47Å; V83-F86 PolarHBondContact O-N 3.05Å; V83-L87 VanDerWaalsContact O-CB 3.3Å; V83-L87 WeakPolarHBondContact O-CB 3.43Å; V83-L87 PolarHBondContact O-N 3.32Å; V83-W164 HydrophobicContact CG1-CH2 4.08Å; V83-W164 HydrophobicContact CG1-CZ2 3.95Å
84	A	95.2	Very high	92.1	Very high	3 Å²	3	24.4 Å²	24.4	3%	0.025	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-50	177	0	0	0	0	0	111.5	N80 L81 F86 L87 F88 N122 T125 W164	N80-A84 PolarHBondContact O-N 3.35Å; L81-A84 PolarHBondContact O-N 3.31Å; A84-F86 PolarHBondContact O-N 3.18Å; A84-L87 PolarHBondContact O-N 3.1Å; A84-F88 PolarHBondContact O-N 2.69Å; A84-N122 WeakPolarHBondContact CB-OD1 3.46Å; A84-N122 PolarHBondContact O-OD1 2.84Å; A84-T125 HydrophobicContact CB-CG2 3.7Å; A84-W164 HydrophobicContact CB-CH2 4.19Å; A84-W164 HydrophobicContact CB-CZ2 4.25Å
85	D	94.9	Very high	92.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-39.2	179.5	-75.7	-38.5	0	0	0	112.1	N58 L81 N89 N122 S309 N312	N58-D85 WeakPolarHBondContact ND2-CB 3.18Å; L81-D85 PolarHBondContact O-N 3.28Å; D85-N89 WeakPolarHBondContact O-CB 3.15Å; D85-N89 PolarHBondContact O-N 2.82Å; D85-N89 PolarHBondContact O-ND2 3.22Å; D85-N122 PolarHBondContact N-OD1 3.49Å; D85-N122 PolarHBondContact OD1-ND2 2.94Å; D85-N122 PolarHBondContact OD1-OD1 3.16Å; D85-S309 VanDerWaalsContact OD1-CA 3.3Å; D85-S309 WeakPolarHBondContact OD1-CA 3.48Å; D85-S309 VanDerWaalsContact OD1-CB 3.24Å; D85-S309 WeakPolarHBondContact OD1-CB 3.29Å; D85-N312 PolarHBondContact OD2-ND2 3.5Å
86	F	95	Very high	93	Very high	68 Å²	68	26.8 Å²	26.8	30%	0.298	14%	0.141	S	C	.	.	H	α-helix	trans	-64.5	-47.4	176.6	-177.8	-94.4	0	0	0	111.3	I55 N58 I62 A82 V83 A84 F88 N89 V90	I55-F86 HydrophobicContact CG2-CE2 4Å; N58-F86 HydrophobicContact CB-CB 4.01Å; I62-F86 HydrophobicContact CD1-CB 3.73Å; I62-F86 HydrophobicContact CD1-CD1 4.34Å; I62-F86 HydrophobicContact CD1-CD2 4.42Å; I62-F86 HydrophobicContact CD1-CG 3.92Å; A82-F86 WeakPolarHBondContact O-CB 3.21Å; A82-F86 PolarHBondContact O-N 2.89Å; V83-F86 PolarHBondContact O-N 3.05Å; A84-F86 PolarHBondContact O-N 3.18Å; F86-F88 VanDerWaalsContact C-N 3.31Å; F86-F88 PolarHBondContact O-N 3.08Å; F86-N89 PolarHBondContact O-N 3.17Å; F86-V90 HydrophobicContact CD1-CG2 4.05Å; F86-V90 HydrophobicContact CE1-CG2 3.66Å; F86-V90 HydrophobicContact CE2-CG2 4.45Å; F86-V90 HydrophobicContact CZ-CG2 3.88Å; F86-V90 WeakPolarHBondContact O-CG2 3.12Å; F86-V90 PolarHBondContact O-N 3.15Å
87	L	94.6	Very high	93.2	Very high	64 Å²	64	29 Å²	29	34%	0.335	15%	0.154	S	C	.	.	H	α-helix	trans	-57.6	-45.9	177.9	-179.9	64.3	0	0	0	110.7	V83 A84 V90 F91 L118	V83-L87 VanDerWaalsContact O-CB 3.3Å; V83-L87 WeakPolarHBondContact O-CB 3.43Å; V83-L87 PolarHBondContact O-N 3.32Å; A84-L87 PolarHBondContact O-N 3.1Å; L87-V90 PolarHBondContact O-N 3.33Å; L87-F91 HydrophobicContact CD1-CE2 4.03Å; L87-F91 WeakPolarHBondContact O-CD2 3.37Å; L87-L118 HydrophobicContact CD2-CD2 4.15Å; L87-L118 HydrophobicContact CG-CD2 4.27Å
88	F	95.3	Very high	93.4	Very high	10 Å²	10	29.8 Å²	29.8	4%	0.044	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-46.3	176.1	170	-108.8	0	0	0	112.6	A84 F86 V90 F91 L92 L118 L119 N122 I306	A84-F88 PolarHBondContact O-N 2.69Å; F86-F88 VanDerWaalsContact C-N 3.31Å; F86-F88 PolarHBondContact O-N 3.08Å; F88-V90 VanDerWaalsContact C-N 3.3Å; F88-V90 PolarHBondContact O-N 3.28Å; F88-F91 PolarHBondContact O-N 3.39Å; F88-F91 VanDerWaalsContact O-N 3.08Å; F88-L92 HydrophobicContact CE1-CD1 4.43Å; F88-L92 HydrophobicContact CZ-CD1 3.96Å; F88-L92 PolarHBondContact O-N 3Å; F88-L92 VanDerWaalsContact O-N 3.11Å; F88-L118 HydrophobicContact CD2-CB 4.48Å; F88-L119 HydrophobicContact CD2-CB 4.49Å; F88-L119 HydrophobicContact CE2-CB 3.92Å; F88-L119 HydrophobicContact CE2-CD1 3.63Å; F88-L119 HydrophobicContact CE2-CG 4.41Å; F88-L119 HydrophobicContact CZ-CD1 3.62Å; F88-N122 HydrophobicContact CB-CB 3.82Å; F88-N122 HydrophobicContact CD2-CB 4.48Å; F88-N122 HydrophobicContact CG-CB 4.07Å; F88-I306 HydrophobicContact CE1-CB 4.41Å; F88-I306 HydrophobicContact CE1-CG1 4.21Å; F88-I306 HydrophobicContact CE1-CG2 3.97Å; F88-I306 HydrophobicContact CZ-CB 4.37Å; F88-I306 HydrophobicContact CZ-CD1 4Å; F88-I306 HydrophobicContact CZ-CG1 3.72Å; F88-I306 HydrophobicContact CZ-CG2 4.11Å
89	N	95.2	Very high	93.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-30.2	-178.8	-81.5	-61.6	0	0	0	113.5	I55 D85 F86 F91 L92 P93 S309	I55-N89 HydrophobicContact CG1-CB 4.04Å; D85-N89 WeakPolarHBondContact O-CB 3.15Å; D85-N89 PolarHBondContact O-N 2.82Å; D85-N89 PolarHBondContact O-ND2 3.22Å; F86-N89 PolarHBondContact O-N 3.17Å; N89-F91 PolarHBondContact O-N 2.77Å; N89-L92 WeakPolarHBondContact O-CB 3.37Å; N89-L92 PolarHBondContact O-N 3.22Å; N89-P93 WeakPolarHBondContact O-CD 3.48Å; N89-S309 PolarHBondContact ND2-OG 3.45Å; N89-S309 VanDerWaalsContact ND2-OG 3.07Å; N89-S309 PolarHBondContact OD1-OG 3.31Å
90	V	95.2	Very high	93.7	Very high	70 Å²	70	30.4 Å²	30.4	42%	0.424	17%	0.17	S	C	.	.	H	α-helix	trans	-62.8	-31.4	174	167.4	0	0	0	0	112.1	F86 L87 F88 P93	F86-V90 HydrophobicContact CD1-CG2 4.05Å; F86-V90 HydrophobicContact CE1-CG2 3.66Å; F86-V90 HydrophobicContact CE2-CG2 4.45Å; F86-V90 HydrophobicContact CZ-CG2 3.88Å; F86-V90 WeakPolarHBondContact O-CG2 3.12Å; F86-V90 PolarHBondContact O-N 3.15Å; L87-V90 PolarHBondContact O-N 3.33Å; F88-V90 VanDerWaalsContact C-N 3.3Å; F88-V90 PolarHBondContact O-N 3.28Å; V90-P93 WeakPolarHBondContact O-CD 3.34Å
91	F	94	Very high	93.6	Very high	65 Å²	65	33.7 Å²	33.7	29%	0.285	19%	0.186	S	C	.	.	H	α-helix	trans	-94.6	-7.8	177.8	-72.8	-97.7	0	0	0	113.5	L87 F88 N89 P93 I94 L118	L87-F91 HydrophobicContact CD1-CE2 4.03Å; L87-F91 WeakPolarHBondContact O-CD2 3.37Å; F88-F91 PolarHBondContact O-N 3.39Å; F88-F91 VanDerWaalsContact O-N 3.08Å; N89-F91 PolarHBondContact O-N 2.77Å; F91-P93 VanDerWaalsContact C-N 3.33Å; F91-I94 HydrophobicContact CD1-CD1 4.01Å; F91-I94 WeakPolarHBondContact O-CB 3.29Å; F91-I94 PolarHBondContact O-N 3.04Å; F91-L118 HydrophobicContact CB-CD1 3.7Å; F91-L118 HydrophobicContact CD1-CD1 3.76Å; F91-L118 HydrophobicContact CD2-CD1 3.46Å; F91-L118 VanDerWaalsContact CD2-CD1 3.46Å; F91-L118 HydrophobicContact CE1-CD1 4.22Å; F91-L118 HydrophobicContact CE2-CD1 3.95Å; F91-L118 HydrophobicContact CG-CD1 3.35Å; F91-L118 HydrophobicContact CZ-CD1 4.31Å
92	L	94.1	Very high	93.4	Very high	2 Å²	2	37 Å²	37	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-58.2	-32.2	177.2	-171.3	59.3	0	0	0	114.4	V50 C51 F88 N89 I94 H95 I96 I306	V50-L92 HydrophobicContact CB-CD2 4.38Å; V50-L92 HydrophobicContact CG1-CD2 4Å; C51-L92 HydrophobicContact CB-CB 4.49Å; C51-L92 HydrophobicContact CB-CD2 3.83Å; C51-L92 HydrophobicContact CB-CG 4.3Å; F88-L92 HydrophobicContact CE1-CD1 4.43Å; F88-L92 HydrophobicContact CZ-CD1 3.96Å; F88-L92 PolarHBondContact O-N 3Å; F88-L92 VanDerWaalsContact O-N 3.11Å; N89-L92 WeakPolarHBondContact O-CB 3.37Å; N89-L92 PolarHBondContact O-N 3.22Å; L92-I94 PolarHBondContact O-N 2.9Å; L92-I94 VanDerWaalsContact O-N 3.16Å; L92-H95 HydrophobicContact CD1-CB 4.1Å; L92-H95 WeakPolarHBondContact O-CA 3.31Å; L92-H95 WeakPolarHBondContact O-CB 3.49Å; L92-H95 PolarHBondContact O-N 2.97Å; L92-I96 PolarHBondContact O-N 3.39Å; L92-I306 HydrophobicContact CD1-CD1 4.04Å; L92-I306 HydrophobicContact CD1-CG2 3.77Å; L92-I306 HydrophobicContact CD2-CG2 3.82Å
93	P	95.6	Very high	93.1	Very high	54 Å²	54	39.7 Å²	39.7	35%	0.351	21%	0.213	S	C	.	.	H	α-helix	trans	-53.3	-33.6	173.5	-29.5	37.1	0	0	0	114.6	N89 V90 F91 H95 I96 T97	N89-P93 WeakPolarHBondContact O-CD 3.48Å; V90-P93 WeakPolarHBondContact O-CD 3.34Å; F91-P93 VanDerWaalsContact C-N 3.33Å; P93-H95 VanDerWaalsContact C-N 3.3Å; P93-H95 PolarHBondContact O-N 3.44Å; P93-I96 WeakPolarHBondContact O-CB 3.18Å; P93-I96 PolarHBondContact O-N 2.84Å; P93-T97 PolarHBondContact O-N 2.97Å; P93-T97 PolarHBondContact O-OG1 3.34Å; P93-T97 VanDerWaalsContact O-OG1 3.13Å
94	I	93.6	Very high	92.9	Very high	28 Å²	28	39.9 Å²	39.9	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-42.3	176	-60.8	177.6	0	0	0	110.2	F91 L92 T97 Y98 W105 F107 M111	F91-I94 HydrophobicContact CD1-CD1 4.01Å; F91-I94 WeakPolarHBondContact O-CB 3.29Å; F91-I94 PolarHBondContact O-N 3.04Å; L92-I94 PolarHBondContact O-N 2.9Å; L92-I94 VanDerWaalsContact O-N 3.16Å; I94-T97 PolarHBondContact O-N 3.28Å; I94-Y98 PolarHBondContact O-N 3.47Å; I94-W105 HydrophobicContact CG2-CH2 3.44Å; I94-W105 VanDerWaalsContact CG2-CH2 3.44Å; I94-W105 HydrophobicContact CG2-CZ2 4.06Å; I94-W105 HydrophobicContact CG2-CZ3 4.09Å; I94-F107 HydrophobicContact CB-CE2 4.4Å; I94-F107 HydrophobicContact CG2-CD1 4.49Å; I94-F107 HydrophobicContact CG2-CD2 3.5Å; I94-F107 HydrophobicContact CG2-CE2 3.68Å; I94-F107 HydrophobicContact CG2-CG 3.93Å; I94-F107 HydrophobicContact CG2-CZ 4.25Å; I94-M111 HydrophobicContact CD1-SD 4.28Å
95	H	91.1	Very high	92.7	Very high	35 Å²	35	40 Å²	40	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-69.8	-35.8	176.8	-165.7	74.4	0	0	0	112.1	Y47 L92 P93 Y98 A99	Y47-H95 AromaticContact CE2-CD2 3.62Å; Y47-H95 AromaticContact CE2-NE2 3.68Å; Y47-H95 AromaticContact CZ-CD2 3.66Å; Y47-H95 AromaticContact CZ-NE2 3.51Å; Y47-H95 PolarHBondContact OH-NE2 2.73Å; L92-H95 HydrophobicContact CD1-CB 4.1Å; L92-H95 WeakPolarHBondContact O-CA 3.31Å; L92-H95 WeakPolarHBondContact O-CB 3.49Å; L92-H95 PolarHBondContact O-N 2.97Å; P93-H95 VanDerWaalsContact C-N 3.3Å; P93-H95 PolarHBondContact O-N 3.44Å; H95-Y98 WeakPolarHBondContact O-CB 3.3Å; H95-Y98 PolarHBondContact O-N 2.89Å; H95-A99 PolarHBondContact O-N 3.48Å
96	I	94	Very high	92.7	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.128	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-48.4	173.6	-63.4	170.9	0	0	0	110.2	V44 C51 L92 P93 Y98 A99 A100	V44-I96 HydrophobicContact CG1-CG2 4.22Å; C51-I96 HydrophobicContact CB-CD1 3.9Å; L92-I96 PolarHBondContact O-N 3.39Å; P93-I96 WeakPolarHBondContact O-CB 3.18Å; P93-I96 PolarHBondContact O-N 2.84Å; I96-Y98 VanDerWaalsContact C-N 3.31Å; I96-Y98 PolarHBondContact O-N 2.82Å; I96-A99 PolarHBondContact O-N 2.74Å; I96-A100 WeakPolarHBondContact O-CB 3.36Å; I96-A100 PolarHBondContact O-N 2.77Å
97	T	94.2	Very high	92.6	Very high	47 Å²	47	43.7 Å²	43.7	29%	0.288	23%	0.232	S	C	.	.	H	α-helix	trans	-61.1	-42.2	177.3	-57.4	0	0	0	0	111.1	P93 I94 A99 A100 M101 F107	P93-T97 PolarHBondContact O-N 2.97Å; P93-T97 PolarHBondContact O-OG1 3.34Å; P93-T97 VanDerWaalsContact O-OG1 3.13Å; I94-T97 PolarHBondContact O-N 3.28Å; T97-A99 PolarHBondContact O-N 2.75Å; T97-A100 PolarHBondContact O-N 3.28Å; T97-M101 HydrophobicContact CG2-CE 3.73Å; T97-M101 HydrophobicContact CG2-CG 4.13Å; T97-M101 HydrophobicContact CG2-SD 3.77Å; T97-M101 WeakPolarHBondContact O-CB 3.18Å; T97-M101 WeakPolarHBondContact O-CG 3.18Å; T97-M101 PolarHBondContact O-N 2.74Å; T97-F107 HydrophobicContact CG2-CE2 3.97Å; T97-F107 HydrophobicContact CG2-CZ 3.75Å
98	Y	91.1	Very high	92.5	Very high	28 Å²	28	42.5 Å²	42.5	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-56.5	-50.5	174	176.5	-120.7	0	0	0	111.7	I94 H95 I96 A100 M101 Y103 W105	I94-Y98 PolarHBondContact O-N 3.47Å; H95-Y98 WeakPolarHBondContact O-CB 3.3Å; H95-Y98 PolarHBondContact O-N 2.89Å; I96-Y98 VanDerWaalsContact C-N 3.31Å; I96-Y98 PolarHBondContact O-N 2.82Å; Y98-A100 VanDerWaalsContact C-N 3.34Å; Y98-A100 PolarHBondContact O-N 3.27Å; Y98-M101 PolarHBondContact O-N 3.36Å; Y98-Y103 AromaticContact CD1-CD1 3.92Å; Y98-Y103 HydrophobicContact CD1-CD1 3.92Å; Y98-Y103 AromaticContact CE1-CD1 3.56Å; Y98-Y103 HydrophobicContact CE1-CD1 3.56Å; Y98-Y103 HydrophobicContact CE1-CE1 4.49Å; Y98-Y103 HydrophobicContact CE1-CG 4.34Å; Y98-Y103 VanDerWaalsContact CE2-CA 3.44Å; Y98-Y103 WeakPolarHBondContact CE2-O 3.44Å; Y98-Y103 AromaticContact CZ-CD1 3.98Å; Y98-Y103 WeakPolarHBondContact O-CA 3.47Å; Y98-Y103 PolarHBondContact O-N 3.05Å; Y98-W105 HydrophobicContact CD1-CE3 4.44Å; Y98-W105 HydrophobicContact CD2-CB 4.03Å; Y98-W105 HydrophobicContact CD2-CD2 4.46Å; Y98-W105 AromaticContact CD2-CE3 3.63Å; Y98-W105 HydrophobicContact CD2-CE3 3.63Å; Y98-W105 HydrophobicContact CD2-CZ3 4.49Å; Y98-W105 HydrophobicContact CE2-CB 3.93Å; Y98-W105 HydrophobicContact CE2-CE3 4.12Å; Y98-W105 AromaticContact CG-CE3 3.8Å; Y98-W105 HydrophobicContact CG-CE3 3.8Å; Y98-W105 HydrophobicContact CG-CZ3 4.22Å
99	A	90.1	Very high	92.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-36.7	177.1	0	0	0	0	0	112.8	R40 V44 Y47 H95 I96 T97 D102 Y103	R40-A99 WeakPolarHBondContact CD-O 3.38Å; R40-A99 WeakPolarHBondContact CG-O 3.33Å; V44-A99 HydrophobicContact CG2-CB 3.91Å; Y47-A99 HydrophobicContact CD2-CB 4.39Å; Y47-A99 HydrophobicContact CE2-CB 4.33Å; H95-A99 PolarHBondContact O-N 3.48Å; I96-A99 PolarHBondContact O-N 2.74Å; T97-A99 PolarHBondContact O-N 2.75Å; A99-D102 PolarHBondContact O-N 2.88Å; A99-Y103 HydrophobicContact CB-CE1 4.34Å
100	A	92.7	Very high	92.4	Very high	59 Å²	59	47.7 Å²	47.7	49%	0.488	27%	0.274	S	S	.	.	H	α-helix	trans	-71.5	-35.6	179.8	0	0	0	0	0	113	V44 I96 T97 Y98 D102	V44-A100 HydrophobicContact CG2-CB 4.06Å; I96-A100 WeakPolarHBondContact O-CB 3.36Å; I96-A100 PolarHBondContact O-N 2.77Å; T97-A100 PolarHBondContact O-N 3.28Å; Y98-A100 VanDerWaalsContact C-N 3.34Å; Y98-A100 PolarHBondContact O-N 3.27Å; A100-D102 PolarHBondContact O-N 3.36Å
101	M	90.7	Very high	92.3	Very high	91 Å²	91	47.6 Å²	47.6	45%	0.448	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	32.1	174.9	-66.3	-175.4	169.3	0	0	112.2	T97 Y98 Y103 H104 V106	T97-M101 HydrophobicContact CG2-CE 3.73Å; T97-M101 HydrophobicContact CG2-CG 4.13Å; T97-M101 HydrophobicContact CG2-SD 3.77Å; T97-M101 WeakPolarHBondContact O-CB 3.18Å; T97-M101 WeakPolarHBondContact O-CG 3.18Å; T97-M101 PolarHBondContact O-N 2.74Å; Y98-M101 PolarHBondContact O-N 3.36Å; M101-Y103 PolarHBondContact O-N 3.44Å; M101-H104 HydrophobicContact CB-CB 4.18Å; M101-H104 WeakPolarHBondContact O-CB 3.22Å; M101-H104 PolarHBondContact O-N 2.85Å; M101-V106 HydrophobicContact SD-CG1 3.85Å; M101-V106 HydrophobicContact SD-CG2 3.98Å
102	D	87.5	Confident	92.3	Very high	71 Å²	71	44.5 Å²	44.5	38%	0.38	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	26.2	-178.7	-168.9	46.4	0	0	0	113.9	R40 A99 A100 K186	R40-D102 IonicContact CZ-OD1 3.62Å; R40-D102 IonicContact NH1-OD1 2.65Å; R40-D102 PolarHBondContact NH1-OD1 3.17Å; A99-D102 PolarHBondContact O-N 2.88Å; A100-D102 PolarHBondContact O-N 3.36Å; D102-K186 WeakPolarHBondContact O-CE 3.43Å; D102-K186 PolarHBondContact O-NZ 3.25Å; D102-K186 IonicContact OD2-NZ 3.89Å; D102-K186 PolarHBondContact OD2-NZ 3.2Å
103	Y	87.2	Confident	92.4	Very high	61 Å²	61	47.3 Å²	47.3	24%	0.239	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	34	-169.8	-47.5	-79	0	0	0	113.9	L43 Y98 A99 M101 K186	L43-Y103 WeakPolarHBondContact CD1-OH 2.91Å; Y98-Y103 AromaticContact CD1-CD1 3.92Å; Y98-Y103 HydrophobicContact CD1-CD1 3.92Å; Y98-Y103 AromaticContact CE1-CD1 3.56Å; Y98-Y103 HydrophobicContact CE1-CD1 3.56Å; Y98-Y103 HydrophobicContact CE1-CE1 4.49Å; Y98-Y103 HydrophobicContact CE1-CG 4.34Å; Y98-Y103 VanDerWaalsContact CE2-CA 3.44Å; Y98-Y103 WeakPolarHBondContact CE2-O 3.44Å; Y98-Y103 AromaticContact CZ-CD1 3.98Å; Y98-Y103 WeakPolarHBondContact O-CA 3.47Å; Y98-Y103 PolarHBondContact O-N 3.05Å; A99-Y103 HydrophobicContact CB-CE1 4.34Å; M101-Y103 PolarHBondContact O-N 3.44Å; Y103-K186 VanDerWaalsContact O-CE 3.27Å; Y103-K186 WeakPolarHBondContact O-CE 3.36Å
104	H	89.6	Confident	92.4	Very high	56 Å²	56	47.6 Å²	47.6	26%	0.259	27%	0.267	S	S	.	.			trans	-93.6	119.7	165.8	-175.5	74.6	0	0	0	110.5	M101 V106 K186 I187	M101-H104 HydrophobicContact CB-CB 4.18Å; M101-H104 WeakPolarHBondContact O-CB 3.22Å; M101-H104 PolarHBondContact O-N 2.85Å; H104-V106 WeakPolarHBondContact CD2-CG1 3.28Å; H104-K186 HydrophobicContact CB-CD 4.47Å; H104-K186 HydrophobicContact CB-CG 3.95Å; H104-K186 WeakPolarHBondContact ND1-CA 3.49Å; H104-K186 WeakPolarHBondContact ND1-CG 3.38Å; H104-I187 PolarHBondContact CE1-N 2.93Å; H104-I187 PolarHBondContact ND1-N 2.95Å; H104-I187 VanDerWaalsContact ND1-N 3.18Å
105	W	91.8	Very high	92.3	Very high	5 Å²	5	47 Å²	47	2%	0.019	27%	0.265	C	S	.	.			trans	-92	107.3	-175.4	-173.8	-88.8	0	0	0	112.5	I94 Y98 F107 G108 M111 C112 T180 I187 C189	I94-W105 HydrophobicContact CG2-CH2 3.44Å; I94-W105 VanDerWaalsContact CG2-CH2 3.44Å; I94-W105 HydrophobicContact CG2-CZ2 4.06Å; I94-W105 HydrophobicContact CG2-CZ3 4.09Å; Y98-W105 HydrophobicContact CD1-CE3 4.44Å; Y98-W105 HydrophobicContact CD2-CB 4.03Å; Y98-W105 HydrophobicContact CD2-CD2 4.46Å; Y98-W105 AromaticContact CD2-CE3 3.63Å; Y98-W105 HydrophobicContact CD2-CE3 3.63Å; Y98-W105 HydrophobicContact CD2-CZ3 4.49Å; Y98-W105 HydrophobicContact CE2-CB 3.93Å; Y98-W105 HydrophobicContact CE2-CE3 4.12Å; Y98-W105 AromaticContact CG-CE3 3.8Å; Y98-W105 HydrophobicContact CG-CE3 3.8Å; Y98-W105 HydrophobicContact CG-CZ3 4.22Å; W105-F107 HydrophobicContact CH2-CD2 4.36Å; W105-F107 HydrophobicContact CZ2-CB 3.81Å; W105-F107 HydrophobicContact CZ2-CD2 4.16Å; W105-F107 HydrophobicContact CZ2-CG 4.43Å; W105-G108 PolarHBondContact NE1-O 3.43Å; W105-M111 HydrophobicContact CZ2-CB 3.76Å; W105-C112 HydrophobicContact CD2-CB 4.29Å; W105-C112 HydrophobicContact CZ2-CB 3.91Å; W105-T180 HydrophobicContact CG-CG2 4.45Å; W105-I187 HydrophobicContact CB-CG2 4.25Å; W105-I187 PolarHBondContact N-O 3.13Å; W105-I187 WeakPolarHBondContact O-CB 3.46Å; W105-I187 WeakPolarHBondContact O-CG2 3.31Å; W105-C189 HydrophobicContact CB-CB 4.31Å; W105-C189 HydrophobicContact CD2-CB 3.9Å; W105-C189 HydrophobicContact CE3-CB 3.95Å; W105-C189 HydrophobicContact CG-CB 4.02Å
106	V	94	Very high	92.4	Very high	70 Å²	70	46 Å²	46	42%	0.424	26%	0.261	S	S	.	.			trans	-100.5	-10.4	-175.6	-60.9	0	0	0	0	115.1	M101 H104 G108	M101-V106 HydrophobicContact SD-CG1 3.85Å; M101-V106 HydrophobicContact SD-CG2 3.98Å; H104-V106 WeakPolarHBondContact CD2-CG1 3.28Å; V106-G108 VanDerWaalsContact C-N 3.28Å; V106-G108 PolarHBondContact O-N 2.88Å
107	F	93.3	Very high	92.5	Very high	77 Å²	77	46 Å²	46	34%	0.338	26%	0.26	S	S	.	.	S	Bend	trans	-87.5	8.3	-169.2	-57.4	-81.1	0	0	0	114.4	I94 T97 W105 M111	I94-F107 HydrophobicContact CB-CE2 4.4Å; I94-F107 HydrophobicContact CG2-CD1 4.49Å; I94-F107 HydrophobicContact CG2-CD2 3.5Å; I94-F107 HydrophobicContact CG2-CE2 3.68Å; I94-F107 HydrophobicContact CG2-CG 3.93Å; I94-F107 HydrophobicContact CG2-CZ 4.25Å; T97-F107 HydrophobicContact CG2-CE2 3.97Å; T97-F107 HydrophobicContact CG2-CZ 3.75Å; W105-F107 HydrophobicContact CH2-CD2 4.36Å; W105-F107 HydrophobicContact CZ2-CB 3.81Å; W105-F107 HydrophobicContact CZ2-CD2 4.16Å; W105-F107 HydrophobicContact CZ2-CG 4.43Å; F107-M111 HydrophobicContact CB-CB 3.62Å; F107-M111 HydrophobicContact CB-CG 4.06Å; F107-M111 WeakPolarHBondContact O-CB 3.28Å
108	G	93.1	Very high	92.6	Very high	38 Å²	38	44.5 Å²	44.5	39%	0.392	25%	0.25	S	S	.	.	H	α-helix	trans	72.7	170.3	-177.6	0	0	0	0	0	114.4	W105 V106 A110 M111 C112	W105-G108 PolarHBondContact NE1-O 3.43Å; V106-G108 VanDerWaalsContact C-N 3.28Å; V106-G108 PolarHBondContact O-N 2.88Å; G108-A110 PolarHBondContact O-N 3.24Å; G108-M111 PolarHBondContact O-N 3.44Å; G108-C112 PolarHBondContact O-N 3.48Å
109	T	92.3	Very high	92.7	Very high	55 Å²	55	43.9 Å²	43.9	34%	0.337	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-36.2	-171.8	-43.5	0	0	0	0	113.1	M111 C112 K113 D179 T180	T109-M111 PolarHBondContact O-N 3.49Å; T109-C112 WeakPolarHBondContact O-CB 3.2Å; T109-C112 PolarHBondContact O-N 2.69Å; T109-K113 HydrophobicContact CG2-CD 4.49Å; T109-K113 WeakPolarHBondContact O-CG 3.22Å; T109-K113 PolarHBondContact O-N 3.25Å; T109-K113 VanDerWaalsContact O-N 3.12Å; T109-D179 WeakPolarHBondContact CG2-OD1 3.25Å; T109-T180 PolarHBondContact OG1-OG1 2.97Å
110	A	94.8	Very high	92.9	Very high	64 Å²	64	44 Å²	44	53%	0.529	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-45.5	178.7	0	0	0	0	0	112.1	G108 C112 K113 I114	G108-A110 PolarHBondContact O-N 3.24Å; A110-C112 VanDerWaalsContact C-N 3.35Å; A110-C112 PolarHBondContact O-N 3.45Å; A110-K113 WeakPolarHBondContact O-CB 3.3Å; A110-K113 PolarHBondContact O-N 3.03Å; A110-I114 VanDerWaalsContact O-CG1 3.28Å; A110-I114 WeakPolarHBondContact O-CG1 3.31Å; A110-I114 PolarHBondContact O-N 3.27Å
111	M	94.2	Very high	93.1	Very high	69 Å²	69	41.8 Å²	41.8	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-71.7	-29.6	178.8	-70.4	-63.9	164.1	0	0	112.4	I94 W105 F107 G108 T109 K113 I114 S115	I94-M111 HydrophobicContact CD1-SD 4.28Å; W105-M111 HydrophobicContact CZ2-CB 3.76Å; F107-M111 HydrophobicContact CB-CB 3.62Å; F107-M111 HydrophobicContact CB-CG 4.06Å; F107-M111 WeakPolarHBondContact O-CB 3.28Å; G108-M111 PolarHBondContact O-N 3.44Å; T109-M111 PolarHBondContact O-N 3.49Å; M111-K113 VanDerWaalsContact C-N 3.3Å; M111-K113 PolarHBondContact O-N 2.68Å; M111-I114 HydrophobicContact CE-CD1 4.43Å; M111-I114 PolarHBondContact O-N 2.93Å; M111-I114 HydrophobicContact SD-CD1 4.28Å; M111-S115 WeakPolarHBondContact O-CB 3.38Å; M111-S115 PolarHBondContact O-N 2.93Å
112	C	94	Very high	93.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-43.9	174	164.9	0	0	0	0	110.4	W105 G108 T109 A110 N116 T180 C189	W105-C112 HydrophobicContact CD2-CB 4.29Å; W105-C112 HydrophobicContact CZ2-CB 3.91Å; G108-C112 PolarHBondContact O-N 3.48Å; T109-C112 WeakPolarHBondContact O-CB 3.2Å; T109-C112 PolarHBondContact O-N 2.69Å; A110-C112 VanDerWaalsContact C-N 3.35Å; A110-C112 PolarHBondContact O-N 3.45Å; C112-N116 PolarHBondContact O-N 2.89Å; C112-T180 HydrophobicContact CB-CG2 3.87Å; C112-C189 VanDerWaalsContact CA-SG 3.59Å; C112-C189 HydrophobicContact CB-CB 3.87Å; C112-C189 WeakPolarHBondContact CB-SG 3.48Å; C112-C189 WeakPolarHBondContact SG-CB 3.48Å; C112-C189 CovalentContact SG-SG 2.03Å; C112-C189 PolarHBondContact SG-SG 3.35Å
113	K	95.2	Very high	93.7	Very high	60 Å²	60	34.3 Å²	34.3	26%	0.261	19%	0.191	S	C	.	.	H	α-helix	trans	-64.5	-52.6	174.5	-70.9	174.9	167.5	-150.6	0	112.1	T109 A110 M111 F117 L175 R178	T109-K113 HydrophobicContact CG2-CD 4.49Å; T109-K113 WeakPolarHBondContact O-CG 3.22Å; T109-K113 PolarHBondContact O-N 3.25Å; T109-K113 VanDerWaalsContact O-N 3.12Å; A110-K113 WeakPolarHBondContact O-CB 3.3Å; A110-K113 PolarHBondContact O-N 3.03Å; M111-K113 VanDerWaalsContact C-N 3.3Å; M111-K113 PolarHBondContact O-N 2.68Å; K113-F117 VanDerWaalsContact O-CB 3.29Å; K113-F117 WeakPolarHBondContact O-CB 3.25Å; K113-F117 PolarHBondContact O-N 2.83Å; K113-L175 HydrophobicContact CB-CD2 4.15Å; K113-L175 WeakPolarHBondContact CD-O 3.41Å; K113-L175 WeakPolarHBondContact CE-O 3.16Å; K113-L175 PolarHBondContact NZ-O 3.03Å; K113-R178 WeakPolarHBondContact CE-O 3.1Å; K113-R178 HydrophobicContact CG-CB 3.99Å; K113-R178 WeakPolarHBondContact CG-O 3.23Å
114	I	95.1	Very high	94.2	Very high	61 Å²	61	31.5 Å²	31.5	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-63.3	-44.6	-177.1	-67.7	164.9	0	0	0	111.5	A110 M111 N116 F117 L118	A110-I114 VanDerWaalsContact O-CG1 3.28Å; A110-I114 WeakPolarHBondContact O-CG1 3.31Å; A110-I114 PolarHBondContact O-N 3.27Å; M111-I114 HydrophobicContact CE-CD1 4.43Å; M111-I114 PolarHBondContact O-N 2.93Å; M111-I114 HydrophobicContact SD-CD1 4.28Å; I114-N116 PolarHBondContact O-N 3Å; I114-F117 WeakPolarHBondContact O-CB 3.47Å; I114-F117 PolarHBondContact O-N 3.33Å; I114-L118 HydrophobicContact CG2-CD1 3.94Å; I114-L118 HydrophobicContact CG2-CG 4.29Å; I114-L118 WeakPolarHBondContact O-CG 3.07Å; I114-L118 PolarHBondContact O-N 2.71Å
115	S	92.9	Very high	94.5	Very high	16 Å²	16	28.9 Å²	28.9	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-45.7	-178	178.6	0	0	0	0	111.6	M111 L118 L119	M111-S115 WeakPolarHBondContact O-CB 3.38Å; M111-S115 PolarHBondContact O-N 2.93Å; S115-L118 PolarHBondContact O-N 2.93Å; S115-L119 PolarHBondContact O-N 3.29Å
116	N	92.8	Very high	94.7	Very high	14 Å²	14	28.7 Å²	28.7	8%	0.075	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-37.9	176.8	-169.9	-100.5	0	0	0	112.3	C112 I114 L118 L119 I120 S174 R178	C112-N116 PolarHBondContact O-N 2.89Å; I114-N116 PolarHBondContact O-N 3Å; N116-L118 VanDerWaalsContact C-N 3.34Å; N116-L118 PolarHBondContact O-N 3.11Å; N116-L119 WeakPolarHBondContact O-CB 3.39Å; N116-L119 PolarHBondContact O-N 3.3Å; N116-I120 WeakPolarHBondContact O-CG1 3.47Å; N116-I120 PolarHBondContact O-N 2.88Å; N116-I120 VanDerWaalsContact O-N 3.09Å; N116-S174 WeakPolarHBondContact OD1-CB 3.44Å; N116-R178 HydrophobicContact CB-CG 3.94Å; N116-R178 PolarHBondContact ND2-NE 3.07Å; N116-R178 PolarHBondContact ND2-NH2 3.43Å; N116-R178 VanDerWaalsContact ND2-NH2 3.17Å
117	F	96.2	Very high	94.8	Very high	23 Å²	23	25.3 Å²	25.3	10%	0.101	15%	0.147	C	C	.	.	H	α-helix	trans	-55.7	-47.7	172.5	170.9	-94.2	0	0	0	112.1	K113 I114 L119 I120 H121 F168 S171 S174 L175	K113-F117 VanDerWaalsContact O-CB 3.29Å; K113-F117 WeakPolarHBondContact O-CB 3.25Å; K113-F117 PolarHBondContact O-N 2.83Å; I114-F117 WeakPolarHBondContact O-CB 3.47Å; I114-F117 PolarHBondContact O-N 3.33Å; F117-L119 VanDerWaalsContact C-N 3.33Å; F117-L119 PolarHBondContact O-N 3.35Å; F117-I120 PolarHBondContact O-N 3.46Å; F117-H121 HydrophobicContact CE1-CB 4.19Å; F117-H121 HydrophobicContact CZ-CB 4.21Å; F117-H121 WeakPolarHBondContact O-CB 3.41Å; F117-H121 PolarHBondContact O-N 2.99Å; F117-F168 HydrophobicContact CE2-CD2 4.07Å; F117-F168 HydrophobicContact CE2-CE2 4.26Å; F117-F168 AromaticContact CZ-CD2 3.53Å; F117-F168 HydrophobicContact CZ-CD2 3.53Å; F117-F168 AromaticContact CZ-CE2 3.87Å; F117-F168 HydrophobicContact CZ-CE2 3.87Å; F117-F168 HydrophobicContact CZ-CG 4.36Å; F117-S171 VanDerWaalsContact CE2-CB 3.46Å; F117-S174 WeakPolarHBondContact CA-OG 3.3Å; F117-S174 WeakPolarHBondContact CB-OG 3.19Å; F117-S174 PolarHBondContact N-OG 3.02Å; F117-L175 HydrophobicContact CB-CD2 3.59Å; F117-L175 HydrophobicContact CB-CG 4.02Å; F117-L175 HydrophobicContact CD2-CD1 3.81Å; F117-L175 HydrophobicContact CD2-CD2 4.16Å; F117-L175 HydrophobicContact CD2-CG 3.74Å; F117-L175 HydrophobicContact CE2-CD1 4.12Å; F117-L175 HydrophobicContact CG-CD1 4.24Å; F117-L175 HydrophobicContact CG-CD2 3.87Å; F117-L175 HydrophobicContact CG-CG 4Å
118	L	95.6	Very high	95	Very high	17 Å²	17	23 Å²	23	9%	0.089	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-37.9	179.1	-71.2	173.6	0	0	0	112.4	L87 F88 F91 I114 S115 N116 N122	L87-L118 HydrophobicContact CD2-CD2 4.15Å; L87-L118 HydrophobicContact CG-CD2 4.27Å; F88-L118 HydrophobicContact CD2-CB 4.48Å; F91-L118 HydrophobicContact CB-CD1 3.7Å; F91-L118 HydrophobicContact CD1-CD1 3.76Å; F91-L118 HydrophobicContact CD2-CD1 3.46Å; F91-L118 VanDerWaalsContact CD2-CD1 3.46Å; F91-L118 HydrophobicContact CE1-CD1 4.22Å; F91-L118 HydrophobicContact CE2-CD1 3.95Å; F91-L118 HydrophobicContact CG-CD1 3.35Å; F91-L118 HydrophobicContact CZ-CD1 4.31Å; I114-L118 HydrophobicContact CG2-CD1 3.94Å; I114-L118 HydrophobicContact CG2-CG 4.29Å; I114-L118 WeakPolarHBondContact O-CG 3.07Å; I114-L118 PolarHBondContact O-N 2.71Å; S115-L118 PolarHBondContact O-N 2.93Å; N116-L118 VanDerWaalsContact C-N 3.34Å; N116-L118 PolarHBondContact O-N 3.11Å; L118-N122 VanDerWaalsContact O-CB 3.3Å; L118-N122 WeakPolarHBondContact O-CB 3.37Å; L118-N122 PolarHBondContact O-N 3.34Å
119	L	93.5	Very high	95	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.079	12%	0.118	C	C	.	.	H	α-helix	trans	-59.4	-52.4	174.4	177.8	68.5	0	0	0	111.4	F88 S115 N116 F117 N122 M123 W273 I306	F88-L119 HydrophobicContact CD2-CB 4.49Å; F88-L119 HydrophobicContact CE2-CB 3.92Å; F88-L119 HydrophobicContact CE2-CD1 3.63Å; F88-L119 HydrophobicContact CE2-CG 4.41Å; F88-L119 HydrophobicContact CZ-CD1 3.62Å; S115-L119 PolarHBondContact O-N 3.29Å; N116-L119 WeakPolarHBondContact O-CB 3.39Å; N116-L119 PolarHBondContact O-N 3.3Å; F117-L119 VanDerWaalsContact C-N 3.33Å; F117-L119 PolarHBondContact O-N 3.35Å; L119-N122 PolarHBondContact O-N 2.99Å; L119-M123 PolarHBondContact O-N 3.5Å; L119-M123 VanDerWaalsContact O-N 3.12Å; L119-W273 HydrophobicContact CD1-CH2 4.33Å; L119-I306 HydrophobicContact CD1-CD1 4.11Å; L119-I306 HydrophobicContact CD1-CG1 3.65Å
120	I	95.1	Very high	95	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-70	-35.7	-178.1	-56.9	-56.4	0	0	0	111	N116 F117 M123 F124 S171	N116-I120 WeakPolarHBondContact O-CG1 3.47Å; N116-I120 PolarHBondContact O-N 2.88Å; N116-I120 VanDerWaalsContact O-N 3.09Å; F117-I120 PolarHBondContact O-N 3.46Å; I120-M123 HydrophobicContact CG2-CE 4.34Å; I120-M123 WeakPolarHBondContact O-CB 3.39Å; I120-M123 PolarHBondContact O-N 3.42Å; I120-F124 HydrophobicContact CG2-CD2 3.69Å; I120-F124 HydrophobicContact CG2-CE2 3.43Å; I120-F124 VanDerWaalsContact CG2-CE2 3.43Å; I120-F124 VanDerWaalsContact O-CD2 3.3Å; I120-F124 WeakPolarHBondContact O-CD2 3.48Å; I120-F124 PolarHBondContact O-N 3.47Å; I120-S171 WeakPolarHBondContact CG2-OG 3.21Å; I120-S171 PolarHBondContact O-OG 2.89Å
121	H	96.6	Very high	95	Very high	13 Å²	13	16.5 Å²	16.5	6%	0.06	8%	0.082	C	C	.	.	H	α-helix	trans	-66.3	-40.8	176.4	-173.8	74.1	0	0	0	112.3	F117 M123 F124 T125 W164 A167 F168 S171	F117-H121 HydrophobicContact CE1-CB 4.19Å; F117-H121 HydrophobicContact CZ-CB 4.21Å; F117-H121 WeakPolarHBondContact O-CB 3.41Å; F117-H121 PolarHBondContact O-N 2.99Å; H121-M123 VanDerWaalsContact C-N 3.32Å; H121-M123 PolarHBondContact O-N 2.87Å; H121-F124 PolarHBondContact O-N 3.37Å; H121-T125 VanDerWaalsContact O-CB 3.29Å; H121-T125 WeakPolarHBondContact O-CB 3.07Å; H121-T125 PolarHBondContact O-N 2.93Å; H121-T125 PolarHBondContact O-OG1 3.41Å; H121-W164 AromaticContact CD2-CZ3 3.98Å; H121-W164 AromaticContact CE1-CE3 3.89Å; H121-W164 AromaticContact NE2-CE3 3.15Å; H121-W164 AromaticContact NE2-CZ3 3.22Å; H121-W164 WeakPolarHBondContact NE2-CZ3 3.25Å; H121-A167 PolarHBondContact ND1-O 3.01Å; H121-F168 PolarHBondContact ND1-N 3.5Å; H121-S171 WeakPolarHBondContact CA-OG 3.11Å; H121-S171 PolarHBondContact N-OG 3.32Å
122	N	95.6	Very high	95	Very high	5 Å²	5	15.2 Å²	15.2	3%	0.027	8%	0.078	C	C	.	.	H	α-helix	trans	-62	-42.3	173.3	-170.6	51.6	0	0	0	111.6	A84 D85 F88 L118 L119 S126	A84-N122 WeakPolarHBondContact CB-OD1 3.46Å; A84-N122 PolarHBondContact O-OD1 2.84Å; D85-N122 PolarHBondContact N-OD1 3.49Å; D85-N122 PolarHBondContact OD1-ND2 2.94Å; D85-N122 PolarHBondContact OD1-OD1 3.16Å; F88-N122 HydrophobicContact CB-CB 3.82Å; F88-N122 HydrophobicContact CD2-CB 4.48Å; F88-N122 HydrophobicContact CG-CB 4.07Å; L118-N122 VanDerWaalsContact O-CB 3.3Å; L118-N122 WeakPolarHBondContact O-CB 3.37Å; L118-N122 PolarHBondContact O-N 3.34Å; L119-N122 PolarHBondContact O-N 2.99Å; N122-S126 WeakPolarHBondContact O-CB 3.29Å; N122-S126 PolarHBondContact O-N 3.01Å; N122-S126 PolarHBondContact O-OG 3.42Å
123	M	95.3	Very high	94.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-56.7	-56.1	175.8	-175	-163.2	74.7	0	0	111.6	L119 I120 H121 S126 V127 R224 W273	L119-M123 PolarHBondContact O-N 3.5Å; L119-M123 VanDerWaalsContact O-N 3.12Å; I120-M123 HydrophobicContact CG2-CE 4.34Å; I120-M123 WeakPolarHBondContact O-CB 3.39Å; I120-M123 PolarHBondContact O-N 3.42Å; H121-M123 VanDerWaalsContact C-N 3.32Å; H121-M123 PolarHBondContact O-N 2.87Å; M123-S126 PolarHBondContact O-N 2.83Å; M123-V127 PolarHBondContact O-N 2.86Å; M123-R224 HydrophobicContact CE-CG 3.86Å; M123-W273 HydrophobicContact CB-CE3 4.38Å; M123-W273 HydrophobicContact CB-CH2 3.4Å; M123-W273 HydrophobicContact CB-CZ2 3.69Å; M123-W273 HydrophobicContact CB-CZ3 3.76Å; M123-W273 HydrophobicContact CG-CD2 3.84Å; M123-W273 HydrophobicContact CG-CE3 3.59Å; M123-W273 HydrophobicContact CG-CH2 3.56Å; M123-W273 HydrophobicContact CG-CZ2 3.77Å; M123-W273 HydrophobicContact CG-CZ3 3.45Å; M123-W273 VanDerWaalsContact CG-CZ3 3.45Å; M123-W273 HydrophobicContact SD-CD2 4.43Å; M123-W273 HydrophobicContact SD-CE3 3.67Å; M123-W273 HydrophobicContact SD-CH2 4.22Å; M123-W273 HydrophobicContact SD-CZ3 3.54Å; M123-W273 VanDerWaalsContact SD-CZ3 3.54Å
124	F	97.3	Very high	94.6	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.009	7%	0.067	C	C	.	.	H	α-helix	trans	-63.4	-44.1	-178.2	-78.6	-59.4	0	0	0	112.1	I120 H121 S126 V127 F128 A167 L170 R224 C227	I120-F124 HydrophobicContact CG2-CD2 3.69Å; I120-F124 HydrophobicContact CG2-CE2 3.43Å; I120-F124 VanDerWaalsContact CG2-CE2 3.43Å; I120-F124 VanDerWaalsContact O-CD2 3.3Å; I120-F124 WeakPolarHBondContact O-CD2 3.48Å; I120-F124 PolarHBondContact O-N 3.47Å; H121-F124 PolarHBondContact O-N 3.37Å; F124-S126 VanDerWaalsContact C-N 3.35Å; F124-S126 PolarHBondContact O-N 2.94Å; F124-V127 WeakPolarHBondContact O-CG1 3.13Å; F124-V127 PolarHBondContact O-N 3.03Å; F124-F128 HydrophobicContact CB-CD2 4.32Å; F124-F128 HydrophobicContact CB-CE2 3.97Å; F124-F128 HydrophobicContact CD1-CE1 4.41Å; F124-F128 HydrophobicContact CD1-CE2 4.02Å; F124-F128 AromaticContact CD1-CZ 3.74Å; F124-F128 HydrophobicContact CD1-CZ 3.74Å; F124-F128 HydrophobicContact CE1-CZ 4.43Å; F124-F128 HydrophobicContact CG-CE2 4.33Å; F124-F128 HydrophobicContact CG-CZ 4.49Å; F124-F128 VanDerWaalsContact O-CB 3.29Å; F124-F128 WeakPolarHBondContact O-CB 3.3Å; F124-F128 WeakPolarHBondContact O-CD2 3.45Å; F124-F128 WeakPolarHBondContact O-CG 3.29Å; F124-F128 PolarHBondContact O-N 3.37Å; F124-A167 HydrophobicContact CB-CB 3.68Å; F124-L170 HydrophobicContact CD1-CB 4.38Å; F124-L170 HydrophobicContact CD1-CD1 3.97Å; F124-L170 HydrophobicContact CD2-CB 3.76Å; F124-L170 HydrophobicContact CE1-CB 4.14Å; F124-L170 HydrophobicContact CE1-CD1 3.86Å; F124-L170 HydrophobicContact CE2-CB 3.48Å; F124-L170 VanDerWaalsContact CE2-CB 3.48Å; F124-L170 HydrophobicContact CG-CB 4.21Å; F124-L170 HydrophobicContact CG-CD1 4.42Å; F124-L170 HydrophobicContact CZ-CB 3.69Å; F124-L170 HydrophobicContact CZ-CD1 4.23Å; F124-L170 HydrophobicContact CZ-CG 4.49Å; F124-R224 HydrophobicContact CZ-CG 4.2Å; F124-C227 HydrophobicContact CE1-CB 3.89Å
125	T	96.9	Very high	94.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.1	-46.4	178.2	-57.6	0	0	0	0	110.8	A84 H121 L129 I163 W164 A167	A84-T125 HydrophobicContact CB-CG2 3.7Å; H121-T125 VanDerWaalsContact O-CB 3.29Å; H121-T125 WeakPolarHBondContact O-CB 3.07Å; H121-T125 PolarHBondContact O-N 2.93Å; H121-T125 PolarHBondContact O-OG1 3.41Å; T125-L129 HydrophobicContact CG2-CD1 3.82Å; T125-L129 HydrophobicContact CG2-CG 4.46Å; T125-L129 WeakPolarHBondContact O-CB 3.2Å; T125-L129 WeakPolarHBondContact O-CD1 3.08Å; T125-L129 WeakPolarHBondContact O-CG 3.33Å; T125-L129 PolarHBondContact O-N 2.97Å; T125-I163 HydrophobicContact CG2-CG2 4.25Å; T125-W164 HydrophobicContact CG2-CD2 4.47Å; T125-W164 HydrophobicContact CG2-CZ2 4.33Å; T125-A167 WeakPolarHBondContact OG1-CB 3.4Å
126	S	94.8	Very high	94.3	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-60.5	-50.6	178	-64.5	0	0	0	0	112.2	N122 M123 F124 F128 L129 L130	N122-S126 WeakPolarHBondContact O-CB 3.29Å; N122-S126 PolarHBondContact O-N 3.01Å; N122-S126 PolarHBondContact O-OG 3.42Å; M123-S126 PolarHBondContact O-N 2.83Å; F124-S126 VanDerWaalsContact C-N 3.35Å; F124-S126 PolarHBondContact O-N 2.94Å; S126-F128 PolarHBondContact O-N 2.96Å; S126-L129 PolarHBondContact O-N 3.06Å; S126-L130 VanDerWaalsContact O-CG 3.32Å; S126-L130 WeakPolarHBondContact O-CG 3.26Å; S126-L130 PolarHBondContact O-N 3.5Å
127	V	95.6	Very high	94	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-68.2	-37.2	-176	80.1	0	0	0	0	112.4	M123 F124 L130 T131 P232 F269 F270	M123-V127 PolarHBondContact O-N 2.86Å; F124-V127 WeakPolarHBondContact O-CG1 3.13Å; F124-V127 PolarHBondContact O-N 3.03Å; V127-L130 PolarHBondContact O-N 3.48Å; V127-T131 WeakPolarHBondContact O-CB 3.36Å; V127-T131 PolarHBondContact O-N 2.9Å; V127-T131 PolarHBondContact O-OG1 3.46Å; V127-P232 HydrophobicContact CG1-CG 4.1Å; V127-P232 HydrophobicContact CG2-CB 3.41Å; V127-P232 VanDerWaalsContact CG2-CB 3.41Å; V127-P232 HydrophobicContact CG2-CG 3.7Å; V127-F269 HydrophobicContact CB-CE1 3.78Å; V127-F269 HydrophobicContact CB-CE2 4.16Å; V127-F269 HydrophobicContact CB-CZ 3.46Å; V127-F269 VanDerWaalsContact CB-CZ 3.46Å; V127-F269 HydrophobicContact CG2-CD1 4.19Å; V127-F269 HydrophobicContact CG2-CE1 3.43Å; V127-F269 VanDerWaalsContact CG2-CE1 3.43Å; V127-F269 HydrophobicContact CG2-CZ 3.7Å; V127-F270 HydrophobicContact CG2-CE1 4.32Å; V127-F270 HydrophobicContact CG2-CZ 4.47Å
128	F	97.3	Very high	93.6	Very high	27 Å²	27	16 Å²	16	12%	0.118	8%	0.078	C	C	.	.	H	α-helix	trans	-69.7	-38.6	176.3	-65.7	-24.3	0	0	0	111.8	F124 S126 T131 V132 I163 L166 L170 C227	F124-F128 HydrophobicContact CB-CD2 4.32Å; F124-F128 HydrophobicContact CB-CE2 3.97Å; F124-F128 HydrophobicContact CD1-CE1 4.41Å; F124-F128 HydrophobicContact CD1-CE2 4.02Å; F124-F128 AromaticContact CD1-CZ 3.74Å; F124-F128 HydrophobicContact CD1-CZ 3.74Å; F124-F128 HydrophobicContact CE1-CZ 4.43Å; F124-F128 HydrophobicContact CG-CE2 4.33Å; F124-F128 HydrophobicContact CG-CZ 4.49Å; F124-F128 VanDerWaalsContact O-CB 3.29Å; F124-F128 WeakPolarHBondContact O-CB 3.3Å; F124-F128 WeakPolarHBondContact O-CD2 3.45Å; F124-F128 WeakPolarHBondContact O-CG 3.29Å; F124-F128 PolarHBondContact O-N 3.37Å; S126-F128 PolarHBondContact O-N 2.96Å; F128-T131 WeakPolarHBondContact O-CB 3.31Å; F128-T131 PolarHBondContact O-N 3.01Å; F128-V132 WeakPolarHBondContact O-CG2 3.22Å; F128-V132 PolarHBondContact O-N 3.48Å; F128-I163 HydrophobicContact CB-CB 4.46Å; F128-I163 HydrophobicContact CB-CD1 4.41Å; F128-I163 HydrophobicContact CB-CG1 4.08Å; F128-I163 HydrophobicContact CB-CG2 3.7Å; F128-I163 HydrophobicContact CD2-CG2 4.26Å; F128-L166 HydrophobicContact CD2-CD2 4.19Å; F128-L166 HydrophobicContact CD2-CG 4.49Å; F128-L166 HydrophobicContact CE2-CB 4.42Å; F128-L166 HydrophobicContact CE2-CD2 3.7Å; F128-L166 HydrophobicContact CE2-CG 3.79Å; F128-L166 HydrophobicContact CZ-CD2 4.02Å; F128-L166 HydrophobicContact CZ-CG 4.34Å; F128-L170 HydrophobicContact CE2-CD1 3.79Å; F128-L170 HydrophobicContact CZ-CD1 3.53Å; F128-C227 WeakPolarHBondContact CE1-O 3.34Å
129	L	94.3	Very high	93.3	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-61.5	-46	171.4	-74.5	168.2	0	0	0	111.1	W77 N80 L81 T125 S126 T131 V132 I133 I163	W77-L129 HydrophobicContact CE3-CD2 4.07Å; N80-L129 HydrophobicContact CB-CD1 3.98Å; N80-L129 HydrophobicContact CB-CD2 4.11Å; L81-L129 HydrophobicContact CB-CD1 3.96Å; L81-L129 HydrophobicContact CD1-CB 4.5Å; L81-L129 HydrophobicContact CD1-CD1 4.14Å; T125-L129 HydrophobicContact CG2-CD1 3.82Å; T125-L129 HydrophobicContact CG2-CG 4.46Å; T125-L129 WeakPolarHBondContact O-CB 3.2Å; T125-L129 WeakPolarHBondContact O-CD1 3.08Å; T125-L129 WeakPolarHBondContact O-CG 3.33Å; T125-L129 PolarHBondContact O-N 2.97Å; S126-L129 PolarHBondContact O-N 3.06Å; L129-T131 VanDerWaalsContact C-N 3.27Å; L129-T131 PolarHBondContact O-N 2.95Å; L129-V132 PolarHBondContact O-N 2.63Å; L129-I133 WeakPolarHBondContact O-CB 3.5Å; L129-I133 WeakPolarHBondContact O-CD1 3.47Å; L129-I133 WeakPolarHBondContact O-CG1 3.17Å; L129-I133 PolarHBondContact O-N 3.04Å; L129-I163 HydrophobicContact CD2-CD1 3.81Å; L129-I163 HydrophobicContact CG-CD1 4.24Å; L129-I163 HydrophobicContact CG-CG2 4.4Å
130	L	92.4	Very high	93	Very high	5 Å²	5	17.2 Å²	17.2	3%	0.026	9%	0.086	C	C	.	.	H	α-helix	trans	-60.3	-38.4	175.7	-69.2	176.4	0	0	0	112.3	S126 V127 S134 I236 I265 F269	S126-L130 VanDerWaalsContact O-CG 3.32Å; S126-L130 WeakPolarHBondContact O-CG 3.26Å; S126-L130 PolarHBondContact O-N 3.5Å; V127-L130 PolarHBondContact O-N 3.48Å; L130-S134 WeakPolarHBondContact O-CB 3.5Å; L130-S134 PolarHBondContact O-N 3.19Å; L130-S134 PolarHBondContact O-OG 3.28Å; L130-I236 HydrophobicContact CB-CD1 4.25Å; L130-I265 HydrophobicContact CD1-CG2 4.43Å; L130-I265 HydrophobicContact CD2-CG2 3.57Å; L130-F269 HydrophobicContact CD1-CB 3.72Å; L130-F269 HydrophobicContact CD1-CD1 4.38Å; L130-F269 HydrophobicContact CD1-CD2 3.69Å; L130-F269 HydrophobicContact CD1-CE2 4.48Å; L130-F269 HydrophobicContact CD1-CG 3.65Å
131	T	95	Very high	92.5	Very high	16 Å²	16	19.7 Å²	19.7	10%	0.098	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-48.9	176.3	-55.8	0	0	0	0	111.1	V127 F128 L129 S134 F135 I235	V127-T131 WeakPolarHBondContact O-CB 3.36Å; V127-T131 PolarHBondContact O-N 2.9Å; V127-T131 PolarHBondContact O-OG1 3.46Å; F128-T131 WeakPolarHBondContact O-CB 3.31Å; F128-T131 PolarHBondContact O-N 3.01Å; L129-T131 VanDerWaalsContact C-N 3.27Å; L129-T131 PolarHBondContact O-N 2.95Å; T131-S134 WeakPolarHBondContact O-CB 3.03Å; T131-S134 PolarHBondContact O-N 3.4Å; T131-F135 WeakPolarHBondContact O-CB 3.44Å; T131-F135 PolarHBondContact O-N 2.93Å; T131-I235 HydrophobicContact CG2-CB 4.01Å; T131-I235 HydrophobicContact CG2-CD1 4.13Å; T131-I235 HydrophobicContact CG2-CG2 3.59Å
132	V	94.3	Very high	92.1	Very high	41 Å²	41	22.2 Å²	22.2	25%	0.248	12%	0.115	C	C	.	.	H	α-helix	trans	-67.5	-38.4	179.2	171.2	0	0	0	0	111.9	W77 F128 L129 S134 F135 D136 I163	W77-V132 HydrophobicContact CE3-CG1 4.46Å; W77-V132 HydrophobicContact CH2-CG1 3.48Å; W77-V132 VanDerWaalsContact CH2-CG1 3.48Å; W77-V132 HydrophobicContact CZ2-CG1 3.69Å; W77-V132 HydrophobicContact CZ3-CG1 3.9Å; F128-V132 WeakPolarHBondContact O-CG2 3.22Å; F128-V132 PolarHBondContact O-N 3.48Å; L129-V132 PolarHBondContact O-N 2.63Å; V132-S134 VanDerWaalsContact C-N 3.31Å; V132-S134 PolarHBondContact O-N 3.25Å; V132-F135 PolarHBondContact O-N 3.03Å; V132-D136 WeakPolarHBondContact O-CB 3.32Å; V132-D136 PolarHBondContact O-N 3.07Å; V132-I163 HydrophobicContact CB-CD1 4.36Å; V132-I163 HydrophobicContact CG2-CD1 3.95Å
133	I	90.1	Very high	91.7	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-58.8	-45.6	172.7	-69.3	162.3	0	0	0	110.1	W77 L129 F135 D136 R137 I262	W77-I133 HydrophobicContact CB-CD1 3.87Å; W77-I133 HydrophobicContact CB-CG1 3.67Å; W77-I133 HydrophobicContact CG-CG1 3.77Å; L129-I133 WeakPolarHBondContact O-CB 3.5Å; L129-I133 WeakPolarHBondContact O-CD1 3.47Å; L129-I133 WeakPolarHBondContact O-CG1 3.17Å; L129-I133 PolarHBondContact O-N 3.04Å; I133-F135 VanDerWaalsContact C-N 3.33Å; I133-F135 PolarHBondContact O-N 3.34Å; I133-D136 PolarHBondContact O-N 3.1Å; I133-R137 WeakPolarHBondContact O-CB 3.16Å; I133-R137 WeakPolarHBondContact O-CG 3.42Å; I133-R137 PolarHBondContact O-N 2.99Å; I133-I262 HydrophobicContact CG2-CD1 4.34Å; I133-I262 HydrophobicContact CG2-CG2 4.21Å
134	S	90.3	Very high	91.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-41.4	179	-57.5	0	0	0	0	111.7	L130 T131 V132 R137 C138 Y240	L130-S134 WeakPolarHBondContact O-CB 3.5Å; L130-S134 PolarHBondContact O-N 3.19Å; L130-S134 PolarHBondContact O-OG 3.28Å; T131-S134 WeakPolarHBondContact O-CB 3.03Å; T131-S134 PolarHBondContact O-N 3.4Å; V132-S134 VanDerWaalsContact C-N 3.31Å; V132-S134 PolarHBondContact O-N 3.25Å; S134-R137 PolarHBondContact O-N 3.35Å; S134-C138 WeakPolarHBondContact O-CB 3.33Å; S134-C138 PolarHBondContact O-N 3.38Å; S134-Y240 WeakPolarHBondContact OG-CE2 3.49Å
135	F	91.7	Very high	90.7	Very high	112 Å²	112	36.1 Å²	36.1	49%	0.491	20%	0.197	S	C	.	.	H	α-helix	trans	-68.4	-45.6	177.6	-171.7	-109	0	0	0	112.7	T131 V132 I133 R137 C138 I139	T131-F135 WeakPolarHBondContact O-CB 3.44Å; T131-F135 PolarHBondContact O-N 2.93Å; V132-F135 PolarHBondContact O-N 3.03Å; I133-F135 VanDerWaalsContact C-N 3.33Å; I133-F135 PolarHBondContact O-N 3.34Å; F135-R137 PolarHBondContact O-N 3.4Å; F135-C138 WeakPolarHBondContact O-CB 3.25Å; F135-C138 PolarHBondContact O-N 3.42Å; F135-C138 VanDerWaalsContact O-N 3.08Å; F135-I139 HydrophobicContact CD1-CD1 3.77Å; F135-I139 HydrophobicContact CE1-CD1 3.28Å; F135-I139 HydrophobicContact CE1-CG1 4.23Å; F135-I139 HydrophobicContact CE2-CD1 4.45Å; F135-I139 HydrophobicContact CZ-CD1 3.67Å; F135-I139 HydrophobicContact CZ-CG1 4.29Å; F135-I139 PolarHBondContact O-N 2.92Å
136	D	89.8	Confident	90.3	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.107	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-39.5	174.3	175.9	63.9	0	0	0	111.5	V132 I133 S140 R151	V132-D136 WeakPolarHBondContact O-CB 3.32Å; V132-D136 PolarHBondContact O-N 3.07Å; I133-D136 PolarHBondContact O-N 3.1Å; D136-S140 WeakPolarHBondContact O-CB 3.26Å; D136-S140 PolarHBondContact O-N 3.32Å; D136-S140 PolarHBondContact O-OG 2.96Å; D136-R151 IonicContact OD1-CZ 3.12Å; D136-R151 IonicContact OD1-NE 2.97Å; D136-R151 PolarHBondContact OD1-NE 3.32Å; D136-R151 IonicContact OD1-NH2 2.74Å; D136-R151 IonicContact OD2-CZ 3.82Å; D136-R151 IonicContact OD2-NE 3.3Å; D136-R151 PolarHBondContact OD2-NE 3.37Å; D136-R151 IonicContact OD2-NH2 3.58Å; D136-R151 PolarHBondContact OD2-NH2 3.24Å
137	R	85.9	Confident	89.9	Confident	45 Å²	45	42 Å²	42	17%	0.17	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-43.3	174.7	-69.6	-72.1	164.1	-172.3	-2.2	112.4	N74 I133 S134 F135 I139 S140 V141 I243 I262 D341	N74-R137 PolarHBondContact ND2-NH2 3.05Å; N74-R137 PolarHBondContact OD1-NH2 3.47Å; I133-R137 WeakPolarHBondContact O-CB 3.16Å; I133-R137 WeakPolarHBondContact O-CG 3.42Å; I133-R137 PolarHBondContact O-N 2.99Å; S134-R137 PolarHBondContact O-N 3.35Å; F135-R137 PolarHBondContact O-N 3.4Å; R137-I139 VanDerWaalsContact C-N 3.35Å; R137-I139 PolarHBondContact O-N 2.98Å; R137-S140 PolarHBondContact O-N 3.04Å; R137-V141 WeakPolarHBondContact O-CG2 3.39Å; R137-V141 PolarHBondContact O-N 2.96Å; R137-I243 HydrophobicContact CB-CD1 4.29Å; R137-I262 HydrophobicContact CG-CD1 3.99Å; R137-D341 IonicContact CZ-OD2 2.75Å; R137-D341 VanDerWaalsContact NH1-CG 3.35Å; R137-D341 IonicContact NH1-OD1 3.8Å; R137-D341 PolarHBondContact NH1-OD1 3.01Å; R137-D341 IonicContact NH1-OD2 2.71Å; R137-D341 PolarHBondContact NH1-OD2 3.49Å; R137-D341 IonicContact NH2-OD2 3.28Å; R137-D341 PolarHBondContact NH2-OD2 2.83Å
138	C	88.3	Confident	89.3	Confident	10 Å²	10	49.5 Å²	49.5	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-49.2	176.5	-162.5	0	0	0	0	110.7	S134 F135 S140 V141 L142 C239 I243	S134-C138 WeakPolarHBondContact O-CB 3.33Å; S134-C138 PolarHBondContact O-N 3.38Å; F135-C138 WeakPolarHBondContact O-CB 3.25Å; F135-C138 PolarHBondContact O-N 3.42Å; F135-C138 VanDerWaalsContact O-N 3.08Å; C138-S140 PolarHBondContact O-N 2.96Å; C138-V141 PolarHBondContact O-N 3.44Å; C138-L142 WeakPolarHBondContact O-CB 3.41Å; C138-L142 VanDerWaalsContact O-CG 3.28Å; C138-L142 WeakPolarHBondContact O-CG 3.19Å; C138-L142 PolarHBondContact O-N 2.96Å; C138-L142 VanDerWaalsContact SG-CD1 3.56Å; C138-C239 HydrophobicContact CB-CB 3.96Å; C138-I243 HydrophobicContact CB-CD1 4.23Å; C138-I243 HydrophobicContact CB-CG1 4.35Å
139	I	89.8	Confident	88.7	Confident	33 Å²	33	54.3 Å²	54.3	17%	0.169	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-44.8	176.4	-69.3	176.4	0	0	0	111.3	F135 R137 V141 L142 L143 W146	F135-I139 HydrophobicContact CD1-CD1 3.77Å; F135-I139 HydrophobicContact CE1-CD1 3.28Å; F135-I139 HydrophobicContact CE1-CG1 4.23Å; F135-I139 HydrophobicContact CE2-CD1 4.45Å; F135-I139 HydrophobicContact CZ-CD1 3.67Å; F135-I139 HydrophobicContact CZ-CG1 4.29Å; F135-I139 PolarHBondContact O-N 2.92Å; R137-I139 VanDerWaalsContact C-N 3.35Å; R137-I139 PolarHBondContact O-N 2.98Å; I139-V141 PolarHBondContact O-N 3.47Å; I139-L142 PolarHBondContact O-N 2.91Å; I139-L143 CarbonylContact O-C 3.58Å; I139-L143 WeakPolarHBondContact O-CA 3.28Å; I139-L143 PolarHBondContact O-N 3.47Å; I139-W146 HydrophobicContact CG2-CE3 3.57Å; I139-W146 HydrophobicContact CG2-CZ3 3.71Å
140	S	86.3	Confident	88.3	Confident	25 Å²	25	58.6 Å²	58.6	18%	0.175	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-29.7	-178.9	-63.6	0	0	0	0	113.3	D136 R137 C138 S147	D136-S140 WeakPolarHBondContact O-CB 3.26Å; D136-S140 PolarHBondContact O-N 3.32Å; D136-S140 PolarHBondContact O-OG 2.96Å; R137-S140 PolarHBondContact O-N 3.04Å; C138-S140 PolarHBondContact O-N 2.96Å; S140-S147 PolarHBondContact OG-OG 2.85Å
141	V	85.1	Confident	88.2	Confident	53 Å²	53	61.4 Å²	61.4	32%	0.321	31%	0.313	S	S	.	.	H	α-helix	trans	-83.4	-38.1	175.9	172.6	0	0	0	0	112.1	R137 C138 I139 I243 K246	R137-V141 WeakPolarHBondContact O-CG2 3.39Å; R137-V141 PolarHBondContact O-N 2.96Å; C138-V141 PolarHBondContact O-N 3.44Å; I139-V141 PolarHBondContact O-N 3.47Å; V141-I243 HydrophobicContact CB-CG1 4.43Å; V141-I243 HydrophobicContact CG1-CG2 4.5Å; V141-I243 HydrophobicContact CG2-CG1 4.49Å; V141-I243 HydrophobicContact CG2-CG2 4.43Å; V141-K246 HydrophobicContact CG1-CB 4.41Å; V141-K246 HydrophobicContact CG1-CG 4.16Å
142	L	87.3	Confident	88	Confident	67 Å²	67	63.2 Å²	63.2	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-80.5	-39.7	-176.5	-69.8	176.2	0	0	0	113.2	C138 I139 T242 K246	C138-L142 WeakPolarHBondContact O-CB 3.41Å; C138-L142 VanDerWaalsContact O-CG 3.28Å; C138-L142 WeakPolarHBondContact O-CG 3.19Å; C138-L142 PolarHBondContact O-N 2.96Å; C138-L142 VanDerWaalsContact SG-CD1 3.56Å; I139-L142 PolarHBondContact O-N 2.91Å; L142-T242 HydrophobicContact CD1-CG2 3.67Å; L142-T242 HydrophobicContact CD2-CG2 3.84Å; L142-T242 HydrophobicContact CG-CG2 4.19Å; L142-K246 HydrophobicContact CD2-CB 4.24Å; L142-K246 HydrophobicContact CD2-CD 4.47Å; L142-K246 HydrophobicContact CD2-CG 4.13Å
143	L	88.1	Confident	87.8	Confident	100 Å²	100	63.4 Å²	63.4	52%	0.524	33%	0.327	S	S	.	.			trans	-130.7	67.5	-171.6	-58.1	175.7	0	0	0	110.4	I139 V145 W146 S147	I139-L143 CarbonylContact O-C 3.58Å; I139-L143 WeakPolarHBondContact O-CA 3.28Å; I139-L143 PolarHBondContact O-N 3.47Å; L143-V145 VanDerWaalsContact C-N 3.33Å; L143-V145 PolarHBondContact O-N 2.86Å; L143-W146 HydrophobicContact CB-CB 3.97Å; L143-W146 PolarHBondContact O-N 2.93Å; L143-S147 WeakPolarHBondContact O-CB 3.5Å; L143-S147 PolarHBondContact O-N 3.38Å
144	P	84.5	Confident	87.9	Confident	79 Å²	79	73 Å²	73	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-38.5	-173.6	23.9	-34	0	0	0	113	S147 Q148	P144-S147 PolarHBondContact O-N 2.93Å; P144-Q148 WeakPolarHBondContact O-CB 3.41Å; P144-Q148 PolarHBondContact O-N 3Å
145	V	86.9	Confident	88.1	Confident	119 Å²	119	77.6 Å²	77.6	72%	0.721	39%	0.387	S	S	*	.	H	α-helix	trans	-66.1	-41.9	178.4	-178.9	0	0	0	0	111.2	L143 Q148 N149	L143-V145 VanDerWaalsContact C-N 3.33Å; L143-V145 PolarHBondContact O-N 2.86Å; V145-Q148 PolarHBondContact O-N 3.12Å; V145-N149 PolarHBondContact O-N 2.99Å
146	W	88.5	Confident	88.1	Confident	114 Å²	114	72.4 Å²	72.4	43%	0.432	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-45.2	177.5	-173.5	91.3	0	0	0	111.1	I139 L143 Q148 N149 H150	I139-W146 HydrophobicContact CG2-CE3 3.57Å; I139-W146 HydrophobicContact CG2-CZ3 3.71Å; L143-W146 HydrophobicContact CB-CB 3.97Å; L143-W146 PolarHBondContact O-N 2.93Å; W146-Q148 VanDerWaalsContact C-N 3.34Å; W146-Q148 PolarHBondContact O-N 3.37Å; W146-N149 PolarHBondContact O-N 3.37Å; W146-H150 AromaticContact CD1-CE1 3.82Å; W146-H150 AromaticContact CD1-ND1 3.47Å; W146-H150 HydrophobicContact CD2-CB 4.07Å; W146-H150 AromaticContact CE2-CG 3.78Å; W146-H150 AromaticContact CE2-ND1 3.84Å; W146-H150 HydrophobicContact CE3-CB 4.32Å; W146-H150 AromaticContact CG-ND1 3.88Å; W146-H150 HydrophobicContact CH2-CB 4.04Å; W146-H150 HydrophobicContact CZ2-CB 3.77Å; W146-H150 HydrophobicContact CZ3-CB 4.3Å; W146-H150 AromaticContact NE1-CE1 3.75Å; W146-H150 AromaticContact NE1-CG 3.72Å; W146-H150 AromaticContact NE1-ND1 3.43Å; W146-H150 PolarHBondContact NE1-ND1 3.37Å; W146-H150 WeakPolarHBondContact O-CB 3.26Å; W146-H150 PolarHBondContact O-N 2.97Å; W146-H150 PolarHBondContact O-ND1 3.19Å
147	S	86.4	Confident	88.4	Confident	11 Å²	11	75.9 Å²	75.9	8%	0.077	38%	0.377	C	S	.	.	H	α-helix	trans	-56.7	-47.9	176.3	-177.9	0	0	0	0	110.4	S140 L143 P144 N149 R151	S140-S147 PolarHBondContact OG-OG 2.85Å; L143-S147 WeakPolarHBondContact O-CB 3.5Å; L143-S147 PolarHBondContact O-N 3.38Å; P144-S147 PolarHBondContact O-N 2.93Å; S147-N149 VanDerWaalsContact C-N 3.28Å; S147-N149 PolarHBondContact O-N 3.38Å; S147-R151 WeakPolarHBondContact O-CA 3.23Å; S147-R151 WeakPolarHBondContact O-CB 3.28Å; S147-R151 PolarHBondContact O-N 3.39Å; S147-R151 VanDerWaalsContact OG-CD 3.31Å; S147-R151 WeakPolarHBondContact OG-CD 3.3Å
148	Q	82.6	Confident	88.9	Confident	158 Å²	158	79 Å²	79	74%	0.738	40%	0.395	S	S	*	.	H	α-helix	trans	-60.8	-34.3	179.2	-171.6	171.8	-0.5	0	0	113.8	P144 V145 W146	P144-Q148 WeakPolarHBondContact O-CB 3.41Å; P144-Q148 PolarHBondContact O-N 3Å; V145-Q148 PolarHBondContact O-N 3.12Å; W146-Q148 VanDerWaalsContact C-N 3.34Å; W146-Q148 PolarHBondContact O-N 3.37Å
149	N	85.3	Confident	89.2	Confident	127 Å²	127	79.8 Å²	79.8	68%	0.679	40%	0.402	S	S	*	.	H	α-helix	trans	-89.4	-31.5	-175.9	-166.6	73.2	0	0	0	114.2	V145 W146 S147	V145-N149 PolarHBondContact O-N 2.99Å; W146-N149 PolarHBondContact O-N 3.37Å; S147-N149 VanDerWaalsContact C-N 3.28Å; S147-N149 PolarHBondContact O-N 3.38Å
150	H	86.9	Confident	89.6	Confident	91 Å²	91	78.3 Å²	78.3	42%	0.421	40%	0.395	S	S	.	.	H	α-helix	trans	-113	-18.9	-171.8	-65.2	87.5	0	0	0	114.2	W146 S152	W146-H150 AromaticContact CD1-CE1 3.82Å; W146-H150 AromaticContact CD1-ND1 3.47Å; W146-H150 HydrophobicContact CD2-CB 4.07Å; W146-H150 AromaticContact CE2-CG 3.78Å; W146-H150 AromaticContact CE2-ND1 3.84Å; W146-H150 HydrophobicContact CE3-CB 4.32Å; W146-H150 AromaticContact CG-ND1 3.88Å; W146-H150 HydrophobicContact CH2-CB 4.04Å; W146-H150 HydrophobicContact CZ2-CB 3.77Å; W146-H150 HydrophobicContact CZ3-CB 4.3Å; W146-H150 AromaticContact NE1-CE1 3.75Å; W146-H150 AromaticContact NE1-CG 3.72Å; W146-H150 AromaticContact NE1-ND1 3.43Å; W146-H150 PolarHBondContact NE1-ND1 3.37Å; W146-H150 WeakPolarHBondContact O-CB 3.26Å; W146-H150 PolarHBondContact O-N 2.97Å; W146-H150 PolarHBondContact O-ND1 3.19Å; H150-S152 PolarHBondContact O-N 3.07Å
151	R	88.3	Confident	90.1	Very high	65 Å²	65	82.8 Å²	82.8	25%	0.245	41%	0.414	C	S	.	.			trans	-69.8	99.2	179.6	-172.9	174.4	-176.2	-139.5	-1.5	109.6	V73 N74 D136 S147 D341	V73-R151 HydrophobicContact CB-CG 4.33Å; V73-R151 HydrophobicContact CG1-CG 4.36Å; V73-R151 HydrophobicContact CG2-CG 3.86Å; N74-R151 PolarHBondContact OD1-NH2 2.96Å; D136-R151 IonicContact OD1-CZ 3.12Å; D136-R151 IonicContact OD1-NE 2.97Å; D136-R151 PolarHBondContact OD1-NE 3.32Å; D136-R151 IonicContact OD1-NH2 2.74Å; D136-R151 IonicContact OD2-CZ 3.82Å; D136-R151 IonicContact OD2-NE 3.3Å; D136-R151 PolarHBondContact OD2-NE 3.37Å; D136-R151 IonicContact OD2-NH2 3.58Å; D136-R151 PolarHBondContact OD2-NH2 3.24Å; S147-R151 WeakPolarHBondContact O-CA 3.23Å; S147-R151 WeakPolarHBondContact O-CB 3.28Å; S147-R151 PolarHBondContact O-N 3.39Å; S147-R151 VanDerWaalsContact OG-CD 3.31Å; S147-R151 WeakPolarHBondContact OG-CD 3.3Å; R151-D341 IonicContact NH1-OD2 2.73Å; R151-D341 IonicContact NH2-OD2 3.36Å
152	S	92	Very high	90.7	Very high	53 Å²	53	84.7 Å²	84.7	37%	0.371	43%	0.426	S	S	.	.			trans	-119.5	150.5	-177.1	69.9	0	0	0	0	112.3	V73 H150 R154 L155 A156	V73-S152 WeakPolarHBondContact CG2-O 3.36Å; H150-S152 PolarHBondContact O-N 3.07Å; S152-R154 PolarHBondContact O-N 3.37Å; S152-L155 PolarHBondContact O-N 3.21Å; S152-L155 WeakPolarHBondContact OG-CB 3.37Å; S152-L155 PolarHBondContact OG-N 3.02Å; S152-A156 PolarHBondContact O-N 3.35Å
153	V	90.5	Very high	91.2	Very high	45 Å²	45	82 Å²	82	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-34.1	175.8	176.3	0	0	0	0	111.3	V73 V76 A156 Y157	V73-V153 HydrophobicContact CG2-CG2 4.45Å; V76-V153 HydrophobicContact CG2-CG1 4.02Å; V153-A156 WeakPolarHBondContact O-CB 3.46Å; V153-A156 PolarHBondContact O-N 2.75Å; V153-Y157 HydrophobicContact CG1-CD2 3.8Å; V153-Y157 HydrophobicContact CG1-CE2 3.56Å; V153-Y157 WeakPolarHBondContact O-CD2 3.19Å; V153-Y157 PolarHBondContact O-N 3.43Å
154	R	92.4	Very high	91.7	Very high	206 Å²	206	79.7 Å²	79.7	78%	0.777	40%	0.396	S	S	*	.	H	α-helix	trans	-61.6	-45.9	176.3	-174.9	177.7	-179.1	174.1	0.7	111.5	S152 A156 Y157 M158	S152-R154 PolarHBondContact O-N 3.37Å; R154-A156 VanDerWaalsContact C-N 3.28Å; R154-A156 PolarHBondContact O-N 3.17Å; R154-Y157 PolarHBondContact O-N 3.32Å; R154-M158 WeakPolarHBondContact O-CG 3.46Å; R154-M158 PolarHBondContact O-N 2.97Å
155	L	92.6	Very high	92.3	Very high	97 Å²	97	79.4 Å²	79.4	51%	0.508	39%	0.393	S	S	.	.	H	α-helix	trans	-62.6	-38.6	177.1	-174.7	63.5	0	0	0	111.4	S152 M158 A159	S152-L155 PolarHBondContact O-N 3.21Å; S152-L155 WeakPolarHBondContact OG-CB 3.37Å; S152-L155 PolarHBondContact OG-N 3.02Å; L155-M158 PolarHBondContact O-N 3.37Å; L155-A159 WeakPolarHBondContact O-CB 3.19Å; L155-A159 PolarHBondContact O-N 3.44Å
156	A	93.2	Very high	92.9	Very high	3 Å²	3	77.6 Å²	77.6	3%	0.025	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-45.6	176.1	0	0	0	0	0	112.4	V73 V76 W77 S152 V153 R154 M158 A159 C160	V73-A156 HydrophobicContact CB-CB 4.4Å; V73-A156 HydrophobicContact CG1-CB 4.05Å; V73-A156 HydrophobicContact CG2-CB 4.18Å; V76-A156 HydrophobicContact CB-CB 4.2Å; V76-A156 HydrophobicContact CG1-CB 4.04Å; W77-A156 HydrophobicContact CH2-CB 3.81Å; W77-A156 HydrophobicContact CZ2-CB 3.84Å; W77-A156 HydrophobicContact CZ3-CB 4.24Å; W77-A156 WeakPolarHBondContact CZ3-O 3.21Å; S152-A156 PolarHBondContact O-N 3.35Å; V153-A156 WeakPolarHBondContact O-CB 3.46Å; V153-A156 PolarHBondContact O-N 2.75Å; R154-A156 VanDerWaalsContact C-N 3.28Å; R154-A156 PolarHBondContact O-N 3.17Å; A156-M158 PolarHBondContact O-N 2.89Å; A156-A159 PolarHBondContact O-N 3.02Å; A156-C160 PolarHBondContact O-N 2.95Å; A156-C160 PolarHBondContact O-SG 3Å; A156-C160 VanDerWaalsContact O-SG 3.39Å
157	Y	94.9	Very high	93.3	Very high	92 Å²	92	72.1 Å²	72.1	36%	0.361	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-41	175.1	-80.9	-66.1	0	0	0	112.8	V76 V153 R154 A159 C160 M161	V76-Y157 HydrophobicContact CG1-CD1 3.93Å; V76-Y157 HydrophobicContact CG1-CE1 3.96Å; V76-Y157 HydrophobicContact CG1-CG 4.24Å; V76-Y157 HydrophobicContact CG2-CD2 4.27Å; V76-Y157 HydrophobicContact CG2-CE1 4.22Å; V76-Y157 HydrophobicContact CG2-CE2 3.76Å; V153-Y157 HydrophobicContact CG1-CD2 3.8Å; V153-Y157 HydrophobicContact CG1-CE2 3.56Å; V153-Y157 WeakPolarHBondContact O-CD2 3.19Å; V153-Y157 PolarHBondContact O-N 3.43Å; R154-Y157 PolarHBondContact O-N 3.32Å; Y157-A159 VanDerWaalsContact C-N 3.34Å; Y157-A159 PolarHBondContact O-N 3.34Å; Y157-C160 PolarHBondContact O-N 2.92Å; Y157-M161 WeakPolarHBondContact O-CG 3.49Å; Y157-M161 PolarHBondContact O-N 3.16Å
158	M	96.1	Very high	93.8	Very high	111 Å²	111	76.2 Å²	76.2	55%	0.547	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-43.7	175.6	-69.4	-56.9	-59.1	0	0	111.5	R154 L155 A156 M161 V162	R154-M158 WeakPolarHBondContact O-CG 3.46Å; R154-M158 PolarHBondContact O-N 2.97Å; L155-M158 PolarHBondContact O-N 3.37Å; A156-M158 PolarHBondContact O-N 2.89Å; M158-M161 PolarHBondContact O-N 3.43Å; M158-V162 WeakPolarHBondContact O-CG2 3.34Å; M158-V162 PolarHBondContact O-N 2.87Å
159	A	96.4	Very high	94.6	Very high	27 Å²	27	74.9 Å²	74.9	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-42.6	175.8	0	0	0	0	0	112	W77 L155 A156 Y157 M161 V162 I163	W77-A159 HydrophobicContact CH2-CB 3.69Å; W77-A159 HydrophobicContact CZ3-CB 4.01Å; L155-A159 WeakPolarHBondContact O-CB 3.19Å; L155-A159 PolarHBondContact O-N 3.44Å; A156-A159 PolarHBondContact O-N 3.02Å; Y157-A159 VanDerWaalsContact C-N 3.34Å; Y157-A159 PolarHBondContact O-N 3.34Å; A159-M161 PolarHBondContact O-N 2.93Å; A159-V162 PolarHBondContact O-N 3.42Å; A159-I163 VanDerWaalsContact O-CG1 3.29Å; A159-I163 WeakPolarHBondContact O-CG1 3.29Å; A159-I163 PolarHBondContact O-N 3.15Å
160	C	96.8	Very high	95.1	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-57.8	-47.6	172.6	-72.2	0	0	0	0	111.4	W77 N80 A156 Y157 V162 I163 W164	W77-C160 VanDerWaalsContact CE3-SG 3.53Å; W77-C160 WeakPolarHBondContact CZ3-SG 3.25Å; N80-C160 PolarHBondContact ND2-SG 3.3Å; A156-C160 PolarHBondContact O-N 2.95Å; A156-C160 PolarHBondContact O-SG 3Å; A156-C160 VanDerWaalsContact O-SG 3.39Å; Y157-C160 PolarHBondContact O-N 2.92Å; C160-V162 VanDerWaalsContact C-N 3.3Å; C160-V162 PolarHBondContact O-N 2.86Å; C160-I163 WeakPolarHBondContact O-CA 3.35Å; C160-I163 WeakPolarHBondContact O-CB 3.3Å; C160-I163 PolarHBondContact O-N 3.44Å; C160-W164 PolarHBondContact O-N 3.31Å
161	M	97.1	Very high	95.6	Very high	118 Å²	118	66.5 Å²	66.5	58%	0.581	33%	0.325	S	S	*	.	H	α-helix	trans	-56.5	-43.7	177.4	-74	-61.4	-62.6	0	0	112.2	Y157 M158 A159 I163 W164 V165	Y157-M161 WeakPolarHBondContact O-CG 3.49Å; Y157-M161 PolarHBondContact O-N 3.16Å; M158-M161 PolarHBondContact O-N 3.43Å; A159-M161 PolarHBondContact O-N 2.93Å; M161-I163 VanDerWaalsContact C-N 3.34Å; M161-I163 PolarHBondContact O-N 3.49Å; M161-W164 PolarHBondContact O-N 2.94Å; M161-V165 VanDerWaalsContact O-CG2 3.31Å; M161-V165 WeakPolarHBondContact O-CG2 3.3Å; M161-V165 PolarHBondContact O-N 3.37Å
162	V	98	Very high	96	Very high	93 Å²	93	65.2 Å²	65.2	56%	0.564	33%	0.326	S	S	*	.	H	α-helix	trans	-61.2	-43.3	174.7	172.9	0	0	0	0	111.4	M158 A159 C160 V165 L166	M158-V162 WeakPolarHBondContact O-CG2 3.34Å; M158-V162 PolarHBondContact O-N 2.87Å; A159-V162 PolarHBondContact O-N 3.42Å; C160-V162 VanDerWaalsContact C-N 3.3Å; C160-V162 PolarHBondContact O-N 2.86Å; V162-V165 PolarHBondContact O-N 3.31Å; V162-L166 VanDerWaalsContact O-CB 3.29Å; V162-L166 WeakPolarHBondContact O-CB 3.09Å; V162-L166 PolarHBondContact O-N 3.47Å
163	I	98.2	Very high	96.1	Very high	10 Å²	10	64.4 Å²	64.4	5%	0.051	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-48.8	177	-70.3	167.3	0	0	0	111	T125 F128 L129 V132 A159 C160 M161 V165 L166 A167	T125-I163 HydrophobicContact CG2-CG2 4.25Å; F128-I163 HydrophobicContact CB-CB 4.46Å; F128-I163 HydrophobicContact CB-CD1 4.41Å; F128-I163 HydrophobicContact CB-CG1 4.08Å; F128-I163 HydrophobicContact CB-CG2 3.7Å; F128-I163 HydrophobicContact CD2-CG2 4.26Å; L129-I163 HydrophobicContact CD2-CD1 3.81Å; L129-I163 HydrophobicContact CG-CD1 4.24Å; L129-I163 HydrophobicContact CG-CG2 4.4Å; V132-I163 HydrophobicContact CB-CD1 4.36Å; V132-I163 HydrophobicContact CG2-CD1 3.95Å; A159-I163 VanDerWaalsContact O-CG1 3.29Å; A159-I163 WeakPolarHBondContact O-CG1 3.29Å; A159-I163 PolarHBondContact O-N 3.15Å; C160-I163 WeakPolarHBondContact O-CA 3.35Å; C160-I163 WeakPolarHBondContact O-CB 3.3Å; C160-I163 PolarHBondContact O-N 3.44Å; M161-I163 VanDerWaalsContact C-N 3.34Å; M161-I163 PolarHBondContact O-N 3.49Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 2.95Å; I163-L166 PolarHBondContact O-N 3.45Å; I163-A167 WeakPolarHBondContact O-CB 3.29Å; I163-A167 PolarHBondContact O-N 2.99Å
164	W	97.9	Very high	96.3	Very high	53 Å²	53	62.5 Å²	62.5	20%	0.201	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-43.5	-179.8	-81.8	96.4	0	0	0	111.7	N80 V83 A84 H121 T125 C160 M161 F168	N80-W164 PolarHBondContact OD1-NE1 2.87Å; V83-W164 HydrophobicContact CG1-CH2 4.08Å; V83-W164 HydrophobicContact CG1-CZ2 3.95Å; A84-W164 HydrophobicContact CB-CH2 4.19Å; A84-W164 HydrophobicContact CB-CZ2 4.25Å; H121-W164 AromaticContact CD2-CZ3 3.98Å; H121-W164 AromaticContact CE1-CE3 3.89Å; H121-W164 AromaticContact NE2-CE3 3.15Å; H121-W164 AromaticContact NE2-CZ3 3.22Å; H121-W164 WeakPolarHBondContact NE2-CZ3 3.25Å; T125-W164 HydrophobicContact CG2-CD2 4.47Å; T125-W164 HydrophobicContact CG2-CZ2 4.33Å; C160-W164 PolarHBondContact O-N 3.31Å; M161-W164 PolarHBondContact O-N 2.94Å; W164-F168 WeakPolarHBondContact O-CB 3.21Å; W164-F168 PolarHBondContact O-N 3.49Å
165	V	98.1	Very high	96.4	Very high	72 Å²	72	55.3 Å²	55.3	44%	0.436	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-46.5	177.2	171.5	0	0	0	0	111.1	M161 V162 I163 A167 F168 F169	M161-V165 VanDerWaalsContact O-CG2 3.31Å; M161-V165 WeakPolarHBondContact O-CG2 3.3Å; M161-V165 PolarHBondContact O-N 3.37Å; V162-V165 PolarHBondContact O-N 3.31Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 2.95Å; V165-A167 PolarHBondContact O-N 3.28Å; V165-F168 WeakPolarHBondContact O-CB 3.47Å; V165-F168 PolarHBondContact O-N 3Å; V165-F169 HydrophobicContact CG1-CD2 3.79Å; V165-F169 HydrophobicContact CG1-CE2 3.43Å; V165-F169 VanDerWaalsContact CG1-CE2 3.43Å; V165-F169 WeakPolarHBondContact O-CD2 3.12Å; V165-F169 PolarHBondContact O-N 2.88Å; V165-F169 VanDerWaalsContact O-N 3.08Å
166	L	97.9	Very high	96.4	Very high	81 Å²	81	54.4 Å²	54.4	42%	0.424	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-44	178	-178.6	61.2	0	0	0	111.6	F128 V162 I163 F168 F169 L170	F128-L166 HydrophobicContact CD2-CD2 4.19Å; F128-L166 HydrophobicContact CD2-CG 4.49Å; F128-L166 HydrophobicContact CE2-CB 4.42Å; F128-L166 HydrophobicContact CE2-CD2 3.7Å; F128-L166 HydrophobicContact CE2-CG 3.79Å; F128-L166 HydrophobicContact CZ-CD2 4.02Å; F128-L166 HydrophobicContact CZ-CG 4.34Å; V162-L166 VanDerWaalsContact O-CB 3.29Å; V162-L166 WeakPolarHBondContact O-CB 3.09Å; V162-L166 PolarHBondContact O-N 3.47Å; I163-L166 PolarHBondContact O-N 3.45Å; L166-F168 VanDerWaalsContact C-N 3.31Å; L166-F168 PolarHBondContact O-N 3.29Å; L166-F169 PolarHBondContact O-N 3.39Å; L166-L170 HydrophobicContact CD1-CD1 4.13Å; L166-L170 HydrophobicContact CD1-CG 4.31Å; L166-L170 HydrophobicContact CG-CD1 4.04Å; L166-L170 WeakPolarHBondContact O-CG 3.13Å; L166-L170 PolarHBondContact O-N 3.09Å
167	A	98	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-37.3	175.6	0	0	0	0	0	111.8	H121 F124 T125 I163 V165 S171	H121-A167 PolarHBondContact ND1-O 3.01Å; F124-A167 HydrophobicContact CB-CB 3.68Å; T125-A167 WeakPolarHBondContact OG1-CB 3.4Å; I163-A167 WeakPolarHBondContact O-CB 3.29Å; I163-A167 PolarHBondContact O-N 2.99Å; V165-A167 PolarHBondContact O-N 3.28Å; A167-S171 VanDerWaalsContact O-CB 3.25Å; A167-S171 WeakPolarHBondContact O-CB 3.15Å; A167-S171 PolarHBondContact O-N 3.42Å; A167-S171 PolarHBondContact O-OG 3.02Å
168	F	97.6	Very high	96.2	Very high	96 Å²	96	53.3 Å²	53.3	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-50	173.7	177.5	-86.1	0	0	0	111.2	F117 H121 W164 V165 L166 L170 S171 S172	F117-F168 HydrophobicContact CE2-CD2 4.07Å; F117-F168 HydrophobicContact CE2-CE2 4.26Å; F117-F168 AromaticContact CZ-CD2 3.53Å; F117-F168 HydrophobicContact CZ-CD2 3.53Å; F117-F168 AromaticContact CZ-CE2 3.87Å; F117-F168 HydrophobicContact CZ-CE2 3.87Å; F117-F168 HydrophobicContact CZ-CG 4.36Å; H121-F168 PolarHBondContact ND1-N 3.5Å; W164-F168 WeakPolarHBondContact O-CB 3.21Å; W164-F168 PolarHBondContact O-N 3.49Å; V165-F168 WeakPolarHBondContact O-CB 3.47Å; V165-F168 PolarHBondContact O-N 3Å; L166-F168 VanDerWaalsContact C-N 3.31Å; L166-F168 PolarHBondContact O-N 3.29Å; F168-L170 PolarHBondContact O-N 3.49Å; F168-S171 PolarHBondContact O-N 3.25Å; F168-S172 WeakPolarHBondContact O-CB 3.46Å; F168-S172 PolarHBondContact O-N 2.73Å
169	F	97.4	Very high	95.9	Very high	130 Å²	130	49.4 Å²	49.4	57%	0.57	26%	0.26	S	S	*	.	H	α-helix	trans	-63	-44.8	-179.3	-75.3	-62.5	0	0	0	112.5	V165 L166 S171 S172	V165-F169 HydrophobicContact CG1-CD2 3.79Å; V165-F169 HydrophobicContact CG1-CE2 3.43Å; V165-F169 VanDerWaalsContact CG1-CE2 3.43Å; V165-F169 WeakPolarHBondContact O-CD2 3.12Å; V165-F169 PolarHBondContact O-N 2.88Å; V165-F169 VanDerWaalsContact O-N 3.08Å; L166-F169 PolarHBondContact O-N 3.39Å; F169-S171 VanDerWaalsContact C-N 3.28Å; F169-S171 PolarHBondContact O-N 2.79Å; F169-S172 WeakPolarHBondContact O-CB 3.41Å; F169-S172 PolarHBondContact O-N 3.32Å; F169-S172 PolarHBondContact O-OG 3.24Å
170	L	97.1	Very high	95.5	Very high	42 Å²	42	49.2 Å²	49.2	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-26.4	179.1	-67.7	174.1	0	0	0	113.2	F124 F128 L166 F168 P173 T223 C227	F124-L170 HydrophobicContact CD1-CB 4.38Å; F124-L170 HydrophobicContact CD1-CD1 3.97Å; F124-L170 HydrophobicContact CD2-CB 3.76Å; F124-L170 HydrophobicContact CE1-CB 4.14Å; F124-L170 HydrophobicContact CE1-CD1 3.86Å; F124-L170 HydrophobicContact CE2-CB 3.48Å; F124-L170 VanDerWaalsContact CE2-CB 3.48Å; F124-L170 HydrophobicContact CG-CB 4.21Å; F124-L170 HydrophobicContact CG-CD1 4.42Å; F124-L170 HydrophobicContact CZ-CB 3.69Å; F124-L170 HydrophobicContact CZ-CD1 4.23Å; F124-L170 HydrophobicContact CZ-CG 4.49Å; F128-L170 HydrophobicContact CE2-CD1 3.79Å; F128-L170 HydrophobicContact CZ-CD1 3.53Å; L166-L170 HydrophobicContact CD1-CD1 4.13Å; L166-L170 HydrophobicContact CD1-CG 4.31Å; L166-L170 HydrophobicContact CG-CD1 4.04Å; L166-L170 WeakPolarHBondContact O-CG 3.13Å; L166-L170 PolarHBondContact O-N 3.09Å; F168-L170 PolarHBondContact O-N 3.49Å; L170-P173 WeakPolarHBondContact O-CD 3.34Å; L170-T223 HydrophobicContact CD2-CG2 4.05Å; L170-C227 HydrophobicContact CD1-CB 4.08Å
171	S	97.1	Very high	95	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-85	-23.6	173.9	-62.9	0	0	0	0	113.8	F117 I120 H121 A167 F168 F169 P173 S174	F117-S171 VanDerWaalsContact CE2-CB 3.46Å; I120-S171 WeakPolarHBondContact CG2-OG 3.21Å; I120-S171 PolarHBondContact O-OG 2.89Å; H121-S171 WeakPolarHBondContact CA-OG 3.11Å; H121-S171 PolarHBondContact N-OG 3.32Å; A167-S171 VanDerWaalsContact O-CB 3.25Å; A167-S171 WeakPolarHBondContact O-CB 3.15Å; A167-S171 PolarHBondContact O-N 3.42Å; A167-S171 PolarHBondContact O-OG 3.02Å; F168-S171 PolarHBondContact O-N 3.25Å; F169-S171 VanDerWaalsContact C-N 3.28Å; F169-S171 PolarHBondContact O-N 2.79Å; S171-P173 VanDerWaalsContact C-N 3.28Å; S171-P173 WeakPolarHBondContact O-CD 3.3Å; S171-P173 VanDerWaalsContact O-N 3.1Å; S171-S174 PolarHBondContact O-N 3.26Å; S171-S174 PolarHBondContact O-OG 3.45Å
172	S	96.6	Very high	94.4	Very high	38 Å²	38	50 Å²	50	27%	0.266	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-29.8	-175.4	72	0	0	0	0	116.2	F168 F169 S174 L175	F168-S172 WeakPolarHBondContact O-CB 3.46Å; F168-S172 PolarHBondContact O-N 2.73Å; F169-S172 WeakPolarHBondContact O-CB 3.41Å; F169-S172 PolarHBondContact O-N 3.32Å; F169-S172 PolarHBondContact O-OG 3.24Å; S172-S174 PolarHBondContact O-N 3.12Å; S172-S174 VanDerWaalsContact O-N 3.11Å; S172-L175 WeakPolarHBondContact O-CB 3.3Å; S172-L175 PolarHBondContact O-N 3.32Å
173	P	95.1	Very high	93.5	Very high	35 Å²	35	48.6 Å²	48.6	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-29	174.8	-27.7	37.6	0	0	0	113.6	L170 S171 L175 V176 F177 V220	L170-P173 WeakPolarHBondContact O-CD 3.34Å; S171-P173 VanDerWaalsContact C-N 3.28Å; S171-P173 WeakPolarHBondContact O-CD 3.3Å; S171-P173 VanDerWaalsContact O-N 3.1Å; P173-L175 VanDerWaalsContact C-N 3.26Å; P173-L175 PolarHBondContact O-N 2.81Å; P173-V176 PolarHBondContact O-N 2.74Å; P173-V176 VanDerWaalsContact O-N 3.16Å; P173-F177 HydrophobicContact CB-CD2 3.87Å; P173-F177 HydrophobicContact CB-CE2 4Å; P173-F177 WeakPolarHBondContact O-CD2 3.09Å; P173-F177 PolarHBondContact O-N 2.94Å; P173-V220 HydrophobicContact CB-CG1 4.26Å; P173-V220 HydrophobicContact CB-CG2 3.88Å; P173-V220 HydrophobicContact CG-CG2 4.4Å
174	S	92.9	Very high	92.6	Very high	5 Å²	5	57.1 Å²	57.1	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-25.1	176.3	69.4	0	0	0	0	113.1	N116 F117 S171 S172 V176 R178	N116-S174 WeakPolarHBondContact OD1-CB 3.44Å; F117-S174 WeakPolarHBondContact CA-OG 3.3Å; F117-S174 WeakPolarHBondContact CB-OG 3.19Å; F117-S174 PolarHBondContact N-OG 3.02Å; S171-S174 PolarHBondContact O-N 3.26Å; S171-S174 PolarHBondContact O-OG 3.45Å; S172-S174 PolarHBondContact O-N 3.12Å; S172-S174 VanDerWaalsContact O-N 3.11Å; S174-V176 VanDerWaalsContact C-N 3.27Å; S174-R178 WeakPolarHBondContact O-CB 3.2Å; S174-R178 WeakPolarHBondContact O-CG 3.24Å; S174-R178 PolarHBondContact O-N 3.21Å
175	L	95.1	Very high	91.8	Very high	55 Å²	55	57.5 Å²	57.5	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-73.8	-24	174.8	-62.7	174.4	0	0	0	112	K113 F117 S172 P173	K113-L175 HydrophobicContact CB-CD2 4.15Å; K113-L175 WeakPolarHBondContact CD-O 3.41Å; K113-L175 WeakPolarHBondContact CE-O 3.16Å; K113-L175 PolarHBondContact NZ-O 3.03Å; F117-L175 HydrophobicContact CB-CD2 3.59Å; F117-L175 HydrophobicContact CB-CG 4.02Å; F117-L175 HydrophobicContact CD2-CD1 3.81Å; F117-L175 HydrophobicContact CD2-CD2 4.16Å; F117-L175 HydrophobicContact CD2-CG 3.74Å; F117-L175 HydrophobicContact CE2-CD1 4.12Å; F117-L175 HydrophobicContact CG-CD1 4.24Å; F117-L175 HydrophobicContact CG-CD2 3.87Å; F117-L175 HydrophobicContact CG-CG 4Å; S172-L175 WeakPolarHBondContact O-CB 3.3Å; S172-L175 PolarHBondContact O-N 3.32Å; P173-L175 VanDerWaalsContact C-N 3.26Å; P173-L175 PolarHBondContact O-N 2.81Å
176	V	93.3	Very high	91.1	Very high	78 Å²	78	57 Å²	57	47%	0.473	31%	0.306	S	S	.	.	H	α-helix	trans	-90.3	-52.6	179.9	-177.8	0	0	0	0	110.3	P173 S174 L195	P173-V176 PolarHBondContact O-N 2.74Å; P173-V176 VanDerWaalsContact O-N 3.16Å; S174-V176 VanDerWaalsContact C-N 3.27Å; V176-L195 HydrophobicContact CG1-CD2 4.35Å
177	F	91.2	Very high	90.7	Very high	30 Å²	30	56 Å²	56	13%	0.132	30%	0.301	C	S	.	.	H	α-helix	trans	-92.6	-5.2	-168.2	-57.6	-58.5	0	0	0	114.7	P173 N192 F193 L195 R216 V220	P173-F177 HydrophobicContact CB-CD2 3.87Å; P173-F177 HydrophobicContact CB-CE2 4Å; P173-F177 WeakPolarHBondContact O-CD2 3.09Å; P173-F177 PolarHBondContact O-N 2.94Å; F177-N192 PolarHBondContact O-N 3.47Å; F177-F193 HydrophobicContact CB-CD1 3.87Å; F177-F193 HydrophobicContact CB-CE1 3.93Å; F177-F193 HydrophobicContact CD1-CD1 4.11Å; F177-F193 HydrophobicContact CD2-CD1 4Å; F177-F193 AromaticContact CD2-CE1 3.96Å; F177-F193 HydrophobicContact CD2-CE1 3.96Å; F177-F193 AromaticContact CG-CD1 3.73Å; F177-F193 HydrophobicContact CG-CD1 3.73Å; F177-F193 AromaticContact CG-CE1 4Å; F177-F193 HydrophobicContact CG-CE1 4Å; F177-L195 HydrophobicContact CD1-CD2 3.83Å; F177-L195 HydrophobicContact CD1-CG 4.38Å; F177-L195 HydrophobicContact CE1-CD1 4.42Å; F177-L195 HydrophobicContact CE1-CD2 4.13Å; F177-L195 HydrophobicContact CE1-CG 4.32Å; F177-R216 HydrophobicContact CZ-CB 4.42Å; F177-R216 HydrophobicContact CZ-CG 4.35Å; F177-V220 HydrophobicContact CD2-CG2 4.2Å; F177-V220 HydrophobicContact CE2-CG2 4Å
178	R	91.1	Very high	90.2	Very high	42 Å²	42	57.6 Å²	57.6	16%	0.158	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	135.3	170.4	-69.9	-65.4	-116.4	-177.1	7.4	110.7	K113 N116 S174 N191	K113-R178 WeakPolarHBondContact CE-O 3.1Å; K113-R178 HydrophobicContact CG-CB 3.99Å; K113-R178 WeakPolarHBondContact CG-O 3.23Å; N116-R178 HydrophobicContact CB-CG 3.94Å; N116-R178 PolarHBondContact ND2-NE 3.07Å; N116-R178 PolarHBondContact ND2-NH2 3.43Å; N116-R178 VanDerWaalsContact ND2-NH2 3.17Å; S174-R178 WeakPolarHBondContact O-CB 3.2Å; S174-R178 WeakPolarHBondContact O-CG 3.24Å; S174-R178 PolarHBondContact O-N 3.21Å; R178-N191 VanDerWaalsContact CD-OD1 3.29Å; R178-N191 WeakPolarHBondContact CD-OD1 3.43Å; R178-N191 PolarHBondContact NH1-OD1 3.47Å
179	D	90.4	Very high	89.8	Confident	30 Å²	30	53.6 Å²	53.6	16%	0.16	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	170.3	179.3	-152.9	-2.5	0	0	0	111.8	T109 C189 F190 N192	T109-D179 WeakPolarHBondContact CG2-OD1 3.25Å; D179-C189 WeakPolarHBondContact O-CA 3.47Å; D179-F190 HydrophobicContact CB-CE1 4.26Å; D179-F190 PolarHBondContact N-O 2.89Å; D179-F190 WeakPolarHBondContact O-CD1 3.33Å; D179-F190 PolarHBondContact O-N 3.4Å; D179-N192 HydrophobicContact CB-CB 3.72Å; D179-N192 PolarHBondContact OD2-ND2 3.49Å; D179-N192 VanDerWaalsContact OD2-ND2 3.1Å
180	T	88.9	Confident	89.4	Confident	22 Å²	22	50.9 Å²	50.9	14%	0.135	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.7	178.6	50.3	0	0	0	0	110.7	W105 T109 C112 I187 S188	W105-T180 HydrophobicContact CG-CG2 4.45Å; T109-T180 PolarHBondContact OG1-OG1 2.97Å; C112-T180 HydrophobicContact CB-CG2 3.87Å; T180-I187 HydrophobicContact CG2-CG2 4.28Å; T180-S188 VanDerWaalsContact CA-O 3.28Å; T180-S188 WeakPolarHBondContact CA-O 3.02Å
181	A	85.3	Confident	88.9	Confident	26 Å²	26	51.1 Å²	51.1	22%	0.215	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.4	173.8	0	0	0	0	0	110.8	I187 S188 F190	A181-I187 CarbonylContact O-C 3.23Å; A181-I187 WeakPolarHBondContact O-CA 3.31Å; A181-S188 PolarHBondContact N-O 3.28Å; A181-S188 PolarHBondContact O-N 3.49Å; A181-F190 HydrophobicContact CB-CD1 3.94Å; A181-F190 HydrophobicContact CB-CE1 3.25Å; A181-F190 HydrophobicContact CB-CZ 3.88Å
182	N	84.9	Confident	88.5	Confident	111 Å²	111	51.5 Å²	51.5	59%	0.594	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	113	172.2	-170.3	-25.7	0	0	0	109.3	G185 K186	N182-G185 VanDerWaalsContact OD1-CA 3.28Å; N182-G185 WeakPolarHBondContact OD1-CA 3.37Å; N182-G185 PolarHBondContact OD1-N 3.45Å; N182-K186 PolarHBondContact OD1-N 2.79Å
183	L	78.8	Confident	88.1	Confident	64 Å²	64	50.6 Å²	50.6	34%	0.335	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	109.8	171.3	-114.1	74.5	0	0	0	108.5	G185 K186 W203	L183-G185 VanDerWaalsContact C-N 3.28Å; L183-G185 PolarHBondContact O-N 3.42Å; L183-G185 VanDerWaalsContact O-N 3.16Å; L183-K186 PolarHBondContact N-O 3.36Å; L183-K186 WeakPolarHBondContact O-CA 3.36Å; L183-K186 WeakPolarHBondContact O-CB 3.41Å; L183-K186 PolarHBondContact O-N 3.02Å; L183-W203 HydrophobicContact CD2-CZ2 4.02Å
184	H	79.9	Confident	87.6	Confident	188 Å²	188	51.3 Å²	51.3	87%	0.87	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	42.7	172.3	-54.2	106.2	0	0	0	114.3
185	G	80.5	Confident	87.1	Confident	61 Å²	61	55 Å²	55	63%	0.629	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	1.2	-179	0	0	0	0	0	114.5	N182 L183	N182-G185 VanDerWaalsContact OD1-CA 3.28Å; N182-G185 WeakPolarHBondContact OD1-CA 3.37Å; N182-G185 PolarHBondContact OD1-N 3.45Å; L183-G185 VanDerWaalsContact C-N 3.28Å; L183-G185 PolarHBondContact O-N 3.42Å; L183-G185 VanDerWaalsContact O-N 3.16Å
186	K	84.7	Confident	86.1	Confident	61 Å²	61	55.2 Å²	55.2	27%	0.265	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.8	-178.2	-179.3	169	174.7	-170.3	0	111.4	D102 Y103 H104 N182 L183 S188	D102-K186 WeakPolarHBondContact O-CE 3.43Å; D102-K186 PolarHBondContact O-NZ 3.25Å; D102-K186 IonicContact OD2-NZ 3.89Å; D102-K186 PolarHBondContact OD2-NZ 3.2Å; Y103-K186 VanDerWaalsContact O-CE 3.27Å; Y103-K186 WeakPolarHBondContact O-CE 3.36Å; H104-K186 HydrophobicContact CB-CD 4.47Å; H104-K186 HydrophobicContact CB-CG 3.95Å; H104-K186 WeakPolarHBondContact ND1-CA 3.49Å; H104-K186 WeakPolarHBondContact ND1-CG 3.38Å; N182-K186 PolarHBondContact OD1-N 2.79Å; L183-K186 PolarHBondContact N-O 3.36Å; L183-K186 WeakPolarHBondContact O-CA 3.36Å; L183-K186 WeakPolarHBondContact O-CB 3.41Å; L183-K186 PolarHBondContact O-N 3.02Å; K186-S188 PolarHBondContact O-N 3.4Å
187	I	89.1	Confident	84.7	Confident	62 Å²	62	56.6 Å²	56.6	32%	0.318	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	122.6	176.9	-55.9	174.2	0	0	0	108.4	H104 W105 T180 A181	H104-I187 PolarHBondContact CE1-N 2.93Å; H104-I187 PolarHBondContact ND1-N 2.95Å; H104-I187 VanDerWaalsContact ND1-N 3.18Å; W105-I187 HydrophobicContact CB-CG2 4.25Å; W105-I187 PolarHBondContact N-O 3.13Å; W105-I187 WeakPolarHBondContact O-CB 3.46Å; W105-I187 WeakPolarHBondContact O-CG2 3.31Å; T180-I187 HydrophobicContact CG2-CG2 4.28Å; A181-I187 CarbonylContact O-C 3.23Å; A181-I187 WeakPolarHBondContact O-CA 3.31Å
188	S	86.7	Confident	82.9	Confident	32 Å²	32	60 Å²	60	22%	0.224	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.5	175.9	-177.2	0	0	0	0	110.7	T180 A181 K186	T180-S188 VanDerWaalsContact CA-O 3.28Å; T180-S188 WeakPolarHBondContact CA-O 3.02Å; A181-S188 PolarHBondContact N-O 3.28Å; A181-S188 PolarHBondContact O-N 3.49Å; K186-S188 PolarHBondContact O-N 3.4Å
189	C	90.4	Very high	81.1	Confident	13 Å²	13	61.4 Å²	61.4	9%	0.088	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	108.4	174.4	172.8	0	0	0	0	109.2	W105 C112 D179	W105-C189 HydrophobicContact CB-CB 4.31Å; W105-C189 HydrophobicContact CD2-CB 3.9Å; W105-C189 HydrophobicContact CE3-CB 3.95Å; W105-C189 HydrophobicContact CG-CB 4.02Å; C112-C189 VanDerWaalsContact CA-SG 3.59Å; C112-C189 HydrophobicContact CB-CB 3.87Å; C112-C189 WeakPolarHBondContact CB-SG 3.48Å; C112-C189 WeakPolarHBondContact SG-CB 3.48Å; C112-C189 CovalentContact SG-SG 2.03Å; C112-C189 PolarHBondContact SG-SG 3.35Å; D179-C189 WeakPolarHBondContact O-CA 3.47Å
190	F	87.4	Confident	79.4	Confident	72 Å²	72	63.9 Å²	63.9	32%	0.316	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	173.3	-168.2	76.9	-72.9	0	0	0	112.6	D179 A181 N192	D179-F190 HydrophobicContact CB-CE1 4.26Å; D179-F190 PolarHBondContact N-O 2.89Å; D179-F190 WeakPolarHBondContact O-CD1 3.33Å; D179-F190 PolarHBondContact O-N 3.4Å; A181-F190 HydrophobicContact CB-CD1 3.94Å; A181-F190 HydrophobicContact CB-CE1 3.25Å; A181-F190 HydrophobicContact CB-CZ 3.88Å; F190-N192 HydrophobicContact CE2-CB 3.93Å; F190-N192 HydrophobicContact CZ-CB 4.02Å
191	N	87.8	Confident	77.3	Confident	48 Å²	48	68.4 Å²	68.4	26%	0.257	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	115.6	175.5	-62.1	-45.8	0	0	0	110.3	R178 F193	R178-N191 VanDerWaalsContact CD-OD1 3.29Å; R178-N191 WeakPolarHBondContact CD-OD1 3.43Å; R178-N191 PolarHBondContact NH1-OD1 3.47Å; N191-F193 HydrophobicContact CB-CD2 3.93Å; N191-F193 HydrophobicContact CB-CE2 3.54Å; N191-F193 HydrophobicContact CB-CZ 4.19Å
192	N	88.7	Confident	75.1	Confident	8 Å²	8	71.7 Å²	71.7	4%	0.043	44%	0.444	C	S	.	.			trans	-106.4	73.1	176.6	-173	2.5	0	0	0	110.1	F177 D179 F190 S194 L195 S196	F177-N192 PolarHBondContact O-N 3.47Å; D179-N192 HydrophobicContact CB-CB 3.72Å; D179-N192 PolarHBondContact OD2-ND2 3.49Å; D179-N192 VanDerWaalsContact OD2-ND2 3.1Å; F190-N192 HydrophobicContact CE2-CB 3.93Å; F190-N192 HydrophobicContact CZ-CB 4.02Å; N192-S194 VanDerWaalsContact C-N 3.28Å; N192-S194 PolarHBondContact O-N 3.32Å; N192-S194 PolarHBondContact OD1-OG 3.43Å; N192-L195 PolarHBondContact O-N 3.08Å; N192-L195 WeakPolarHBondContact OD1-CA 3.01Å; N192-L195 PolarHBondContact OD1-N 3.24Å; N192-S196 PolarHBondContact ND2-N 3.24Å; N192-S196 PolarHBondContact ND2-O 3.23Å; N192-S196 PolarHBondContact OD1-N 2.92Å
193	F	87.1	Confident	73.1	Confident	20 Å²	20	75.2 Å²	75.2	9%	0.088	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.4	178.9	-68	-68.3	0	0	0	113.4	F177 N191 L195 G213 R216 H217 V220	F177-F193 HydrophobicContact CB-CD1 3.87Å; F177-F193 HydrophobicContact CB-CE1 3.93Å; F177-F193 HydrophobicContact CD1-CD1 4.11Å; F177-F193 HydrophobicContact CD2-CD1 4Å; F177-F193 AromaticContact CD2-CE1 3.96Å; F177-F193 HydrophobicContact CD2-CE1 3.96Å; F177-F193 AromaticContact CG-CD1 3.73Å; F177-F193 HydrophobicContact CG-CD1 3.73Å; F177-F193 AromaticContact CG-CE1 4Å; F177-F193 HydrophobicContact CG-CE1 4Å; N191-F193 HydrophobicContact CB-CD2 3.93Å; N191-F193 HydrophobicContact CB-CE2 3.54Å; N191-F193 HydrophobicContact CB-CZ 4.19Å; F193-L195 VanDerWaalsContact C-N 3.26Å; F193-L195 PolarHBondContact O-N 3.47Å; F193-G213 WeakPolarHBondContact CB-O 3.37Å; F193-R216 HydrophobicContact CB-CB 4.45Å; F193-R216 HydrophobicContact CD1-CB 4.32Å; F193-R216 VanDerWaalsContact O-CD 3.29Å; F193-R216 WeakPolarHBondContact O-CD 3.47Å; F193-R216 PolarHBondContact O-NH1 3.11Å; F193-R216 VanDerWaalsContact O-NH1 3.16Å; F193-H217 HydrophobicContact CB-CB 4.21Å; F193-H217 HydrophobicContact CD1-CB 4.26Å; F193-H217 HydrophobicContact CD2-CB 3.49Å; F193-H217 VanDerWaalsContact CD2-CB 3.49Å; F193-H217 AromaticContact CD2-CD2 3.73Å; F193-H217 AromaticContact CD2-CG 3.52Å; F193-H217 HydrophobicContact CE2-CB 3.81Å; F193-H217 AromaticContact CE2-CD2 3.1Å; F193-H217 WeakPolarHBondContact CE2-CD2 3.48Å; F193-H217 AromaticContact CE2-CG 3.43Å; F193-H217 VanDerWaalsContact CE2-CG 3.43Å; F193-H217 AromaticContact CE2-NE2 3.72Å; F193-H217 HydrophobicContact CG-CB 3.73Å; F193-H217 HydrophobicContact CZ-CB 4.32Å; F193-H217 AromaticContact CZ-CD2 3.55Å; F193-V220 HydrophobicContact CE1-CB 4.1Å; F193-V220 HydrophobicContact CE1-CG1 4.27Å; F193-V220 HydrophobicContact CE1-CG2 4.18Å; F193-V220 HydrophobicContact CZ-CG1 4.48Å
194	S	85	Confident	71.4	Confident	49 Å²	49	77 Å²	77	34%	0.343	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.9	173.6	55.6	0	0	0	0	113.2	N192 S196 D210	N192-S194 VanDerWaalsContact C-N 3.28Å; N192-S194 PolarHBondContact O-N 3.32Å; N192-S194 PolarHBondContact OD1-OG 3.43Å; S194-S196 WeakPolarHBondContact CB-OG 3.2Å; S194-S196 PolarHBondContact O-N 3.17Å; S194-S196 PolarHBondContact OG-OG 3.36Å; S194-D210 VanDerWaalsContact CA-OD2 3.23Å; S194-D210 WeakPolarHBondContact CA-OD2 2.95Å; S194-D210 WeakPolarHBondContact CB-OD2 3.28Å
195	L	82.9	Confident	69.3	Low	82 Å²	82	72.1 Å²	72.1	43%	0.429	46%	0.457	S	S	.	.			trans	53.1	35.6	-174.2	-59.9	175.8	0	0	0	112.4	V176 F177 N192 F193	V176-L195 HydrophobicContact CG1-CD2 4.35Å; F177-L195 HydrophobicContact CD1-CD2 3.83Å; F177-L195 HydrophobicContact CD1-CG 4.38Å; F177-L195 HydrophobicContact CE1-CD1 4.42Å; F177-L195 HydrophobicContact CE1-CD2 4.13Å; F177-L195 HydrophobicContact CE1-CG 4.32Å; N192-L195 PolarHBondContact O-N 3.08Å; N192-L195 WeakPolarHBondContact OD1-CA 3.01Å; N192-L195 PolarHBondContact OD1-N 3.24Å; F193-L195 VanDerWaalsContact C-N 3.26Å; F193-L195 PolarHBondContact O-N 3.47Å
196	S	74	Confident	67.4	Low	61 Å²	61	77 Å²	77	43%	0.427	46%	0.463	S	S	.	.			trans	-72.5	140.6	-179.4	-52.7	0	0	0	0	110.5	N192 S194	N192-S196 PolarHBondContact ND2-N 3.24Å; N192-S196 PolarHBondContact ND2-O 3.23Å; N192-S196 PolarHBondContact OD1-N 2.92Å; S194-S196 WeakPolarHBondContact CB-OG 3.2Å; S194-S196 PolarHBondContact O-N 3.17Å; S194-S196 PolarHBondContact OG-OG 3.36Å
197	T	63.5	Low	65.5	Low	106 Å²	106	79.6 Å²	79.6	65%	0.65	49%	0.489	S	S	*	.			trans	-69	137.1	-177.9	42	0	0	0	0	112.5	G199 S200	T197-G199 PolarHBondContact O-N 3.37Å; T197-G199 VanDerWaalsContact O-N 3.15Å; T197-S200 PolarHBondContact O-OG 2.95Å
198	P	53.2	Low	63.6	Low	101 Å²	101	85.4 Å²	85.4	66%	0.656	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	112.8	175.4	26.3	-33.2	0	0	0	110.3
199	G	53.5	Low	62.3	Low	72 Å²	72	90.8 Å²	90.8	74%	0.742	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	131	-14.1	177.1	0	0	0	0	0	115.6	T197 S201	T197-G199 PolarHBondContact O-N 3.37Å; T197-G199 VanDerWaalsContact O-N 3.15Å; G199-S201 PolarHBondContact O-N 3.28Å
200	S	54.9	Low	61.7	Low	83 Å²	83	93.2 Å²	93.2	58%	0.58	55%	0.55	S	S	*	*			trans	-81.2	69.5	166.8	59	0	0	0	0	109.2	T197 S202	T197-S200 PolarHBondContact O-OG 2.95Å; S200-S202 PolarHBondContact O-N 3.29Å; S200-S202 VanDerWaalsContact O-N 3.07Å
201	S	44.8	Very low	61.5	Low	116 Å²	116	94 Å²	94	81%	0.811	56%	0.563	S	S	*	*			trans	-71.1	100.9	-177.5	54.6	0	0	0	0	111.5	G199	G199-S201 PolarHBondContact O-N 3.28Å
202	S	39.2	Very low	61.4	Low	95 Å²	95	95.3 Å²	95.3	66%	0.664	57%	0.572	S	S	*	*				-150.6	131.6	123.3	56.3	0	0	0	0	106.1	S200	S200-S202 PolarHBondContact O-N 3.29Å; S200-S202 VanDerWaalsContact O-N 3.07Å
203	W	42.6	Very low	61.3	Low	185 Å²	185	95.2 Å²	95.2	70%	0.701	57%	0.573	S	S	*	*			trans	-40.2	143	150.3	-88.3	69.7	0	0	0	108.5	L183 A205	L183-W203 HydrophobicContact CD2-CZ2 4.02Å; W203-A205 PolarHBondContact O-N 3.43Å
204	P	42.9	Very low	61.4	Low	101 Å²	101	98 Å²	98	66%	0.656	58%	0.584	S	S	*	*			trans	-67	85.2	-172.1	28.1	-32.7	0	0	0	109.6	H206	P204-H206 PolarHBondContact O-N 2.99Å
205	A	37.5	Very low	61.6	Low	86 Å²	86	98.3 Å²	98.3	71%	0.711	59%	0.586	S	S	*	*	S	Bend	trans	-70.7	-4	165	0	0	0	0	0	110.6	W203	W203-A205 PolarHBondContact O-N 3.43Å
206	H	39.4	Very low	62.1	Low	163 Å²	163	98.5 Å²	98.5	76%	0.755	58%	0.581	S	S	*	*	S	Bend	trans	-133.4	118.3	159.3	-81.8	-77.2	0	0	0	110	P204 Q208	P204-H206 PolarHBondContact O-N 2.99Å; H206-Q208 PolarHBondContact O-N 2.95Å
207	S	44.8	Very low	62.9	Low	117 Å²	117	96.9 Å²	96.9	82%	0.818	57%	0.566	S	S	*	*			trans	-59.1	66.8	172	43.8	0	0	0	0	113.2	M209	S207-M209 PolarHBondContact O-N 3.49Å
208	Q	50.3	Low	64.3	Low	183 Å²	183	95.2 Å²	95.2	86%	0.855	55%	0.552	S	S	*	*			trans	-83	99.3	151	-78.8	-166.5	53.5	0	0	107.6	H206 D210	H206-Q208 PolarHBondContact O-N 2.95Å; Q208-D210 PolarHBondContact O-N 3.42Å
209	M	58.7	Low	66.2	Low	146 Å²	146	94.5 Å²	94.5	72%	0.719	55%	0.546	S	S	*	.			trans	-61	103.9	175.1	-164.9	168.1	-177.9	0	0	107.8	S207 P211	S207-M209 PolarHBondContact O-N 3.49Å; M209-P211 WeakPolarHBondContact O-CD 3.48Å
210	D	77.4	Confident	68.2	Low	63 Å²	63	92 Å²	92	34%	0.337	52%	0.516	S	S	.	.			trans	-65.9	100.9	171.8	172	10.4	0	0	0	108.2	S194 Q208 V212 G213 Y214	S194-D210 VanDerWaalsContact CA-OD2 3.23Å; S194-D210 WeakPolarHBondContact CA-OD2 2.95Å; S194-D210 WeakPolarHBondContact CB-OD2 3.28Å; Q208-D210 PolarHBondContact O-N 3.42Å; D210-V212 PolarHBondContact O-N 3.24Å; D210-V212 PolarHBondContact OD1-N 3.04Å; D210-V212 VanDerWaalsContact OD1-N 3.1Å; D210-G213 PolarHBondContact O-N 2.9Å; D210-G213 PolarHBondContact OD1-N 3.23Å; D210-G213 VanDerWaalsContact OD2-CA 3.3Å; D210-G213 WeakPolarHBondContact OD2-CA 3.32Å; D210-G213 PolarHBondContact OD2-N 3.47Å; D210-Y214 WeakPolarHBondContact O-CB 2.9Å; D210-Y214 PolarHBondContact O-N 2.86Å
211	P	82.6	Confident	70	Confident	89 Å²	89	88.2 Å²	88.2	58%	0.578	49%	0.49	S	S	*	.	H	α-helix	trans	-71.2	-25.4	-172.1	30.3	-29.8	0	0	0	110.9	M209 S215	M209-P211 WeakPolarHBondContact O-CD 3.48Å; P211-S215 WeakPolarHBondContact O-CB 3.39Å; P211-S215 PolarHBondContact O-N 3.49Å; P211-S215 PolarHBondContact O-OG 3.49Å
212	V	87.2	Confident	72.4	Confident	75 Å²	75	85.1 Å²	85.1	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-76.3	-46.1	178.5	-177.2	0	0	0	0	109.8	D210 S215 R216	D210-V212 PolarHBondContact O-N 3.24Å; D210-V212 PolarHBondContact OD1-N 3.04Å; D210-V212 VanDerWaalsContact OD1-N 3.1Å; V212-S215 PolarHBondContact O-N 3.28Å; V212-R216 VanDerWaalsContact O-CG 3.31Å; V212-R216 WeakPolarHBondContact O-CG 3.34Å; V212-R216 PolarHBondContact O-N 3Å
213	G	86.8	Confident	75.2	Confident	6 Å²	6	83.3 Å²	83.3	6%	0.062	45%	0.45	C	S	.	.	H	α-helix	trans	-58.5	-44.9	173.5	0	0	0	0	0	112.4	F193 D210 R216 H217	F193-G213 WeakPolarHBondContact CB-O 3.37Å; D210-G213 PolarHBondContact O-N 2.9Å; D210-G213 PolarHBondContact OD1-N 3.23Å; D210-G213 VanDerWaalsContact OD2-CA 3.3Å; D210-G213 WeakPolarHBondContact OD2-CA 3.32Å; D210-G213 PolarHBondContact OD2-N 3.47Å; G213-R216 PolarHBondContact O-N 2.84Å; G213-H217 PolarHBondContact O-N 3Å
214	Y	87.6	Confident	77.7	Confident	80 Å²	80	75.6 Å²	75.6	31%	0.314	42%	0.421	S	S	.	.	H	α-helix	trans	-60.3	-46.6	174.6	-178.2	-97.6	0	0	0	112.1	D210 R216 H217 M218	D210-Y214 WeakPolarHBondContact O-CB 2.9Å; D210-Y214 PolarHBondContact O-N 2.86Å; Y214-R216 VanDerWaalsContact C-N 3.34Å; Y214-R216 PolarHBondContact O-N 3.23Å; Y214-H217 PolarHBondContact O-N 3.38Å; Y214-M218 HydrophobicContact CE1-CE 4.41Å; Y214-M218 HydrophobicContact CE1-SD 4.45Å; Y214-M218 WeakPolarHBondContact O-CB 3.37Å; Y214-M218 PolarHBondContact O-N 3.4Å
215	S	90.6	Very high	80.2	Confident	55 Å²	55	73 Å²	73	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-41.5	178.4	-62.3	0	0	0	0	112.2	P211 V212 M218 V219	P211-S215 WeakPolarHBondContact O-CB 3.39Å; P211-S215 PolarHBondContact O-N 3.49Å; P211-S215 PolarHBondContact O-OG 3.49Å; V212-S215 PolarHBondContact O-N 3.28Å; S215-M218 PolarHBondContact O-N 3.04Å; S215-V219 VanDerWaalsContact O-CG2 3.29Å; S215-V219 WeakPolarHBondContact O-CG2 3.28Å; S215-V219 PolarHBondContact O-N 2.89Å
216	R	92.6	Very high	83	Confident	85 Å²	85	72.1 Å²	72.1	32%	0.321	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-46	175	-71.6	166	178.4	169	3.5	111.8	F177 F193 V212 G213 Y214 V219 V220	F177-R216 HydrophobicContact CZ-CB 4.42Å; F177-R216 HydrophobicContact CZ-CG 4.35Å; F193-R216 HydrophobicContact CB-CB 4.45Å; F193-R216 HydrophobicContact CD1-CB 4.32Å; F193-R216 VanDerWaalsContact O-CD 3.29Å; F193-R216 WeakPolarHBondContact O-CD 3.47Å; F193-R216 PolarHBondContact O-NH1 3.11Å; F193-R216 VanDerWaalsContact O-NH1 3.16Å; V212-R216 VanDerWaalsContact O-CG 3.31Å; V212-R216 WeakPolarHBondContact O-CG 3.34Å; V212-R216 PolarHBondContact O-N 3Å; G213-R216 PolarHBondContact O-N 2.84Å; Y214-R216 VanDerWaalsContact C-N 3.34Å; Y214-R216 PolarHBondContact O-N 3.23Å; R216-V219 PolarHBondContact O-N 3.08Å; R216-V220 WeakPolarHBondContact O-CB 3.3Å; R216-V220 WeakPolarHBondContact O-CG2 3.29Å; R216-V220 PolarHBondContact O-N 3.35Å
217	H	90.5	Very high	85.7	Confident	27 Å²	27	66.3 Å²	66.3	13%	0.125	36%	0.36	C	S	.	.	H	α-helix	trans	-58	-50.6	177.2	-175.1	-167.7	0	0	0	110.7	F193 G213 Y214 V219 V220 T221 L284	F193-H217 HydrophobicContact CB-CB 4.21Å; F193-H217 HydrophobicContact CD1-CB 4.26Å; F193-H217 HydrophobicContact CD2-CB 3.49Å; F193-H217 VanDerWaalsContact CD2-CB 3.49Å; F193-H217 AromaticContact CD2-CD2 3.73Å; F193-H217 AromaticContact CD2-CG 3.52Å; F193-H217 HydrophobicContact CE2-CB 3.81Å; F193-H217 AromaticContact CE2-CD2 3.1Å; F193-H217 WeakPolarHBondContact CE2-CD2 3.48Å; F193-H217 AromaticContact CE2-CG 3.43Å; F193-H217 VanDerWaalsContact CE2-CG 3.43Å; F193-H217 AromaticContact CE2-NE2 3.72Å; F193-H217 HydrophobicContact CG-CB 3.73Å; F193-H217 HydrophobicContact CZ-CB 4.32Å; F193-H217 AromaticContact CZ-CD2 3.55Å; G213-H217 PolarHBondContact O-N 3Å; Y214-H217 PolarHBondContact O-N 3.38Å; H217-V219 PolarHBondContact O-N 3.35Å; H217-V220 PolarHBondContact O-N 3.1Å; H217-T221 PolarHBondContact CD2-OG1 2.94Å; H217-T221 VanDerWaalsContact CD2-OG1 3.25Å; H217-T221 PolarHBondContact NE2-OG1 3.49Å; H217-T221 WeakPolarHBondContact O-CB 3.45Å; H217-T221 PolarHBondContact O-N 3.49Å; H217-T221 PolarHBondContact O-OG1 2.94Å; H217-T221 VanDerWaalsContact O-OG1 3.12Å; H217-L284 HydrophobicContact CB-CD2 4.44Å
218	M	92.8	Very high	88	Confident	71 Å²	71	60.7 Å²	60.7	35%	0.35	32%	0.321	S	S	.	.	H	α-helix	trans	-57.5	-50.3	178.3	177.9	178	47.6	0	0	112	Y214 S215 V220 T221 V222 L284	Y214-M218 HydrophobicContact CE1-CE 4.41Å; Y214-M218 HydrophobicContact CE1-SD 4.45Å; Y214-M218 WeakPolarHBondContact O-CB 3.37Å; Y214-M218 PolarHBondContact O-N 3.4Å; S215-M218 PolarHBondContact O-N 3.04Å; M218-V220 PolarHBondContact O-N 3.24Å; M218-T221 PolarHBondContact O-N 3.35Å; M218-V222 HydrophobicContact CG-CG2 4.24Å; M218-V222 VanDerWaalsContact O-CB 3.3Å; M218-V222 WeakPolarHBondContact O-CB 3.43Å; M218-V222 VanDerWaalsContact O-CG2 3.26Å; M218-V222 WeakPolarHBondContact O-CG2 3.41Å; M218-V222 PolarHBondContact O-N 3Å; M218-L284 HydrophobicContact CB-CD2 4.33Å
219	V	94.5	Very high	90.1	Very high	87 Å²	87	53.4 Å²	53.4	53%	0.527	29%	0.287	S	S	.	.	H	α-helix	trans	-59.8	-49	-179.9	169.6	0	0	0	0	110.9	S215 R216 H217 T221 T223	S215-V219 VanDerWaalsContact O-CG2 3.29Å; S215-V219 WeakPolarHBondContact O-CG2 3.28Å; S215-V219 PolarHBondContact O-N 2.89Å; R216-V219 PolarHBondContact O-N 3.08Å; H217-V219 PolarHBondContact O-N 3.35Å; V219-T221 PolarHBondContact O-N 3.48Å; V219-T223 WeakPolarHBondContact O-CB 3.21Å; V219-T223 PolarHBondContact O-N 3.15Å; V219-T223 PolarHBondContact O-OG1 3.11Å
220	V	94.5	Very high	91.8	Very high	19 Å²	19	49.5 Å²	49.5	12%	0.115	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-44.9	-179.3	171.6	0	0	0	0	111.2	P173 F177 F193 R216 H217 M218 R224	P173-V220 HydrophobicContact CB-CG1 4.26Å; P173-V220 HydrophobicContact CB-CG2 3.88Å; P173-V220 HydrophobicContact CG-CG2 4.4Å; F177-V220 HydrophobicContact CD2-CG2 4.2Å; F177-V220 HydrophobicContact CE2-CG2 4Å; F193-V220 HydrophobicContact CE1-CB 4.1Å; F193-V220 HydrophobicContact CE1-CG1 4.27Å; F193-V220 HydrophobicContact CE1-CG2 4.18Å; F193-V220 HydrophobicContact CZ-CG1 4.48Å; R216-V220 WeakPolarHBondContact O-CB 3.3Å; R216-V220 WeakPolarHBondContact O-CG2 3.29Å; R216-V220 PolarHBondContact O-N 3.35Å; H217-V220 PolarHBondContact O-N 3.1Å; M218-V220 PolarHBondContact O-N 3.24Å; V220-R224 WeakPolarHBondContact O-CB 3.33Å; V220-R224 PolarHBondContact O-N 3.12Å
221	T	93.6	Very high	92.7	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.025	27%	0.272	C	S	.	.	H	α-helix	trans	-68.1	-45.7	-178.5	-65.7	0	0	0	0	111.9	H217 M218 V219 R224 F225 N280 L281 L284	H217-T221 PolarHBondContact CD2-OG1 2.94Å; H217-T221 VanDerWaalsContact CD2-OG1 3.25Å; H217-T221 PolarHBondContact NE2-OG1 3.49Å; H217-T221 WeakPolarHBondContact O-CB 3.45Å; H217-T221 PolarHBondContact O-N 3.49Å; H217-T221 PolarHBondContact O-OG1 2.94Å; H217-T221 VanDerWaalsContact O-OG1 3.12Å; M218-T221 PolarHBondContact O-N 3.35Å; V219-T221 PolarHBondContact O-N 3.48Å; T221-R224 PolarHBondContact O-N 3.08Å; T221-F225 PolarHBondContact O-N 3.46Å; T221-N280 HydrophobicContact CG2-CB 4.34Å; T221-N280 WeakPolarHBondContact CG2-O 3.35Å; T221-L281 HydrophobicContact CG2-CD2 4.07Å; T221-L281 HydrophobicContact CG2-CG 4.5Å; T221-L284 HydrophobicContact CG2-CD1 3.85Å; T221-L284 HydrophobicContact CG2-CD2 4.46Å; T221-L284 HydrophobicContact CG2-CG 4.11Å
222	V	95.3	Very high	93.3	Very high	51 Å²	51	45.7 Å²	45.7	31%	0.309	25%	0.245	S	C	.	.	H	α-helix	trans	-67.1	-46.7	178.9	172.3	0	0	0	0	110.9	M218 R224 F225 L226 L284	M218-V222 HydrophobicContact CG-CG2 4.24Å; M218-V222 VanDerWaalsContact O-CB 3.3Å; M218-V222 WeakPolarHBondContact O-CB 3.43Å; M218-V222 VanDerWaalsContact O-CG2 3.26Å; M218-V222 WeakPolarHBondContact O-CG2 3.41Å; M218-V222 PolarHBondContact O-N 3Å; V222-R224 VanDerWaalsContact C-N 3.28Å; V222-R224 PolarHBondContact O-N 3.39Å; V222-F225 PolarHBondContact O-N 2.85Å; V222-L226 HydrophobicContact CG1-CD1 3.78Å; V222-L226 HydrophobicContact CG1-CG 4.12Å; V222-L226 WeakPolarHBondContact O-CB 3.45Å; V222-L226 VanDerWaalsContact O-CG 3.31Å; V222-L226 WeakPolarHBondContact O-CG 3.18Å; V222-L226 PolarHBondContact O-N 3.45Å; V222-L284 HydrophobicContact CG2-CD1 4.43Å
223	T	96.3	Very high	93.6	Very high	56 Å²	56	43.7 Å²	43.7	34%	0.344	23%	0.233	S	C	.	.	H	α-helix	trans	-59.6	-41.5	175.7	-62.8	0	0	0	0	111	L170 V219 F225 L226 C227	L170-T223 HydrophobicContact CD2-CG2 4.05Å; V219-T223 WeakPolarHBondContact O-CB 3.21Å; V219-T223 PolarHBondContact O-N 3.15Å; V219-T223 PolarHBondContact O-OG1 3.11Å; T223-F225 PolarHBondContact O-N 3.26Å; T223-L226 PolarHBondContact O-N 3.39Å; T223-C227 WeakPolarHBondContact O-CB 3.19Å; T223-C227 PolarHBondContact O-N 3.49Å
224	R	95.6	Very high	93.9	Very high	23 Å²	23	48.6 Å²	48.6	9%	0.087	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-43.5	175.6	-172.8	-171.1	-62	149.5	3.9	112.1	M123 F124 V220 T221 V222 G228 N280	M123-R224 HydrophobicContact CE-CG 3.86Å; F124-R224 HydrophobicContact CZ-CG 4.2Å; V220-R224 WeakPolarHBondContact O-CB 3.33Å; V220-R224 PolarHBondContact O-N 3.12Å; T221-R224 PolarHBondContact O-N 3.08Å; V222-R224 VanDerWaalsContact C-N 3.28Å; V222-R224 PolarHBondContact O-N 3.39Å; R224-G228 WeakPolarHBondContact O-CA 3.41Å; R224-G228 PolarHBondContact O-N 3.21Å; R224-N280 PolarHBondContact NH1-OD1 3.33Å
225	F	95.8	Very high	94.3	Very high	46 Å²	46	48 Å²	48	20%	0.202	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-47.9	176.7	172.6	-111.8	0	0	0	112.3	T221 V222 T223 F229 L230 H277 L281	T221-F225 PolarHBondContact O-N 3.46Å; V222-F225 PolarHBondContact O-N 2.85Å; T223-F225 PolarHBondContact O-N 3.26Å; F225-F229 HydrophobicContact CD2-CB 4.14Å; F225-F229 HydrophobicContact CD2-CD1 4.21Å; F225-F229 HydrophobicContact CD2-CG 4.48Å; F225-F229 HydrophobicContact CE2-CB 4.38Å; F225-F229 AromaticContact CE2-CD1 3.62Å; F225-F229 HydrophobicContact CE2-CD1 3.62Å; F225-F229 HydrophobicContact CE2-CE1 4.31Å; F225-F229 HydrophobicContact CE2-CG 4.32Å; F225-F229 HydrophobicContact CZ-CD1 4.38Å; F225-F229 WeakPolarHBondContact O-CA 3.36Å; F225-F229 VanDerWaalsContact O-CB 3.25Å; F225-F229 WeakPolarHBondContact O-CB 3.43Å; F225-F229 PolarHBondContact O-N 3.21Å; F225-L230 HydrophobicContact CE1-CB 4.13Å; F225-L230 HydrophobicContact CE1-CD2 4.15Å; F225-L230 HydrophobicContact CZ-CB 4.23Å; F225-L230 PolarHBondContact O-N 2.95Å; F225-H277 HydrophobicContact CD2-CB 3.95Å; F225-H277 HydrophobicContact CE2-CB 4.47Å; F225-L281 HydrophobicContact CB-CD1 4.33Å; F225-L281 HydrophobicContact CB-CD2 4.29Å; F225-L281 HydrophobicContact CB-CG 4.46Å; F225-L281 HydrophobicContact CD1-CD1 4.03Å; F225-L281 HydrophobicContact CD2-CD1 3.7Å; F225-L281 HydrophobicContact CE1-CD1 4.21Å; F225-L281 HydrophobicContact CE2-CD1 3.88Å; F225-L281 HydrophobicContact CG-CD1 3.75Å; F225-L281 HydrophobicContact CG-CD2 4.41Å; F225-L281 HydrophobicContact CG-CG 4.38Å; F225-L281 HydrophobicContact CZ-CD1 4.13Å
226	L	96.6	Very high	94.4	Very high	68 Å²	68	45.6 Å²	45.6	36%	0.356	24%	0.242	S	C	.	.	I	π-helix	trans	-64.2	-52.9	-177.8	-67.2	178.5	0	0	0	111.4	V222 T223 L230 V231	V222-L226 HydrophobicContact CG1-CD1 3.78Å; V222-L226 HydrophobicContact CG1-CG 4.12Å; V222-L226 WeakPolarHBondContact O-CB 3.45Å; V222-L226 VanDerWaalsContact O-CG 3.31Å; V222-L226 WeakPolarHBondContact O-CG 3.18Å; V222-L226 PolarHBondContact O-N 3.45Å; T223-L226 PolarHBondContact O-N 3.39Å; L226-L230 HydrophobicContact CD2-CB 4.39Å; L226-L230 HydrophobicContact CD2-CD2 3.71Å; L226-L230 PolarHBondContact O-N 3.48Å; L226-V231 WeakPolarHBondContact O-CB 3.05Å; L226-V231 WeakPolarHBondContact O-CG2 3.18Å; L226-V231 PolarHBondContact O-N 2.97Å
227	C	96.3	Very high	94.3	Very high	41 Å²	41	44.7 Å²	44.7	28%	0.277	25%	0.246	S	C	.	.	I	π-helix	trans	-79	-31.5	-175.6	-61.7	0	0	0	0	112.9	F124 F128 L170 T223 P232	F124-C227 HydrophobicContact CE1-CB 3.89Å; F128-C227 WeakPolarHBondContact CE1-O 3.34Å; L170-C227 HydrophobicContact CD1-CB 4.08Å; T223-C227 WeakPolarHBondContact O-CB 3.19Å; T223-C227 PolarHBondContact O-N 3.49Å; C227-P232 WeakPolarHBondContact O-CD 3.38Å; C227-P232 WeakPolarHBondContact O-CG 3.35Å
228	G	93.3	Very high	94.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-88.7	-17.3	-176.7	0	0	0	0	0	114	R224	R224-G228 WeakPolarHBondContact O-CA 3.41Å; R224-G228 PolarHBondContact O-N 3.21Å
229	F	93.5	Very high	94.3	Very high	30 Å²	30	43 Å²	43	13%	0.132	25%	0.247	C	C	.	.	I	π-helix	trans	-138.1	-70.4	-173.6	-166.6	-96.6	0	0	0	112.6	F225 P232 V233 F270 W273 C274 H277	F225-F229 HydrophobicContact CD2-CB 4.14Å; F225-F229 HydrophobicContact CD2-CD1 4.21Å; F225-F229 HydrophobicContact CD2-CG 4.48Å; F225-F229 HydrophobicContact CE2-CB 4.38Å; F225-F229 AromaticContact CE2-CD1 3.62Å; F225-F229 HydrophobicContact CE2-CD1 3.62Å; F225-F229 HydrophobicContact CE2-CE1 4.31Å; F225-F229 HydrophobicContact CE2-CG 4.32Å; F225-F229 HydrophobicContact CZ-CD1 4.38Å; F225-F229 WeakPolarHBondContact O-CA 3.36Å; F225-F229 VanDerWaalsContact O-CB 3.25Å; F225-F229 WeakPolarHBondContact O-CB 3.43Å; F225-F229 PolarHBondContact O-N 3.21Å; F229-P232 WeakPolarHBondContact O-CD 3.3Å; F229-V233 HydrophobicContact CD1-CG2 4.39Å; F229-V233 HydrophobicContact CE1-CG2 4.31Å; F229-V233 HydrophobicContact CZ-CG2 4.49Å; F229-V233 VanDerWaalsContact O-CG2 3.26Å; F229-V233 WeakPolarHBondContact O-CG2 3.47Å; F229-V233 PolarHBondContact O-N 3Å; F229-F270 AromaticContact CD2-CD1 3.77Å; F229-F270 HydrophobicContact CD2-CD1 3.77Å; F229-F270 HydrophobicContact CD2-CE1 4.26Å; F229-F270 HydrophobicContact CE2-CB 4.22Å; F229-F270 AromaticContact CE2-CD1 3.59Å; F229-F270 HydrophobicContact CE2-CD1 3.59Å; F229-F270 HydrophobicContact CE2-CE1 4.48Å; F229-F270 HydrophobicContact CE2-CG 4.37Å; F229-F270 HydrophobicContact CZ-CD1 4.23Å; F229-W273 HydrophobicContact CD2-CB 4.42Å; F229-C274 HydrophobicContact CE2-CB 3.83Å; F229-C274 HydrophobicContact CZ-CB 3.69Å; F229-H277 AromaticContact CD2-CD2 3.49Å; F229-H277 VanDerWaalsContact CD2-CD2 3.49Å; F229-H277 WeakPolarHBondContact CD2-CD2 3.43Å; F229-H277 AromaticContact CG-CD2 3.79Å
230	L	94.8	Very high	94	Very high	63 Å²	63	39.9 Å²	39.9	33%	0.33	23%	0.226	S	C	.	.	I	π-helix	trans	-63	-53.2	-166.2	-177.1	62.8	0	0	0	113.4	F225 L226 V233 L234	F225-L230 HydrophobicContact CE1-CB 4.13Å; F225-L230 HydrophobicContact CE1-CD2 4.15Å; F225-L230 HydrophobicContact CZ-CB 4.23Å; F225-L230 PolarHBondContact O-N 2.95Å; L226-L230 HydrophobicContact CD2-CB 4.39Å; L226-L230 HydrophobicContact CD2-CD2 3.71Å; L226-L230 PolarHBondContact O-N 3.48Å; L230-V233 PolarHBondContact O-N 3.11Å; L230-L234 HydrophobicContact CD1-CD1 4.23Å; L230-L234 HydrophobicContact CD1-CG 4.34Å; L230-L234 HydrophobicContact CG-CD1 4.1Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.44Å
231	V	96.1	Very high	93.7	Very high	69 Å²	69	44 Å²	44	42%	0.418	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-48.1	-179.1	170.8	0	0	0	0	111.1	L226 V233 L234 I235	L226-V231 WeakPolarHBondContact O-CB 3.05Å; L226-V231 WeakPolarHBondContact O-CG2 3.18Å; L226-V231 PolarHBondContact O-N 2.97Å; V231-V233 PolarHBondContact O-N 2.99Å; V231-L234 PolarHBondContact O-N 3.34Å; V231-I235 HydrophobicContact CG1-CD1 3.71Å; V231-I235 HydrophobicContact CG1-CG1 4.38Å; V231-I235 WeakPolarHBondContact O-CG1 3.41Å; V231-I235 PolarHBondContact O-N 3.38Å
232	P	95.6	Very high	93.4	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-55.7	-45.6	171.9	-28.8	35.1	0	0	0	114.8	V127 C227 F229 L234 I235 I236 F270	V127-P232 HydrophobicContact CG1-CG 4.1Å; V127-P232 HydrophobicContact CG2-CB 3.41Å; V127-P232 VanDerWaalsContact CG2-CB 3.41Å; V127-P232 HydrophobicContact CG2-CG 3.7Å; C227-P232 WeakPolarHBondContact O-CD 3.38Å; C227-P232 WeakPolarHBondContact O-CG 3.35Å; F229-P232 WeakPolarHBondContact O-CD 3.3Å; P232-L234 VanDerWaalsContact C-N 3.28Å; P232-L234 PolarHBondContact O-N 3.16Å; P232-I235 PolarHBondContact O-N 3.19Å; P232-I236 VanDerWaalsContact O-CB 3.3Å; P232-I236 WeakPolarHBondContact O-CB 3.35Å; P232-I236 WeakPolarHBondContact O-CG1 3.41Å; P232-I236 PolarHBondContact O-N 2.79Å; P232-F270 HydrophobicContact CB-CZ 4.35Å
233	V	92.9	Very high	93	Very high	34 Å²	34	44.4 Å²	44.4	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-54.9	-47.8	176.4	169.6	0	0	0	0	110.2	F229 L230 V231 I236 T237 F270	F229-V233 HydrophobicContact CD1-CG2 4.39Å; F229-V233 HydrophobicContact CE1-CG2 4.31Å; F229-V233 HydrophobicContact CZ-CG2 4.49Å; F229-V233 VanDerWaalsContact O-CG2 3.26Å; F229-V233 WeakPolarHBondContact O-CG2 3.47Å; F229-V233 PolarHBondContact O-N 3Å; L230-V233 PolarHBondContact O-N 3.11Å; V231-V233 PolarHBondContact O-N 2.99Å; V233-I236 PolarHBondContact O-N 3.07Å; V233-T237 WeakPolarHBondContact O-CB 3.24Å; V233-T237 PolarHBondContact O-N 2.76Å; V233-T237 PolarHBondContact O-OG1 2.9Å; V233-F270 HydrophobicContact CB-CE1 4.23Å; V233-F270 HydrophobicContact CB-CE2 4.38Å; V233-F270 HydrophobicContact CB-CZ 4.04Å; V233-F270 HydrophobicContact CG2-CD1 3.3Å; V233-F270 HydrophobicContact CG2-CD2 3.94Å; V233-F270 HydrophobicContact CG2-CE1 3.09Å; V233-F270 HydrophobicContact CG2-CE2 3.7Å; V233-F270 HydrophobicContact CG2-CG 3.76Å; V233-F270 HydrophobicContact CG2-CZ 3.28Å
234	L	94.3	Very high	92.4	Very high	108 Å²	108	44.1 Å²	44.1	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-64.2	-46.4	-176.9	-67.6	172.6	0	0	0	111.5	L230 V231 P232 T237 A238	L230-L234 HydrophobicContact CD1-CD1 4.23Å; L230-L234 HydrophobicContact CD1-CG 4.34Å; L230-L234 HydrophobicContact CG-CD1 4.1Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.44Å; V231-L234 PolarHBondContact O-N 3.34Å; P232-L234 VanDerWaalsContact C-N 3.28Å; P232-L234 PolarHBondContact O-N 3.16Å; L234-T237 PolarHBondContact O-N 3.03Å; L234-A238 WeakPolarHBondContact O-CB 3.37Å; L234-A238 PolarHBondContact O-N 3.17Å
235	I	95.2	Very high	91.9	Very high	69 Å²	69	46.7 Å²	46.7	35%	0.354	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-48.7	178.5	-65.6	168.7	0	0	0	110.5	T131 V231 P232 A238 C239	T131-I235 HydrophobicContact CG2-CB 4.01Å; T131-I235 HydrophobicContact CG2-CD1 4.13Å; T131-I235 HydrophobicContact CG2-CG2 3.59Å; V231-I235 HydrophobicContact CG1-CD1 3.71Å; V231-I235 HydrophobicContact CG1-CG1 4.38Å; V231-I235 WeakPolarHBondContact O-CG1 3.41Å; V231-I235 PolarHBondContact O-N 3.38Å; P232-I235 PolarHBondContact O-N 3.19Å; I235-A238 PolarHBondContact O-N 3Å; I235-C239 WeakPolarHBondContact O-CB 3.27Å; I235-C239 PolarHBondContact O-N 2.77Å; I235-C239 PolarHBondContact O-SG 2.86Å
236	I	92.9	Very high	91.3	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-49.1	-179.7	-68.5	172.8	0	0	0	109.6	L130 P232 V233 A238 C239 Y240 I266 F270	L130-I236 HydrophobicContact CB-CD1 4.25Å; P232-I236 VanDerWaalsContact O-CB 3.3Å; P232-I236 WeakPolarHBondContact O-CB 3.35Å; P232-I236 WeakPolarHBondContact O-CG1 3.41Å; P232-I236 PolarHBondContact O-N 2.79Å; V233-I236 PolarHBondContact O-N 3.07Å; I236-A238 PolarHBondContact O-N 3.01Å; I236-C239 WeakPolarHBondContact O-CB 3.45Å; I236-C239 PolarHBondContact O-N 3.4Å; I236-C239 VanDerWaalsContact O-N 3.17Å; I236-Y240 HydrophobicContact CG2-CD2 3.75Å; I236-Y240 HydrophobicContact CG2-CE2 4Å; I236-Y240 VanDerWaalsContact O-CD2 3.28Å; I236-Y240 WeakPolarHBondContact O-CD2 3.47Å; I236-Y240 PolarHBondContact O-N 3.39Å; I236-I266 HydrophobicContact CG2-CD1 3.54Å; I236-I266 HydrophobicContact CG2-CG1 4.03Å; I236-I266 HydrophobicContact CG2-CG2 3.72Å; I236-F270 HydrophobicContact CD1-CE2 4Å; I236-F270 HydrophobicContact CD1-CZ 3.94Å
237	T	90.1	Very high	90.4	Very high	67 Å²	67	46.7 Å²	46.7	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-58.3	-47.4	179.4	-57	0	0	0	0	111.2	V233 L234 C239 Y240 L241	V233-T237 WeakPolarHBondContact O-CB 3.24Å; V233-T237 PolarHBondContact O-N 2.76Å; V233-T237 PolarHBondContact O-OG1 2.9Å; L234-T237 PolarHBondContact O-N 3.03Å; T237-C239 PolarHBondContact O-N 3.48Å; T237-Y240 PolarHBondContact O-N 2.88Å; T237-L241 HydrophobicContact CG2-CD1 3.92Å; T237-L241 HydrophobicContact CG2-CG 4.21Å; T237-L241 WeakPolarHBondContact O-CB 3.39Å; T237-L241 VanDerWaalsContact O-CG 3.25Å; T237-L241 WeakPolarHBondContact O-CG 3.45Å; T237-L241 PolarHBondContact O-N 2.92Å
238	A	92.3	Very high	89.5	Confident	52 Å²	52	51.4 Å²	51.4	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-42.8	176.9	0	0	0	0	0	112.5	L234 I235 I236 Y240 T242	L234-A238 WeakPolarHBondContact O-CB 3.37Å; L234-A238 PolarHBondContact O-N 3.17Å; I235-A238 PolarHBondContact O-N 3Å; I236-A238 PolarHBondContact O-N 3.01Å; A238-Y240 PolarHBondContact O-N 3.28Å; A238-T242 WeakPolarHBondContact O-CB 3.48Å; A238-T242 PolarHBondContact O-N 3Å; A238-T242 PolarHBondContact O-OG1 3.46Å
239	C	91.8	Very high	88.9	Confident	9 Å²	9	60.4 Å²	60.4	6%	0.061	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-46.5	176.1	-71.1	0	0	0	0	111.5	C138 I235 I236 T237 T242 I243	C138-C239 HydrophobicContact CB-CB 3.96Å; I235-C239 WeakPolarHBondContact O-CB 3.27Å; I235-C239 PolarHBondContact O-N 2.77Å; I235-C239 PolarHBondContact O-SG 2.86Å; I236-C239 WeakPolarHBondContact O-CB 3.45Å; I236-C239 PolarHBondContact O-N 3.4Å; I236-C239 VanDerWaalsContact O-N 3.17Å; T237-C239 PolarHBondContact O-N 3.48Å; C239-T242 PolarHBondContact O-N 3.26Å; C239-I243 WeakPolarHBondContact O-CD1 3.2Å; C239-I243 VanDerWaalsContact O-CG1 3.24Å; C239-I243 WeakPolarHBondContact O-CG1 3.2Å; C239-I243 PolarHBondContact O-N 3.12Å
240	Y	86.8	Confident	87.9	Confident	22 Å²	22	62.4 Å²	62.4	9%	0.086	33%	0.332	C	S	.	.	H	α-helix	trans	-72	-39.9	-177.5	-87.4	-84.9	0	0	0	113.3	S134 I236 T237 A238 T242 I243 V244 F259 I262 V263 I266	S134-Y240 WeakPolarHBondContact OG-CE2 3.49Å; I236-Y240 HydrophobicContact CG2-CD2 3.75Å; I236-Y240 HydrophobicContact CG2-CE2 4Å; I236-Y240 VanDerWaalsContact O-CD2 3.28Å; I236-Y240 WeakPolarHBondContact O-CD2 3.47Å; I236-Y240 PolarHBondContact O-N 3.39Å; T237-Y240 PolarHBondContact O-N 2.88Å; A238-Y240 PolarHBondContact O-N 3.28Å; Y240-T242 VanDerWaalsContact C-N 3.27Å; Y240-T242 PolarHBondContact O-N 3.12Å; Y240-I243 PolarHBondContact O-N 3.17Å; Y240-V244 VanDerWaalsContact O-CG2 3.31Å; Y240-V244 WeakPolarHBondContact O-CG2 3.27Å; Y240-V244 PolarHBondContact O-N 3.19Å; Y240-F259 HydrophobicContact CD1-CD2 4.14Å; Y240-F259 AromaticContact CD1-CE2 3.24Å; Y240-F259 HydrophobicContact CD1-CE2 3.24Å; Y240-F259 AromaticContact CD1-CZ 3.49Å; Y240-F259 HydrophobicContact CD1-CZ 3.49Å; Y240-F259 VanDerWaalsContact CD1-CZ 3.49Å; Y240-F259 AromaticContact CE1-CD2 3.76Å; Y240-F259 HydrophobicContact CE1-CD2 3.76Å; Y240-F259 AromaticContact CE1-CE2 3.33Å; Y240-F259 HydrophobicContact CE1-CE2 3.33Å; Y240-F259 AromaticContact CE1-CZ 3.9Å; Y240-F259 HydrophobicContact CE1-CZ 3.9Å; Y240-I262 WeakPolarHBondContact OH-CB 3.46Å; Y240-I262 WeakPolarHBondContact OH-CG2 3.5Å; Y240-V263 HydrophobicContact CD1-CG2 3.66Å; Y240-V263 HydrophobicContact CE1-CG2 3.41Å; Y240-V263 VanDerWaalsContact CE1-CG2 3.41Å; Y240-I266 HydrophobicContact CD2-CD1 3.96Å; Y240-I266 HydrophobicContact CE2-CD1 3.21Å
241	L	87.8	Confident	86.5	Confident	107 Å²	107	70.5 Å²	70.5	56%	0.56	36%	0.358	S	S	*	.	H	α-helix	trans	-57.4	-45.8	171.8	-70.9	174.9	0	0	0	110.4	T237 I243 V244 C245	T237-L241 HydrophobicContact CG2-CD1 3.92Å; T237-L241 HydrophobicContact CG2-CG 4.21Å; T237-L241 WeakPolarHBondContact O-CB 3.39Å; T237-L241 VanDerWaalsContact O-CG 3.25Å; T237-L241 WeakPolarHBondContact O-CG 3.45Å; T237-L241 PolarHBondContact O-N 2.92Å; L241-I243 PolarHBondContact O-N 3.5Å; L241-V244 PolarHBondContact O-N 3.35Å; L241-C245 WeakPolarHBondContact O-CB 3.35Å; L241-C245 PolarHBondContact O-N 3.15Å; L241-C245 PolarHBondContact O-SG 2.83Å
242	T	88.9	Confident	84.9	Confident	58 Å²	58	72 Å²	72	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-61.8	-43.2	178.4	-56.9	0	0	0	0	112.3	L142 A238 C239 Y240 K246	L142-T242 HydrophobicContact CD1-CG2 3.67Å; L142-T242 HydrophobicContact CD2-CG2 3.84Å; L142-T242 HydrophobicContact CG-CG2 4.19Å; A238-T242 WeakPolarHBondContact O-CB 3.48Å; A238-T242 PolarHBondContact O-N 3Å; A238-T242 PolarHBondContact O-OG1 3.46Å; C239-T242 PolarHBondContact O-N 3.26Å; Y240-T242 VanDerWaalsContact C-N 3.27Å; Y240-T242 PolarHBondContact O-N 3.12Å; T242-K246 WeakPolarHBondContact O-CB 3.36Å; T242-K246 PolarHBondContact O-N 3.28Å
243	I	85.8	Confident	83	Confident	5 Å²	5	76.4 Å²	76.4	3%	0.026	40%	0.4	C	S	.	.	H	α-helix	trans	-60.6	-47.9	175.7	-70.2	163.4	0	0	0	110.8	R137 C138 V141 C239 Y240 L241 K246 L247 F259	R137-I243 HydrophobicContact CB-CD1 4.29Å; C138-I243 HydrophobicContact CB-CD1 4.23Å; C138-I243 HydrophobicContact CB-CG1 4.35Å; V141-I243 HydrophobicContact CB-CG1 4.43Å; V141-I243 HydrophobicContact CG1-CG2 4.5Å; V141-I243 HydrophobicContact CG2-CG1 4.49Å; V141-I243 HydrophobicContact CG2-CG2 4.43Å; C239-I243 WeakPolarHBondContact O-CD1 3.2Å; C239-I243 VanDerWaalsContact O-CG1 3.24Å; C239-I243 WeakPolarHBondContact O-CG1 3.2Å; C239-I243 PolarHBondContact O-N 3.12Å; Y240-I243 PolarHBondContact O-N 3.17Å; L241-I243 PolarHBondContact O-N 3.5Å; I243-K246 PolarHBondContact O-N 3.45Å; I243-L247 HydrophobicContact CG2-CD1 3.54Å; I243-L247 HydrophobicContact CG2-CG 4.4Å; I243-L247 WeakPolarHBondContact O-CB 3.08Å; I243-L247 WeakPolarHBondContact O-CG 3.15Å; I243-L247 PolarHBondContact O-N 2.83Å; I243-F259 HydrophobicContact CB-CE2 4.39Å; I243-F259 HydrophobicContact CG2-CD2 4.14Å; I243-F259 HydrophobicContact CG2-CE2 3.67Å
244	V	83.6	Confident	81.1	Confident	50 Å²	50	80.9 Å²	80.9	30%	0.303	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-48.8	-179.7	170.8	0	0	0	0	110.9	Y240 L241 K246 L247 Q248 F259	Y240-V244 VanDerWaalsContact O-CG2 3.31Å; Y240-V244 WeakPolarHBondContact O-CG2 3.27Å; Y240-V244 PolarHBondContact O-N 3.19Å; L241-V244 PolarHBondContact O-N 3.35Å; V244-K246 VanDerWaalsContact C-N 3.31Å; V244-K246 PolarHBondContact O-N 3.19Å; V244-L247 PolarHBondContact O-N 3.34Å; V244-Q248 HydrophobicContact CG1-CG 4.4Å; V244-Q248 WeakPolarHBondContact O-CB 3.35Å; V244-Q248 WeakPolarHBondContact O-CG 3.21Å; V244-Q248 PolarHBondContact O-N 3.05Å; V244-F259 HydrophobicContact CG2-CE1 4.4Å; V244-F259 HydrophobicContact CG2-CE2 4.49Å; V244-F259 HydrophobicContact CG2-CZ 3.69Å
245	C	84.9	Confident	79.2	Confident	77 Å²	77	81 Å²	81	52%	0.52	42%	0.422	S	S	.	.	H	α-helix	trans	-58.8	-42.2	177.3	-67.9	0	0	0	0	111.7	L241 R249	L241-C245 WeakPolarHBondContact O-CB 3.35Å; L241-C245 PolarHBondContact O-N 3.15Å; L241-C245 PolarHBondContact O-SG 2.83Å; C245-R249 WeakPolarHBondContact O-CB 3.43Å; C245-R249 PolarHBondContact O-N 3.18Å
246	K	83	Confident	77.6	Confident	47 Å²	47	86.1 Å²	86.1	20%	0.204	44%	0.442	C	S	.	.	H	α-helix	trans	-67.1	-42.7	178.7	-175	60.7	170.6	166.4	0	112.4	V141 L142 T242 I243 V244 R249 N250	V141-K246 HydrophobicContact CG1-CB 4.41Å; V141-K246 HydrophobicContact CG1-CG 4.16Å; L142-K246 HydrophobicContact CD2-CB 4.24Å; L142-K246 HydrophobicContact CD2-CD 4.47Å; L142-K246 HydrophobicContact CD2-CG 4.13Å; T242-K246 WeakPolarHBondContact O-CB 3.36Å; T242-K246 PolarHBondContact O-N 3.28Å; I243-K246 PolarHBondContact O-N 3.45Å; V244-K246 VanDerWaalsContact C-N 3.31Å; V244-K246 PolarHBondContact O-N 3.19Å; K246-R249 PolarHBondContact O-N 3.24Å; K246-N250 VanDerWaalsContact CE-ND2 3.34Å; K246-N250 WeakPolarHBondContact CE-ND2 3.08Å; K246-N250 PolarHBondContact NZ-ND2 3.45Å; K246-N250 PolarHBondContact NZ-OD1 3.22Å; K246-N250 WeakPolarHBondContact O-CB 3.28Å; K246-N250 PolarHBondContact O-N 3.35Å
247	L	78.8	Confident	75.9	Confident	67 Å²	67	93.7 Å²	93.7	35%	0.351	48%	0.475	S	S	.	.	H	α-helix	trans	-64.7	-42.3	178.3	-79.3	162.4	0	0	0	112	I243 V244 R251 L252	I243-L247 HydrophobicContact CG2-CD1 3.54Å; I243-L247 HydrophobicContact CG2-CG 4.4Å; I243-L247 WeakPolarHBondContact O-CB 3.08Å; I243-L247 WeakPolarHBondContact O-CG 3.15Å; I243-L247 PolarHBondContact O-N 2.83Å; V244-L247 PolarHBondContact O-N 3.34Å; L247-R251 PolarHBondContact O-N 2.77Å; L247-L252 WeakPolarHBondContact CD2-O 3.4Å
248	Q	78.3	Confident	74.5	Confident	140 Å²	140	93.3 Å²	93.3	65%	0.654	47%	0.473	S	S	*	.	H	α-helix	trans	-62.9	-46.8	175.6	-73.9	175.7	-15.9	0	0	111.4	V244 N250 R251	V244-Q248 HydrophobicContact CG1-CG 4.4Å; V244-Q248 WeakPolarHBondContact O-CB 3.35Å; V244-Q248 WeakPolarHBondContact O-CG 3.21Å; V244-Q248 PolarHBondContact O-N 3.05Å; Q248-N250 VanDerWaalsContact C-N 3.35Å; Q248-N250 PolarHBondContact O-N 3.37Å; Q248-R251 PolarHBondContact O-N 2.93Å
249	R	79.7	Confident	73.3	Confident	188 Å²	188	94 Å²	94	71%	0.709	47%	0.466	S	S	*	.	H	α-helix	trans	-62.1	-40.6	179.8	-174.9	172.7	64.7	163.9	-6.2	112.8	C245 K246	C245-R249 WeakPolarHBondContact O-CB 3.43Å; C245-R249 PolarHBondContact O-N 3.18Å; K246-R249 PolarHBondContact O-N 3.24Å
250	N	71.8	Confident	72.3	Confident	72 Å²	72	100 Å²	100	39%	0.385	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1	-174.6	-76.3	13.5	0	0	0	113.8	K246 Q248 L252	K246-N250 VanDerWaalsContact CE-ND2 3.34Å; K246-N250 WeakPolarHBondContact CE-ND2 3.08Å; K246-N250 PolarHBondContact NZ-ND2 3.45Å; K246-N250 PolarHBondContact NZ-OD1 3.22Å; K246-N250 WeakPolarHBondContact O-CB 3.28Å; K246-N250 PolarHBondContact O-N 3.35Å; Q248-N250 VanDerWaalsContact C-N 3.35Å; Q248-N250 PolarHBondContact O-N 3.37Å; N250-L252 HydrophobicContact CB-CB 4.4Å; N250-L252 HydrophobicContact CB-CD1 4.18Å; N250-L252 PolarHBondContact O-N 2.83Å
251	R	67.1	Low	71.4	Confident	234 Å²	234	100.6 Å²	100.6	88%	0.883	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	19.7	-173.5	-62	-173	179.2	-170.1	0.5	114.6	L247 Q248 A253	L247-R251 PolarHBondContact O-N 2.77Å; Q248-R251 PolarHBondContact O-N 2.93Å; R251-A253 VanDerWaalsContact C-N 3.28Å; R251-A253 PolarHBondContact O-N 3.42Å
252	L	61.1	Low	70.6	Confident	99 Å²	99	96.1 Å²	96.1	52%	0.518	47%	0.473	S	S	.	.			trans	-85.1	74.7	-178.9	-109.3	125.2	0	0	0	108.3	L247 N250 K254	L247-L252 WeakPolarHBondContact CD2-O 3.4Å; N250-L252 HydrophobicContact CB-CB 4.4Å; N250-L252 HydrophobicContact CB-CD1 4.18Å; N250-L252 PolarHBondContact O-N 2.83Å; L252-K254 PolarHBondContact O-N 3.29Å
253	A	55.2	Low	70.1	Confident	97 Å²	97	95.3 Å²	95.3	80%	0.802	47%	0.467	S	S	*	.			trans	-76.4	72.3	171.8	0	0	0	0	0	110	R251	R251-A253 VanDerWaalsContact C-N 3.28Å; R251-A253 PolarHBondContact O-N 3.42Å
254	K	54.4	Low	69.8	Low	127 Å²	127	96.5 Å²	96.5	55%	0.552	48%	0.475	S	S	*	.			trans	-76.7	150.1	157.6	-84	-177.5	176.3	167.5	0	109.1	L252 K256 H344	L252-K254 PolarHBondContact O-N 3.29Å; K254-K256 PolarHBondContact O-N 3.37Å; K254-H344 PolarHBondContact NZ-CE1 3.45Å; K254-H344 PolarHBondContact NZ-NE2 2.89Å
255	T	53.6	Low	69.6	Low	111 Å²	111	94.2 Å²	94.2	68%	0.681	46%	0.461	S	S	*	.			trans	-37.1	122	-170.7	46.5	0	0	0	0	113.8	K257 P258	T255-K257 PolarHBondContact O-N 3.4Å; T255-P258 WeakPolarHBondContact O-CD 3.33Å
256	K	61.3	Low	69.5	Low	177 Å²	177	91.3 Å²	91.3	77%	0.77	44%	0.44	S	S	*	.	S	Bend	trans	-67.4	-0.3	-178.4	-61.8	-179.3	179.5	179.2	0	114.6	K254 K260	K254-K256 PolarHBondContact O-N 3.37Å; K256-K260 WeakPolarHBondContact O-CB 3.42Å; K256-K260 PolarHBondContact O-N 3.46Å
257	K	58.2	Low	69.7	Low	162 Å²	162	94 Å²	94	70%	0.704	46%	0.456	S	S	*	.	H	α-helix	trans	-67.6	-55.9	-168.1	-72.1	-173.9	177	-179.1	0	114.1	T255 F259 K260 I261	T255-K257 PolarHBondContact O-N 3.4Å; K257-F259 VanDerWaalsContact C-N 3.28Å; K257-F259 PolarHBondContact O-N 3.35Å; K257-K260 PolarHBondContact O-N 3.12Å; K257-I261 WeakPolarHBondContact O-CG1 3.35Å; K257-I261 PolarHBondContact O-N 2.85Å; K257-I261 VanDerWaalsContact O-N 3.17Å
258	P	60.3	Low	70.1	Confident	59 Å²	59	91.9 Å²	91.9	38%	0.383	45%	0.445	S	S	.	.	H	α-helix	trans	-63.9	-33.9	179.3	23.5	-33.8	0	0	0	112.6	T255 I261 I262	T255-P258 WeakPolarHBondContact O-CD 3.33Å; P258-I261 PolarHBondContact O-N 3.33Å; P258-I262 PolarHBondContact O-N 2.96Å
259	F	67.3	Low	70.5	Confident	65 Å²	65	85.2 Å²	85.2	29%	0.285	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.5	-177.5	-97.4	0	0	0	112	Y240 I243 V244 K257 I261 I262 V263	Y240-F259 HydrophobicContact CD1-CD2 4.14Å; Y240-F259 AromaticContact CD1-CE2 3.24Å; Y240-F259 HydrophobicContact CD1-CE2 3.24Å; Y240-F259 AromaticContact CD1-CZ 3.49Å; Y240-F259 HydrophobicContact CD1-CZ 3.49Å; Y240-F259 VanDerWaalsContact CD1-CZ 3.49Å; Y240-F259 AromaticContact CE1-CD2 3.76Å; Y240-F259 HydrophobicContact CE1-CD2 3.76Å; Y240-F259 AromaticContact CE1-CE2 3.33Å; Y240-F259 HydrophobicContact CE1-CE2 3.33Å; Y240-F259 AromaticContact CE1-CZ 3.9Å; Y240-F259 HydrophobicContact CE1-CZ 3.9Å; I243-F259 HydrophobicContact CB-CE2 4.39Å; I243-F259 HydrophobicContact CG2-CD2 4.14Å; I243-F259 HydrophobicContact CG2-CE2 3.67Å; V244-F259 HydrophobicContact CG2-CE1 4.4Å; V244-F259 HydrophobicContact CG2-CE2 4.49Å; V244-F259 HydrophobicContact CG2-CZ 3.69Å; K257-F259 VanDerWaalsContact C-N 3.28Å; K257-F259 PolarHBondContact O-N 3.35Å; F259-I261 VanDerWaalsContact C-N 3.29Å; F259-I261 PolarHBondContact O-N 2.68Å; F259-I262 PolarHBondContact O-N 3.08Å; F259-V263 HydrophobicContact CD1-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.79Å; F259-V263 HydrophobicContact CE2-CG2 4.39Å; F259-V263 HydrophobicContact CZ-CG2 3.96Å; F259-V263 VanDerWaalsContact O-CG2 3.28Å; F259-V263 WeakPolarHBondContact O-CG2 3.46Å; F259-V263 PolarHBondContact O-N 3.33Å; F259-V263 VanDerWaalsContact O-N 3.07Å
260	K	71.1	Confident	71	Confident	135 Å²	135	77.5 Å²	77.5	59%	0.587	39%	0.386	S	S	*	.	H	α-helix	trans	-59.6	-38.8	176.8	-173.2	178.7	178.1	-178.1	0	112	K256 K257 T264 M319	K256-K260 WeakPolarHBondContact O-CB 3.42Å; K256-K260 PolarHBondContact O-N 3.46Å; K257-K260 PolarHBondContact O-N 3.12Å; K260-T264 PolarHBondContact O-N 2.97Å; K260-T264 PolarHBondContact O-OG1 3.29Å; K260-T264 VanDerWaalsContact O-OG1 3.11Å; K260-M319 HydrophobicContact CG-CE 4.45Å
261	I	68.4	Low	72	Confident	35 Å²	35	80.8 Å²	80.8	18%	0.179	40%	0.397	C	S	.	.	H	α-helix	trans	-60.8	-53.2	179.1	-68	168.4	0	0	0	110.8	K257 P258 F259 V263 T264 I265 Y316 M319	K257-I261 WeakPolarHBondContact O-CG1 3.35Å; K257-I261 PolarHBondContact O-N 2.85Å; K257-I261 VanDerWaalsContact O-N 3.17Å; P258-I261 PolarHBondContact O-N 3.33Å; F259-I261 VanDerWaalsContact C-N 3.29Å; F259-I261 PolarHBondContact O-N 2.68Å; I261-V263 PolarHBondContact O-N 3.06Å; I261-T264 PolarHBondContact O-N 3.42Å; I261-I265 HydrophobicContact CG2-CD1 3.89Å; I261-I265 WeakPolarHBondContact O-CG1 3.37Å; I261-I265 PolarHBondContact O-N 2.8Å; I261-I265 VanDerWaalsContact O-N 3.08Å; I261-Y316 HydrophobicContact CG2-CD1 4.11Å; I261-Y316 HydrophobicContact CG2-CE1 4.44Å; I261-M319 HydrophobicContact CD1-CB 4.38Å; I261-M319 HydrophobicContact CG1-CB 3.76Å; I261-M319 HydrophobicContact CG1-CG 3.9Å
262	I	70.3	Confident	73.2	Confident	14 Å²	14	70 Å²	70	7%	0.072	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-40.2	-175.8	-51.4	169.8	0	0	0	110.7	I133 R137 Y240 P258 F259 T264 I265 I266	I133-I262 HydrophobicContact CG2-CD1 4.34Å; I133-I262 HydrophobicContact CG2-CG2 4.21Å; R137-I262 HydrophobicContact CG-CD1 3.99Å; Y240-I262 WeakPolarHBondContact OH-CB 3.46Å; Y240-I262 WeakPolarHBondContact OH-CG2 3.5Å; P258-I262 PolarHBondContact O-N 2.96Å; F259-I262 PolarHBondContact O-N 3.08Å; I262-T264 VanDerWaalsContact C-N 3.29Å; I262-T264 PolarHBondContact O-N 3.49Å; I262-I265 PolarHBondContact O-N 3.03Å; I262-I266 HydrophobicContact CG2-CD1 3.87Å; I262-I266 HydrophobicContact CG2-CG1 4.44Å; I262-I266 WeakPolarHBondContact O-CD1 3.37Å; I262-I266 VanDerWaalsContact O-CG1 3.28Å; I262-I266 WeakPolarHBondContact O-CG1 3.45Å; I262-I266 PolarHBondContact O-N 3.45Å
263	V	77.2	Confident	74.8	Confident	40 Å²	40	65.3 Å²	65.3	24%	0.242	33%	0.333	C	S	.	.	H	α-helix	trans	-58.6	-41.6	175	171.3	0	0	0	0	111.4	Y240 F259 I261 I266 I267	Y240-V263 HydrophobicContact CD1-CG2 3.66Å; Y240-V263 HydrophobicContact CE1-CG2 3.41Å; Y240-V263 VanDerWaalsContact CE1-CG2 3.41Å; F259-V263 HydrophobicContact CD1-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.79Å; F259-V263 HydrophobicContact CE2-CG2 4.39Å; F259-V263 HydrophobicContact CZ-CG2 3.96Å; F259-V263 VanDerWaalsContact O-CG2 3.28Å; F259-V263 WeakPolarHBondContact O-CG2 3.46Å; F259-V263 PolarHBondContact O-N 3.33Å; F259-V263 VanDerWaalsContact O-N 3.07Å; I261-V263 PolarHBondContact O-N 3.06Å; V263-I266 PolarHBondContact O-N 3Å; V263-I267 HydrophobicContact CG1-CD1 3.75Å; V263-I267 HydrophobicContact CG1-CG1 4.4Å; V263-I267 VanDerWaalsContact O-CG1 3.3Å; V263-I267 WeakPolarHBondContact O-CG1 3.31Å; V263-I267 PolarHBondContact O-N 2.89Å
264	T	79.6	Confident	76.6	Confident	31 Å²	31	63.1 Å²	63.1	19%	0.19	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-42.6	176.7	-64.5	0	0	0	0	112.2	K260 I261 I262 I266 I267 T268 L315 M319	K260-T264 PolarHBondContact O-N 2.97Å; K260-T264 PolarHBondContact O-OG1 3.29Å; K260-T264 VanDerWaalsContact O-OG1 3.11Å; I261-T264 PolarHBondContact O-N 3.42Å; I262-T264 VanDerWaalsContact C-N 3.29Å; I262-T264 PolarHBondContact O-N 3.49Å; T264-I266 VanDerWaalsContact C-N 3.27Å; T264-I266 PolarHBondContact O-N 2.03Å; T264-I267 PolarHBondContact O-N 3.25Å; T264-T268 WeakPolarHBondContact O-CB 3.34Å; T264-T268 PolarHBondContact O-N 3.18Å; T264-T268 PolarHBondContact O-OG1 2.84Å; T264-T268 VanDerWaalsContact O-OG1 3.08Å; T264-L315 HydrophobicContact CG2-CD1 4.21Å; T264-L315 HydrophobicContact CG2-CD2 3.65Å; T264-L315 HydrophobicContact CG2-CG 4.49Å; T264-M319 VanDerWaalsContact CB-CE 3.41Å; T264-M319 HydrophobicContact CG2-CE 3.5Å; T264-M319 HydrophobicContact CG2-SD 4.14Å; T264-M319 WeakPolarHBondContact OG1-CE 3.4Å
265	I	80.2	Confident	78.5	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-41.6	177.4	-65.3	161.8	0	0	0	110.8	L130 I261 I262 T268 F269 L315 Y316	L130-I265 HydrophobicContact CD1-CG2 4.43Å; L130-I265 HydrophobicContact CD2-CG2 3.57Å; I261-I265 HydrophobicContact CG2-CD1 3.89Å; I261-I265 WeakPolarHBondContact O-CG1 3.37Å; I261-I265 PolarHBondContact O-N 2.8Å; I261-I265 VanDerWaalsContact O-N 3.08Å; I262-I265 PolarHBondContact O-N 3.03Å; I265-T268 PolarHBondContact O-N 3.37Å; I265-F269 WeakPolarHBondContact O-CB 3.11Å; I265-F269 PolarHBondContact O-N 3.07Å; I265-L315 HydrophobicContact CB-CD1 4.48Å; I265-L315 HydrophobicContact CG1-CB 4.15Å; I265-L315 HydrophobicContact CG1-CD1 3.91Å; I265-Y316 HydrophobicContact CD1-CD1 3.9Å; I265-Y316 HydrophobicContact CD1-CE1 3.19Å; I265-Y316 HydrophobicContact CG1-CE1 4.44Å
266	I	82.7	Confident	80.4	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.077	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-48.8	175.9	-70.7	160.7	0	0	0	111.3	I236 Y240 I262 V263 T264 T268 F269 F270	I236-I266 HydrophobicContact CG2-CD1 3.54Å; I236-I266 HydrophobicContact CG2-CG1 4.03Å; I236-I266 HydrophobicContact CG2-CG2 3.72Å; Y240-I266 HydrophobicContact CD2-CD1 3.96Å; Y240-I266 HydrophobicContact CE2-CD1 3.21Å; I262-I266 HydrophobicContact CG2-CD1 3.87Å; I262-I266 HydrophobicContact CG2-CG1 4.44Å; I262-I266 WeakPolarHBondContact O-CD1 3.37Å; I262-I266 VanDerWaalsContact O-CG1 3.28Å; I262-I266 WeakPolarHBondContact O-CG1 3.45Å; I262-I266 PolarHBondContact O-N 3.45Å; V263-I266 PolarHBondContact O-N 3Å; T264-I266 VanDerWaalsContact C-N 3.27Å; T264-I266 PolarHBondContact O-N 2.03Å; I266-T268 VanDerWaalsContact C-N 3.34Å; I266-T268 PolarHBondContact O-N 3.36Å; I266-F269 PolarHBondContact O-N 3.06Å; I266-F270 HydrophobicContact CG2-CD2 3.75Å; I266-F270 HydrophobicContact CG2-CE2 3.67Å; I266-F270 VanDerWaalsContact O-CD2 3.23Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å
267	I	86.7	Confident	82	Confident	104 Å²	104	46.3 Å²	46.3	53%	0.533	23%	0.233	S	C	.	.	H	α-helix	trans	-62.1	-45.2	179.3	-69.9	168.6	0	0	0	110.2	V263 T264 F269 F270 F271	V263-I267 HydrophobicContact CG1-CD1 3.75Å; V263-I267 HydrophobicContact CG1-CG1 4.4Å; V263-I267 VanDerWaalsContact O-CG1 3.3Å; V263-I267 WeakPolarHBondContact O-CG1 3.31Å; V263-I267 PolarHBondContact O-N 2.89Å; T264-I267 PolarHBondContact O-N 3.25Å; I267-F269 VanDerWaalsContact C-N 3.34Å; I267-F269 PolarHBondContact O-N 2.91Å; I267-F270 PolarHBondContact O-N 2.74Å; I267-F271 WeakPolarHBondContact O-CB 3.36Å; I267-F271 PolarHBondContact O-N 2.79Å
268	T	87.3	Confident	83.7	Confident	22 Å²	22	41.7 Å²	41.7	14%	0.135	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-43.7	177.7	-62.1	0	0	0	0	111.3	T264 I265 I266 F271 C272 M311 L315	T264-T268 WeakPolarHBondContact O-CB 3.34Å; T264-T268 PolarHBondContact O-N 3.18Å; T264-T268 PolarHBondContact O-OG1 2.84Å; T264-T268 VanDerWaalsContact O-OG1 3.08Å; I265-T268 PolarHBondContact O-N 3.37Å; I266-T268 VanDerWaalsContact C-N 3.34Å; I266-T268 PolarHBondContact O-N 3.36Å; T268-F271 PolarHBondContact O-N 3.49Å; T268-C272 VanDerWaalsContact O-CB 3.27Å; T268-C272 WeakPolarHBondContact O-CB 3.24Å; T268-C272 PolarHBondContact O-N 3.12Å; T268-C272 PolarHBondContact O-SG 2.84Å; T268-C272 VanDerWaalsContact O-SG 3.33Å; T268-M311 HydrophobicContact CG2-CB 3.93Å; T268-M311 HydrophobicContact CG2-CE 4.23Å; T268-M311 HydrophobicContact CG2-CG 4.14Å; T268-L315 HydrophobicContact CG2-CD1 4.06Å
269	F	86.8	Confident	85.1	Confident	1 Å²	1	40 Å²	40	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-56.4	-56.3	175.6	-177.1	-85.1	0	0	0	111.2	V127 L130 I265 I266 I267 F271 C272 W273 N308	V127-F269 HydrophobicContact CB-CE1 3.78Å; V127-F269 HydrophobicContact CB-CE2 4.16Å; V127-F269 HydrophobicContact CB-CZ 3.46Å; V127-F269 VanDerWaalsContact CB-CZ 3.46Å; V127-F269 HydrophobicContact CG2-CD1 4.19Å; V127-F269 HydrophobicContact CG2-CE1 3.43Å; V127-F269 VanDerWaalsContact CG2-CE1 3.43Å; V127-F269 HydrophobicContact CG2-CZ 3.7Å; L130-F269 HydrophobicContact CD1-CB 3.72Å; L130-F269 HydrophobicContact CD1-CD1 4.38Å; L130-F269 HydrophobicContact CD1-CD2 3.69Å; L130-F269 HydrophobicContact CD1-CE2 4.48Å; L130-F269 HydrophobicContact CD1-CG 3.65Å; I265-F269 WeakPolarHBondContact O-CB 3.11Å; I265-F269 PolarHBondContact O-N 3.07Å; I266-F269 PolarHBondContact O-N 3.06Å; I267-F269 VanDerWaalsContact C-N 3.34Å; I267-F269 PolarHBondContact O-N 2.91Å; F269-F271 VanDerWaalsContact C-N 3.34Å; F269-F271 PolarHBondContact O-N 3.37Å; F269-C272 PolarHBondContact O-N 2.92Å; F269-C272 VanDerWaalsContact O-N 3.13Å; F269-W273 AromaticContact CD1-CD1 3.89Å; F269-W273 AromaticContact CD2-CD1 3.57Å; F269-W273 AromaticContact CD2-NE1 3.66Å; F269-W273 HydrophobicContact CE1-CB 4.34Å; F269-W273 AromaticContact CE1-CD1 3.64Å; F269-W273 HydrophobicContact CE1-CG 4.08Å; F269-W273 AromaticContact CE2-CD1 3.32Å; F269-W273 HydrophobicContact CE2-CG 4.27Å; F269-W273 AromaticContact CE2-NE1 3.21Å; F269-W273 AromaticContact CG-CD1 3.82Å; F269-W273 AromaticContact CZ-CD1 3.32Å; F269-W273 HydrophobicContact CZ-CD2 4.39Å; F269-W273 AromaticContact CZ-CG 3.88Å; F269-W273 HydrophobicContact CZ-CG 3.88Å; F269-W273 AromaticContact CZ-NE1 3.57Å; F269-W273 PolarHBondContact O-N 2.97Å; F269-N308 WeakPolarHBondContact CA-OD1 3.44Å; F269-N308 WeakPolarHBondContact CD2-ND2 3.31Å
270	F	90.4	Very high	86.2	Confident	26 Å²	26	37.3 Å²	37.3	11%	0.114	19%	0.194	C	C	.	.	H	α-helix	trans	-68.9	-33.6	-175.7	-68.3	-55.7	0	0	0	113.1	V127 F229 P232 V233 I236 I266 I267 C272 C274	V127-F270 HydrophobicContact CG2-CE1 4.32Å; V127-F270 HydrophobicContact CG2-CZ 4.47Å; F229-F270 AromaticContact CD2-CD1 3.77Å; F229-F270 HydrophobicContact CD2-CD1 3.77Å; F229-F270 HydrophobicContact CD2-CE1 4.26Å; F229-F270 HydrophobicContact CE2-CB 4.22Å; F229-F270 AromaticContact CE2-CD1 3.59Å; F229-F270 HydrophobicContact CE2-CD1 3.59Å; F229-F270 HydrophobicContact CE2-CE1 4.48Å; F229-F270 HydrophobicContact CE2-CG 4.37Å; F229-F270 HydrophobicContact CZ-CD1 4.23Å; P232-F270 HydrophobicContact CB-CZ 4.35Å; V233-F270 HydrophobicContact CB-CE1 4.23Å; V233-F270 HydrophobicContact CB-CE2 4.38Å; V233-F270 HydrophobicContact CB-CZ 4.04Å; V233-F270 HydrophobicContact CG2-CD1 3.3Å; V233-F270 HydrophobicContact CG2-CD2 3.94Å; V233-F270 HydrophobicContact CG2-CE1 3.09Å; V233-F270 HydrophobicContact CG2-CE2 3.7Å; V233-F270 HydrophobicContact CG2-CG 3.76Å; V233-F270 HydrophobicContact CG2-CZ 3.28Å; I236-F270 HydrophobicContact CD1-CE2 4Å; I236-F270 HydrophobicContact CD1-CZ 3.94Å; I266-F270 HydrophobicContact CG2-CD2 3.75Å; I266-F270 HydrophobicContact CG2-CE2 3.67Å; I266-F270 VanDerWaalsContact O-CD2 3.23Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å; I267-F270 PolarHBondContact O-N 2.74Å; F270-C272 VanDerWaalsContact C-N 3.32Å; F270-C274 WeakPolarHBondContact O-CB 3.35Å; F270-C274 PolarHBondContact O-N 3.4Å
271	F	92.5	Very high	87.2	Confident	141 Å²	141	33.1 Å²	33.1	62%	0.618	18%	0.178	S	C	*	.	H	α-helix	trans	-62.4	-42.2	171.8	-175.9	-97	0	0	0	111.5	I267 T268 F269 P275 L304	I267-F271 WeakPolarHBondContact O-CB 3.36Å; I267-F271 PolarHBondContact O-N 2.79Å; T268-F271 PolarHBondContact O-N 3.49Å; F269-F271 VanDerWaalsContact C-N 3.34Å; F269-F271 PolarHBondContact O-N 3.37Å; F271-P275 WeakPolarHBondContact O-CD 3.39Å; F271-L304 HydrophobicContact CD1-CD2 4.44Å; F271-L304 HydrophobicContact CE1-CD1 4.45Å; F271-L304 HydrophobicContact CE1-CD2 4.24Å
272	C	92.9	Very high	88.2	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-69.7	-39.2	-179.5	-78.4	0	0	0	0	113.4	T268 F269 F270 L304 A305 N308	T268-C272 VanDerWaalsContact O-CB 3.27Å; T268-C272 WeakPolarHBondContact O-CB 3.24Å; T268-C272 PolarHBondContact O-N 3.12Å; T268-C272 PolarHBondContact O-SG 2.84Å; T268-C272 VanDerWaalsContact O-SG 3.33Å; F269-C272 PolarHBondContact O-N 2.92Å; F269-C272 VanDerWaalsContact O-N 3.13Å; F270-C272 VanDerWaalsContact C-N 3.32Å; C272-L304 HydrophobicContact CB-CG 4.32Å; C272-L304 WeakPolarHBondContact CB-O 3.21Å; C272-L304 PolarHBondContact SG-O 3.22Å; C272-L304 VanDerWaalsContact SG-O 3.4Å; C272-A305 PolarHBondContact O-N 2.99Å; C272-N308 HydrophobicContact CB-CB 3.87Å
273	W	93.8	Very high	88.9	Confident	2 Å²	2	36 Å²	36	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-90.7	-21.7	-174.4	-73.1	99.5	0	0	0	114.1	L119 M123 F229 F269 Y276 H277 A305 N308	L119-W273 HydrophobicContact CD1-CH2 4.33Å; M123-W273 HydrophobicContact CB-CE3 4.38Å; M123-W273 HydrophobicContact CB-CH2 3.4Å; M123-W273 HydrophobicContact CB-CZ2 3.69Å; M123-W273 HydrophobicContact CB-CZ3 3.76Å; M123-W273 HydrophobicContact CG-CD2 3.84Å; M123-W273 HydrophobicContact CG-CE3 3.59Å; M123-W273 HydrophobicContact CG-CH2 3.56Å; M123-W273 HydrophobicContact CG-CZ2 3.77Å; M123-W273 HydrophobicContact CG-CZ3 3.45Å; M123-W273 VanDerWaalsContact CG-CZ3 3.45Å; M123-W273 HydrophobicContact SD-CD2 4.43Å; M123-W273 HydrophobicContact SD-CE3 3.67Å; M123-W273 HydrophobicContact SD-CH2 4.22Å; M123-W273 HydrophobicContact SD-CZ3 3.54Å; M123-W273 VanDerWaalsContact SD-CZ3 3.54Å; F229-W273 HydrophobicContact CD2-CB 4.42Å; F269-W273 AromaticContact CD1-CD1 3.89Å; F269-W273 AromaticContact CD2-CD1 3.57Å; F269-W273 AromaticContact CD2-NE1 3.66Å; F269-W273 HydrophobicContact CE1-CB 4.34Å; F269-W273 AromaticContact CE1-CD1 3.64Å; F269-W273 HydrophobicContact CE1-CG 4.08Å; F269-W273 AromaticContact CE2-CD1 3.32Å; F269-W273 HydrophobicContact CE2-CG 4.27Å; F269-W273 AromaticContact CE2-NE1 3.21Å; F269-W273 AromaticContact CG-CD1 3.82Å; F269-W273 AromaticContact CZ-CD1 3.32Å; F269-W273 HydrophobicContact CZ-CD2 4.39Å; F269-W273 AromaticContact CZ-CG 3.88Å; F269-W273 HydrophobicContact CZ-CG 3.88Å; F269-W273 AromaticContact CZ-NE1 3.57Å; F269-W273 PolarHBondContact O-N 2.97Å; W273-Y276 AromaticContact CE3-CD1 3.96Å; W273-Y276 HydrophobicContact CE3-CD1 3.96Å; W273-Y276 HydrophobicContact CE3-CG 4.41Å; W273-Y276 HydrophobicContact CZ3-CD1 4.05Å; W273-Y276 HydrophobicContact CZ3-CE1 4.27Å; W273-Y276 WeakPolarHBondContact O-CB 2.98Å; W273-Y276 PolarHBondContact O-N 3.39Å; W273-H277 PolarHBondContact O-CD2 3.5Å; W273-H277 PolarHBondContact O-N 2.63Å; W273-A305 HydrophobicContact CD2-CB 3.96Å; W273-A305 HydrophobicContact CE3-CB 3.71Å; W273-A305 HydrophobicContact CH2-CB 4.03Å; W273-A305 HydrophobicContact CZ2-CB 4.29Å; W273-A305 HydrophobicContact CZ3-CB 3.76Å; W273-N308 PolarHBondContact NE1-ND2 2.88Å
274	C	94.4	Very high	89.2	Confident	50 Å²	50	34.8 Å²	34.8	34%	0.338	18%	0.184	S	C	.	.	H	α-helix	trans	-56.9	-50.2	-178.2	176	0	0	0	0	112.8	F229 F270 Y276 H277 T278	F229-C274 HydrophobicContact CE2-CB 3.83Å; F229-C274 HydrophobicContact CZ-CB 3.69Å; F270-C274 WeakPolarHBondContact O-CB 3.35Å; F270-C274 PolarHBondContact O-N 3.4Å; C274-Y276 VanDerWaalsContact C-N 3.27Å; C274-Y276 PolarHBondContact O-N 2.94Å; C274-H277 PolarHBondContact O-N 2.71Å; C274-T278 WeakPolarHBondContact O-CB 3.29Å; C274-T278 PolarHBondContact O-N 3.25Å; C274-T278 PolarHBondContact O-OG1 3.31Å
275	P	94.6	Very high	89.3	Confident	46 Å²	46	38.7 Å²	38.7	30%	0.299	20%	0.2	S	C	.	.	H	α-helix	trans	-61.1	-37.5	179.7	-26.1	38.4	0	0	0	112.5	F271 T278 L279 A301 L304	F271-P275 WeakPolarHBondContact O-CD 3.39Å; P275-T278 PolarHBondContact O-N 3.35Å; P275-L279 WeakPolarHBondContact O-CB 3.24Å; P275-L279 WeakPolarHBondContact O-CG 3.28Å; P275-L279 PolarHBondContact O-N 2.91Å; P275-A301 HydrophobicContact CB-CB 3.84Å; P275-L304 HydrophobicContact CG-CD2 3.91Å
276	Y	93.6	Very high	89	Confident	12 Å²	12	44.5 Å²	44.5	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-49.4	177.9	177.3	-95.7	0	0	0	111.1	W273 C274 L279 N280 A305	W273-Y276 AromaticContact CE3-CD1 3.96Å; W273-Y276 HydrophobicContact CE3-CD1 3.96Å; W273-Y276 HydrophobicContact CE3-CG 4.41Å; W273-Y276 HydrophobicContact CZ3-CD1 4.05Å; W273-Y276 HydrophobicContact CZ3-CE1 4.27Å; W273-Y276 WeakPolarHBondContact O-CB 2.98Å; W273-Y276 PolarHBondContact O-N 3.39Å; C274-Y276 VanDerWaalsContact C-N 3.27Å; C274-Y276 PolarHBondContact O-N 2.94Å; Y276-L279 PolarHBondContact O-N 3.45Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.1Å; Y276-N280 PolarHBondContact O-N 2.98Å; Y276-N280 VanDerWaalsContact O-N 3.08Å; Y276-N280 PolarHBondContact O-ND2 3.23Å; Y276-A305 HydrophobicContact CG-CB 4.37Å
277	H	94.1	Very high	88.6	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.019	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-42.2	178.6	-77.2	-65.1	0	0	0	113	F225 F229 W273 C274 L279 N280 L281	F225-H277 HydrophobicContact CD2-CB 3.95Å; F225-H277 HydrophobicContact CE2-CB 4.47Å; F229-H277 AromaticContact CD2-CD2 3.49Å; F229-H277 VanDerWaalsContact CD2-CD2 3.49Å; F229-H277 WeakPolarHBondContact CD2-CD2 3.43Å; F229-H277 AromaticContact CG-CD2 3.79Å; W273-H277 PolarHBondContact O-CD2 3.5Å; W273-H277 PolarHBondContact O-N 2.63Å; C274-H277 PolarHBondContact O-N 2.71Å; H277-L279 PolarHBondContact O-N 3.37Å; H277-N280 PolarHBondContact O-N 2.89Å; H277-L281 WeakPolarHBondContact O-CG 3.32Å; H277-L281 PolarHBondContact O-N 3.39Å
278	T	92.8	Very high	88.1	Confident	66 Å²	66	48.3 Å²	48.3	41%	0.405	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-46.3	178.6	-60	0	0	0	0	111.3	C274 P275 L281 L282	C274-T278 WeakPolarHBondContact O-CB 3.29Å; C274-T278 PolarHBondContact O-N 3.25Å; C274-T278 PolarHBondContact O-OG1 3.31Å; P275-T278 PolarHBondContact O-N 3.35Å; T278-L281 PolarHBondContact O-N 3.29Å; T278-L282 HydrophobicContact CG2-CD1 4.05Å; T278-L282 WeakPolarHBondContact O-CG 3.41Å; T278-L282 PolarHBondContact O-N 3.4Å
279	L	91.5	Very high	87.6	Confident	22 Å²	22	50.6 Å²	50.6	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-38.5	179.9	-69.4	174.7	0	0	0	112.9	P275 Y276 H277 L281 L282 E283 V293 G297 L298 A301	P275-L279 WeakPolarHBondContact O-CB 3.24Å; P275-L279 WeakPolarHBondContact O-CG 3.28Å; P275-L279 PolarHBondContact O-N 2.91Å; Y276-L279 PolarHBondContact O-N 3.45Å; H277-L279 PolarHBondContact O-N 3.37Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 PolarHBondContact O-N 2.86Å; L279-L282 HydrophobicContact CD2-CD1 4.29Å; L279-L282 PolarHBondContact O-N 3.13Å; L279-E283 PolarHBondContact O-N 2.82Å; L279-V293 HydrophobicContact CD2-CG1 3.89Å; L279-G297 WeakPolarHBondContact CD1-O 3.41Å; L279-L298 HydrophobicContact CB-CD1 4.21Å; L279-A301 HydrophobicContact CD1-CB 3.64Å
280	N	89.5	Confident	87.3	Confident	9 Å²	9	54.4 Å²	54.4	5%	0.048	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-33.8	174.1	-80.6	-100.4	0	0	0	111.8	T221 R224 Y276 H277 E283	T221-N280 HydrophobicContact CG2-CB 4.34Å; T221-N280 WeakPolarHBondContact CG2-O 3.35Å; R224-N280 PolarHBondContact NH1-OD1 3.33Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.1Å; Y276-N280 PolarHBondContact O-N 2.98Å; Y276-N280 VanDerWaalsContact O-N 3.08Å; Y276-N280 PolarHBondContact O-ND2 3.23Å; H277-N280 PolarHBondContact O-N 2.89Å; N280-E283 WeakPolarHBondContact O-CB 3.47Å
281	L	91.4	Very high	86.6	Confident	48 Å²	48	55.2 Å²	55.2	25%	0.251	31%	0.314	S	S	.	.	H	α-helix	trans	-69.3	-42.2	173.5	-77.2	169.4	0	0	0	111.8	T221 F225 H277 T278 L279 E283 L284	T221-L281 HydrophobicContact CG2-CD2 4.07Å; T221-L281 HydrophobicContact CG2-CG 4.5Å; F225-L281 HydrophobicContact CB-CD1 4.33Å; F225-L281 HydrophobicContact CB-CD2 4.29Å; F225-L281 HydrophobicContact CB-CG 4.46Å; F225-L281 HydrophobicContact CD1-CD1 4.03Å; F225-L281 HydrophobicContact CD2-CD1 3.7Å; F225-L281 HydrophobicContact CE1-CD1 4.21Å; F225-L281 HydrophobicContact CE2-CD1 3.88Å; F225-L281 HydrophobicContact CG-CD1 3.75Å; F225-L281 HydrophobicContact CG-CD2 4.41Å; F225-L281 HydrophobicContact CG-CG 4.38Å; F225-L281 HydrophobicContact CZ-CD1 4.13Å; H277-L281 WeakPolarHBondContact O-CG 3.32Å; H277-L281 PolarHBondContact O-N 3.39Å; T278-L281 PolarHBondContact O-N 3.29Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 PolarHBondContact O-N 2.86Å; L281-E283 PolarHBondContact O-N 3.5Å; L281-L284 HydrophobicContact CD2-CD1 4.4Å; L281-L284 VanDerWaalsContact O-CB 3.31Å; L281-L284 WeakPolarHBondContact O-CB 3.47Å; L281-L284 PolarHBondContact O-N 3.01Å
282	L	89.4	Confident	85.8	Confident	56 Å²	56	49.9 Å²	49.9	29%	0.293	30%	0.295	S	S	.	.	H	α-helix	trans	-64.1	-29.6	176.4	-72.5	169.7	0	0	0	112.3	T278 L279 L284 H285 H286 M289 F294	T278-L282 HydrophobicContact CG2-CD1 4.05Å; T278-L282 WeakPolarHBondContact O-CG 3.41Å; T278-L282 PolarHBondContact O-N 3.4Å; L279-L282 HydrophobicContact CD2-CD1 4.29Å; L279-L282 PolarHBondContact O-N 3.13Å; L282-L284 PolarHBondContact O-N 3.31Å; L282-H285 CarbonylContact O-C 3.51Å; L282-H285 VanDerWaalsContact O-C 3.23Å; L282-H285 WeakPolarHBondContact O-CA 3.45Å; L282-H285 PolarHBondContact O-N 3Å; L282-H286 PolarHBondContact O-N 3.16Å; L282-M289 HydrophobicContact CD1-CE 4.16Å; L282-M289 HydrophobicContact CD2-CG 4.46Å; L282-F294 HydrophobicContact CB-CE1 4.09Å; L282-F294 HydrophobicContact CB-CZ 4.19Å
283	E	85	Confident	85.4	Confident	52 Å²	52	51.6 Å²	51.6	24%	0.243	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-26.7	175.3	-165.1	179.4	172.2	0	0	112.4	L279 N280 L281 H285 H286 F294	L279-E283 PolarHBondContact O-N 2.82Å; N280-E283 WeakPolarHBondContact O-CB 3.47Å; L281-E283 PolarHBondContact O-N 3.5Å; E283-H285 PolarHBondContact O-N 3.46Å; E283-H286 PolarHBondContact O-N 3.13Å; E283-F294 HydrophobicContact CB-CE1 4.07Å
284	L	84.1	Confident	84.9	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.079	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.7	172.7	-62.4	174.1	0	0	0	112.9	H217 M218 T221 V222 L281 L282	H217-L284 HydrophobicContact CB-CD2 4.44Å; M218-L284 HydrophobicContact CB-CD2 4.33Å; T221-L284 HydrophobicContact CG2-CD1 3.85Å; T221-L284 HydrophobicContact CG2-CD2 4.46Å; T221-L284 HydrophobicContact CG2-CG 4.11Å; V222-L284 HydrophobicContact CG2-CD1 4.43Å; L281-L284 HydrophobicContact CD2-CD1 4.4Å; L281-L284 VanDerWaalsContact O-CB 3.31Å; L281-L284 WeakPolarHBondContact O-CB 3.47Å; L281-L284 PolarHBondContact O-N 3.01Å; L282-L284 PolarHBondContact O-N 3.31Å
285	H	82.1	Confident	84.2	Confident	113 Å²	113	54.2 Å²	54.2	52%	0.523	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	43.9	178.4	-62.2	-70	0	0	0	110.9	L282 E283 T287 A288	L282-H285 CarbonylContact O-C 3.51Å; L282-H285 VanDerWaalsContact O-C 3.23Å; L282-H285 WeakPolarHBondContact O-CA 3.45Å; L282-H285 PolarHBondContact O-N 3Å; E283-H285 PolarHBondContact O-N 3.46Å; H285-T287 PolarHBondContact O-N 3.13Å; H285-A288 HydrophobicContact CB-CB 4.46Å; H285-A288 WeakPolarHBondContact O-CB 3.46Å; H285-A288 PolarHBondContact O-N 2.89Å
286	H	72.9	Confident	83.6	Confident	124 Å²	124	54.2 Å²	54.2	57%	0.574	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-50.8	-27.2	-176	69.6	-79.5	0	0	0	115.1	L282 E283 A288 F294	L282-H286 PolarHBondContact O-N 3.16Å; E283-H286 PolarHBondContact O-N 3.13Å; H286-A288 PolarHBondContact O-N 3.2Å; H286-F294 HydrophobicContact CB-CE2 4.42Å
287	T	74.4	Confident	83.3	Confident	124 Å²	124	54.6 Å²	54.6	76%	0.761	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-70.1	-15.7	177.1	57.2	0	0	0	0	113.9	H285	H285-T287 PolarHBondContact O-N 3.13Å
288	A	76.6	Confident	82.9	Confident	75 Å²	75	56.5 Å²	56.5	62%	0.62	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-90.1	-9.9	-177.8	0	0	0	0	0	113.5	H285 H286	H285-A288 HydrophobicContact CB-CB 4.46Å; H285-A288 WeakPolarHBondContact O-CB 3.46Å; H285-A288 PolarHBondContact O-N 2.89Å; H286-A288 PolarHBondContact O-N 3.2Å
289	M	77.1	Confident	82.7	Confident	70 Å²	70	54.6 Å²	54.6	35%	0.345	32%	0.323	S	S	.	.	S	Bend	trans	-130.7	143.6	-174	-61.8	-63.2	-92.5	0	0	111.1	L282 V293 F294	L282-M289 HydrophobicContact CD1-CE 4.16Å; L282-M289 HydrophobicContact CD2-CG 4.46Å; M289-V293 HydrophobicContact CE-CG1 4.42Å; M289-F294 HydrophobicContact CB-CE2 3.84Å; M289-F294 HydrophobicContact CB-CZ 4.07Å
290	P	80.7	Confident	82.7	Confident	81 Å²	81	57 Å²	57	53%	0.526	34%	0.336	S	S	.	.			trans	-57.8	142	173.6	-22.9	32.4	0	0	0	112.1	S292 V293	P290-S292 PolarHBondContact O-N 3.42Å; P290-S292 VanDerWaalsContact O-N 3.13Å; P290-V293 HydrophobicContact CB-CG2 4.36Å; P290-V293 HydrophobicContact CG-CG2 4.46Å; P290-V293 VanDerWaalsContact O-CB 3.32Å; P290-V293 WeakPolarHBondContact O-CB 3.39Å; P290-V293 PolarHBondContact O-N 3.18Å
291	G	74.4	Confident	82.9	Confident	43 Å²	43	56.9 Å²	56.9	44%	0.443	34%	0.335	S	S	.	.	H	α-helix	trans	-58.1	-27.5	178.8	0	0	0	0	0	114	V293 F294 S295	G291-V293 PolarHBondContact O-N 2.79Å; G291-F294 PolarHBondContact O-N 2.85Å; G291-F294 VanDerWaalsContact O-N 3.13Å; G291-S295 PolarHBondContact O-N 3.44Å; G291-S295 PolarHBondContact O-OG 3.24Å
292	S	76.7	Confident	82.9	Confident	30 Å²	30	55.4 Å²	55.4	21%	0.21	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-31.9	174.8	57	0	0	0	0	113.2	P290 F294 S295 L296	P290-S292 PolarHBondContact O-N 3.42Å; P290-S292 VanDerWaalsContact O-N 3.13Å; S292-F294 VanDerWaalsContact C-N 3.29Å; S292-F294 PolarHBondContact O-N 2.77Å; S292-S295 WeakPolarHBondContact CA-OG 3.27Å; S292-S295 PolarHBondContact O-N 3.49Å; S292-S295 PolarHBondContact O-OG 3.35Å; S292-L296 WeakPolarHBondContact O-CB 3.12Å; S292-L296 PolarHBondContact O-N 3.44Å
293	V	83.5	Confident	83	Confident	42 Å²	42	53 Å²	53	26%	0.255	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-39.3	176.2	177.5	0	0	0	0	110.8	L279 M289 P290 G291 G297	L279-V293 HydrophobicContact CD2-CG1 3.89Å; M289-V293 HydrophobicContact CE-CG1 4.42Å; P290-V293 HydrophobicContact CB-CG2 4.36Å; P290-V293 HydrophobicContact CG-CG2 4.46Å; P290-V293 VanDerWaalsContact O-CB 3.32Å; P290-V293 WeakPolarHBondContact O-CB 3.39Å; P290-V293 PolarHBondContact O-N 3.18Å; G291-V293 PolarHBondContact O-N 2.79Å; V293-G297 WeakPolarHBondContact O-CA 3.39Å; V293-G297 PolarHBondContact O-N 3.01Å
294	F	83.4	Confident	83.5	Confident	35 Å²	35	53.2 Å²	53.2	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-83.6	-37.2	-179.5	-59.7	-69.4	0	0	0	112.1	L282 E283 H286 M289 G291 S292 L296 L298	L282-F294 HydrophobicContact CB-CE1 4.09Å; L282-F294 HydrophobicContact CB-CZ 4.19Å; E283-F294 HydrophobicContact CB-CE1 4.07Å; H286-F294 HydrophobicContact CB-CE2 4.42Å; M289-F294 HydrophobicContact CB-CE2 3.84Å; M289-F294 HydrophobicContact CB-CZ 4.07Å; G291-F294 PolarHBondContact O-N 2.85Å; G291-F294 VanDerWaalsContact O-N 3.13Å; S292-F294 VanDerWaalsContact C-N 3.29Å; S292-F294 PolarHBondContact O-N 2.77Å; F294-L296 PolarHBondContact O-N 2.95Å; F294-L298 VanDerWaalsContact O-CB 3.24Å; F294-L298 WeakPolarHBondContact O-CB 3.13Å; F294-L298 PolarHBondContact O-N 2.95Å
295	S	79.6	Confident	83.9	Confident	72 Å²	72	52.6 Å²	52.6	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-32.6	-179.4	68	0	0	0	0	113.3	G291 S292 P299	G291-S295 PolarHBondContact O-N 3.44Å; G291-S295 PolarHBondContact O-OG 3.24Å; S292-S295 WeakPolarHBondContact CA-OG 3.27Å; S292-S295 PolarHBondContact O-N 3.49Å; S292-S295 PolarHBondContact O-OG 3.35Å; S295-P299 WeakPolarHBondContact O-CD 3.47Å; S295-P299 WeakPolarHBondContact O-CG 3.46Å
296	L	82.3	Confident	84.4	Confident	46 Å²	46	47.3 Å²	47.3	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-96.7	-47.9	173.5	-80.4	176	0	0	0	113.2	L31 T39 S292 F294 P299 L300	L31-L296 HydrophobicContact CD1-CD1 3.49Å; L31-L296 VanDerWaalsContact CD1-CD1 3.49Å; L31-L296 HydrophobicContact CD1-CD2 4.07Å; L31-L296 HydrophobicContact CD1-CG 3.94Å; L31-L296 HydrophobicContact CD2-CD1 4.29Å; L31-L296 HydrophobicContact CD2-CD2 3.38Å; L31-L296 HydrophobicContact CD2-CG 3.78Å; L31-L296 HydrophobicContact CG-CD1 4.49Å; L31-L296 HydrophobicContact CG-CD2 4.37Å; L31-L296 HydrophobicContact CG-CG 4.45Å; T39-L296 HydrophobicContact CG2-CD2 3.98Å; S292-L296 WeakPolarHBondContact O-CB 3.12Å; S292-L296 PolarHBondContact O-N 3.44Å; F294-L296 PolarHBondContact O-N 2.95Å; L296-P299 WeakPolarHBondContact O-CD 3.2Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.42Å; L296-L300 PolarHBondContact O-N 2.84Å
297	G	87	Confident	85.3	Confident	19 Å²	19	42.3 Å²	42.3	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-67.5	-42.3	-169.8	0	0	0	0	0	112.1	L279 V293 L300 A301	L279-G297 WeakPolarHBondContact CD1-O 3.41Å; V293-G297 WeakPolarHBondContact O-CA 3.39Å; V293-G297 PolarHBondContact O-N 3.01Å; G297-L300 PolarHBondContact O-N 3.46Å; G297-A301 WeakPolarHBondContact O-CB 3.08Å; G297-A301 PolarHBondContact O-N 3.02Å
298	L	86.9	Confident	86.1	Confident	45 Å²	45	36.4 Å²	36.4	24%	0.236	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-43.9	-175.7	-170.6	68.8	0	0	0	112.2	L279 F294 T302	L279-L298 HydrophobicContact CB-CD1 4.21Å; F294-L298 VanDerWaalsContact O-CB 3.24Å; F294-L298 WeakPolarHBondContact O-CB 3.13Å; F294-L298 PolarHBondContact O-N 2.95Å; L298-T302 VanDerWaalsContact O-CB 3.28Å; L298-T302 WeakPolarHBondContact O-CB 3.42Å; L298-T302 PolarHBondContact O-N 2.91Å; L298-T302 PolarHBondContact O-OG1 3.41Å
299	P	88.6	Confident	86.7	Confident	25 Å²	25	32.9 Å²	32.9	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-43.3	171.4	-27.3	36.6	0	0	0	113.7	L43 S295 L296 T302 A303	L43-P299 HydrophobicContact CD1-CB 3.6Å; S295-P299 WeakPolarHBondContact O-CD 3.47Å; S295-P299 WeakPolarHBondContact O-CG 3.46Å; L296-P299 WeakPolarHBondContact O-CD 3.2Å; P299-T302 PolarHBondContact O-N 3.34Å; P299-A303 PolarHBondContact O-N 3.5Å
300	L	90.7	Very high	87.1	Confident	74 Å²	74	29.9 Å²	29.9	39%	0.387	19%	0.192	S	C	.	.	H	α-helix	trans	-66.3	-43.6	178.8	-72	171.3	0	0	0	112.3	F42 L43 L296 G297 T302 A303 L304	F42-L300 HydrophobicContact CD1-CD2 4.18Å; F42-L300 HydrophobicContact CE1-CD2 4.01Å; L43-L300 HydrophobicContact CD2-CD2 4.21Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.42Å; L296-L300 PolarHBondContact O-N 2.84Å; G297-L300 PolarHBondContact O-N 3.46Å; L300-T302 VanDerWaalsContact C-N 3.32Å; L300-T302 PolarHBondContact O-N 3.21Å; L300-A303 WeakPolarHBondContact O-CB 3.3Å; L300-A303 PolarHBondContact O-N 3.27Å; L300-L304 PolarHBondContact O-N 2.83Å
301	A	93.4	Very high	87.1	Confident	5 Å²	5	28.9 Å²	28.9	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-65.3	-37.4	175.7	0	0	0	0	0	112	P275 L279 G297 L304 A305	P275-A301 HydrophobicContact CB-CB 3.84Å; L279-A301 HydrophobicContact CD1-CB 3.64Å; G297-A301 WeakPolarHBondContact O-CB 3.08Å; G297-A301 PolarHBondContact O-N 3.02Å; A301-L304 PolarHBondContact O-N 3.43Å; A301-A305 WeakPolarHBondContact O-CB 3.2Å; A301-A305 PolarHBondContact O-N 3.34Å
302	T	91.4	Very high	87.2	Confident	18 Å²	18	27 Å²	27	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-42.3	172.7	-58.6	0	0	0	0	110.7	L298 P299 L300 L304 A305 I306	L298-T302 VanDerWaalsContact O-CB 3.28Å; L298-T302 WeakPolarHBondContact O-CB 3.42Å; L298-T302 PolarHBondContact O-N 2.91Å; L298-T302 PolarHBondContact O-OG1 3.41Å; P299-T302 PolarHBondContact O-N 3.34Å; L300-T302 VanDerWaalsContact C-N 3.32Å; L300-T302 PolarHBondContact O-N 3.21Å; T302-L304 VanDerWaalsContact C-N 3.34Å; T302-L304 PolarHBondContact O-N 2.89Å; T302-A305 PolarHBondContact O-N 3.27Å; T302-I306 HydrophobicContact CG2-CD1 3.79Å; T302-I306 HydrophobicContact CG2-CG1 4.3Å; T302-I306 WeakPolarHBondContact O-CB 3.35Å; T302-I306 VanDerWaalsContact O-CG1 3.24Å; T302-I306 WeakPolarHBondContact O-CG1 3.36Å; T302-I306 PolarHBondContact O-N 3.5Å
303	A	92.8	Very high	86.8	Confident	5 Å²	5	26 Å²	26	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-43.7	174.6	0	0	0	0	0	113.1	L43 V46 Y47 P299 L300 I306 A307	L43-A303 HydrophobicContact CD2-CB 3.5Å; L43-A303 VanDerWaalsContact CD2-CB 3.5Å; V46-A303 HydrophobicContact CG1-CB 4.39Å; Y47-A303 HydrophobicContact CE1-CB 3.77Å; P299-A303 PolarHBondContact O-N 3.5Å; L300-A303 WeakPolarHBondContact O-CB 3.3Å; L300-A303 PolarHBondContact O-N 3.27Å; A303-I306 PolarHBondContact O-N 3.26Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 3.32Å
304	L	94	Very high	86	Confident	56 Å²	56	26.1 Å²	26.1	29%	0.293	15%	0.152	S	C	.	.	H	α-helix	trans	-65.7	-40.8	177.1	-173.3	66.1	0	0	0	112.1	F271 C272 P275 L300 A301 T302 A307 N308	F271-L304 HydrophobicContact CD1-CD2 4.44Å; F271-L304 HydrophobicContact CE1-CD1 4.45Å; F271-L304 HydrophobicContact CE1-CD2 4.24Å; C272-L304 HydrophobicContact CB-CG 4.32Å; C272-L304 WeakPolarHBondContact CB-O 3.21Å; C272-L304 PolarHBondContact SG-O 3.22Å; C272-L304 VanDerWaalsContact SG-O 3.4Å; P275-L304 HydrophobicContact CG-CD2 3.91Å; L300-L304 PolarHBondContact O-N 2.83Å; A301-L304 PolarHBondContact O-N 3.43Å; T302-L304 VanDerWaalsContact C-N 3.34Å; T302-L304 PolarHBondContact O-N 2.89Å; L304-A307 PolarHBondContact O-N 3.03Å; L304-N308 PolarHBondContact O-N 2.76Å
305	A	93.4	Very high	85	Confident	2 Å²	2	25.2 Å²	25.2	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-63.5	-42.4	175.1	0	0	0	0	0	112	C272 W273 Y276 A301 T302 N308	C272-A305 PolarHBondContact O-N 2.99Å; W273-A305 HydrophobicContact CD2-CB 3.96Å; W273-A305 HydrophobicContact CE3-CB 3.71Å; W273-A305 HydrophobicContact CH2-CB 4.03Å; W273-A305 HydrophobicContact CZ2-CB 4.29Å; W273-A305 HydrophobicContact CZ3-CB 3.76Å; Y276-A305 HydrophobicContact CG-CB 4.37Å; A301-A305 WeakPolarHBondContact O-CB 3.2Å; A301-A305 PolarHBondContact O-N 3.34Å; T302-A305 PolarHBondContact O-N 3.27Å; A305-N308 WeakPolarHBondContact O-CB 3.46Å; A305-N308 PolarHBondContact O-N 2.98Å
306	I	92.7	Very high	84.2	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-39.4	177.3	-74	-178.3	0	0	0	111.4	Y47 V50 F88 L92 L119 T302 A303 N308 S309	Y47-I306 HydrophobicContact CD1-CB 4.49Å; Y47-I306 HydrophobicContact CD1-CD1 4.33Å; Y47-I306 HydrophobicContact CD1-CG2 3.94Å; Y47-I306 HydrophobicContact CE1-CB 4.18Å; Y47-I306 HydrophobicContact CE1-CD1 3.7Å; Y47-I306 HydrophobicContact CE1-CG1 4.45Å; Y47-I306 HydrophobicContact CE1-CG2 4.12Å; V50-I306 HydrophobicContact CG1-CG2 3.92Å; F88-I306 HydrophobicContact CE1-CB 4.41Å; F88-I306 HydrophobicContact CE1-CG1 4.21Å; F88-I306 HydrophobicContact CE1-CG2 3.97Å; F88-I306 HydrophobicContact CZ-CB 4.37Å; F88-I306 HydrophobicContact CZ-CD1 4Å; F88-I306 HydrophobicContact CZ-CG1 3.72Å; F88-I306 HydrophobicContact CZ-CG2 4.11Å; L92-I306 HydrophobicContact CD1-CD1 4.04Å; L92-I306 HydrophobicContact CD1-CG2 3.77Å; L92-I306 HydrophobicContact CD2-CG2 3.82Å; L119-I306 HydrophobicContact CD1-CD1 4.11Å; L119-I306 HydrophobicContact CD1-CG1 3.65Å; T302-I306 HydrophobicContact CG2-CD1 3.79Å; T302-I306 HydrophobicContact CG2-CG1 4.3Å; T302-I306 WeakPolarHBondContact O-CB 3.35Å; T302-I306 VanDerWaalsContact O-CG1 3.24Å; T302-I306 WeakPolarHBondContact O-CG1 3.36Å; T302-I306 PolarHBondContact O-N 3.5Å; A303-I306 PolarHBondContact O-N 3.26Å; I306-N308 PolarHBondContact O-N 3.44Å; I306-N308 VanDerWaalsContact O-N 3.17Å; I306-S309 PolarHBondContact O-N 3.3Å; I306-S309 VanDerWaalsContact O-N 3.12Å; I306-S309 PolarHBondContact O-OG 2.92Å
307	A	92.1	Very high	83	Confident	18 Å²	18	21.5 Å²	21.5	15%	0.149	12%	0.123	C	C	.	.	H	α-helix	trans	-59	-26.7	177.4	0	0	0	0	0	113.1	V50 A303 L304 S309 C310 M311	V50-A307 HydrophobicContact CG2-CB 3.86Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 3.32Å; L304-A307 PolarHBondContact O-N 3.03Å; A307-S309 PolarHBondContact O-N 3.16Å; A307-S309 VanDerWaalsContact O-N 3.12Å; A307-C310 PolarHBondContact O-N 3.06Å; A307-C310 VanDerWaalsContact O-N 3.15Å; A307-C310 PolarHBondContact O-SG 3.48Å; A307-M311 WeakPolarHBondContact O-CG 3.45Å; A307-M311 PolarHBondContact O-N 3.5Å
308	N	90.9	Very high	81.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-51.9	-36.8	174.9	-179	69	0	0	0	112.7	F269 C272 W273 L304 A305 I306 C310 M311	F269-N308 WeakPolarHBondContact CA-OD1 3.44Å; F269-N308 WeakPolarHBondContact CD2-ND2 3.31Å; C272-N308 HydrophobicContact CB-CB 3.87Å; W273-N308 PolarHBondContact NE1-ND2 2.88Å; L304-N308 PolarHBondContact O-N 2.76Å; A305-N308 WeakPolarHBondContact O-CB 3.46Å; A305-N308 PolarHBondContact O-N 2.98Å; I306-N308 PolarHBondContact O-N 3.44Å; I306-N308 VanDerWaalsContact O-N 3.17Å; N308-C310 VanDerWaalsContact C-N 3.28Å; N308-C310 PolarHBondContact O-N 3.05Å; N308-M311 PolarHBondContact O-N 3.46Å
309	S	89.2	Confident	79.4	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-65.9	-25.2	-176.3	69.8	0	0	0	0	114.5	N58 D85 N89 I306 A307	N58-S309 PolarHBondContact ND2-O 2.96Å; D85-S309 VanDerWaalsContact OD1-CA 3.3Å; D85-S309 WeakPolarHBondContact OD1-CA 3.48Å; D85-S309 VanDerWaalsContact OD1-CB 3.24Å; D85-S309 WeakPolarHBondContact OD1-CB 3.29Å; N89-S309 PolarHBondContact ND2-OG 3.45Å; N89-S309 VanDerWaalsContact ND2-OG 3.07Å; N89-S309 PolarHBondContact OD1-OG 3.31Å; I306-S309 PolarHBondContact O-N 3.3Å; I306-S309 VanDerWaalsContact O-N 3.12Å; I306-S309 PolarHBondContact O-OG 2.92Å; A307-S309 PolarHBondContact O-N 3.16Å; A307-S309 VanDerWaalsContact O-N 3.12Å
310	C	85.6	Confident	77.4	Confident	7 Å²	7	26.9 Å²	26.9	5%	0.047	15%	0.149	C	C	.	.	H	α-helix	trans	-96.5	-13.9	175.7	73.1	0	0	0	0	113.1	V50 L53 A307 N308 I314	V50-C310 HydrophobicContact CG1-CB 4.12Å; L53-C310 HydrophobicContact CB-CB 3.96Å; A307-C310 PolarHBondContact O-N 3.06Å; A307-C310 VanDerWaalsContact O-N 3.15Å; A307-C310 PolarHBondContact O-SG 3.48Å; N308-C310 VanDerWaalsContact C-N 3.28Å; N308-C310 PolarHBondContact O-N 3.05Å; C310-I314 WeakPolarHBondContact O-CD1 3.35Å; C310-I314 WeakPolarHBondContact O-CG1 3.36Å
311	M	81	Confident	75.2	Confident	60 Å²	60	24.7 Å²	24.7	30%	0.296	14%	0.137	S	C	.	.	H	α-helix	trans	-72.8	-29.4	-179.4	-69.4	-62.8	-76.7	0	0	112.3	T268 A307 N308 I314 L315	T268-M311 HydrophobicContact CG2-CB 3.93Å; T268-M311 HydrophobicContact CG2-CE 4.23Å; T268-M311 HydrophobicContact CG2-CG 4.14Å; A307-M311 WeakPolarHBondContact O-CG 3.45Å; A307-M311 PolarHBondContact O-N 3.5Å; N308-M311 PolarHBondContact O-N 3.46Å; M311-I314 PolarHBondContact O-N 3.23Å; M311-I314 HydrophobicContact SD-CD1 4.42Å; M311-L315 HydrophobicContact CB-CD1 4.41Å; M311-L315 WeakPolarHBondContact O-CB 3.38Å; M311-L315 VanDerWaalsContact O-CG 3.24Å; M311-L315 WeakPolarHBondContact O-CG 3.49Å; M311-L315 PolarHBondContact O-N 3.17Å
312	N	76	Confident	72.6	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-55	-55.1	-177.2	-69.3	-31.4	0	0	0	112.7	D85 I314 L315 Y316	D85-N312 PolarHBondContact OD2-ND2 3.5Å; N312-I314 PolarHBondContact O-N 2.83Å; N312-L315 PolarHBondContact O-N 2.78Å; N312-Y316 HydrophobicContact CB-CE2 4.29Å; N312-Y316 WeakPolarHBondContact O-CD2 3.16Å; N312-Y316 VanDerWaalsContact O-CE2 3.25Å; N312-Y316 WeakPolarHBondContact O-CE2 3.39Å; N312-Y316 PolarHBondContact O-N 3.44Å
313	P	69.4	Low	70.2	Confident	9 Å²	9	37.2 Å²	37.2	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-38.8	174.1	-24.2	34.2	0	0	0	114.9	N58 V61 Y316 V317	N58-P313 WeakPolarHBondContact OD1-CD 3.43Å; N58-P313 WeakPolarHBondContact OD1-CG 3.47Å; V61-P313 HydrophobicContact CG2-CB 4.39Å; V61-P313 HydrophobicContact CG2-CG 4.35Å; P313-Y316 PolarHBondContact O-N 3.43Å; P313-V317 VanDerWaalsContact O-CG2 3.3Å; P313-V317 WeakPolarHBondContact O-CG2 3.46Å; P313-V317 PolarHBondContact O-N 2.86Å
314	I	65.7	Low	67.7	Low	45 Å²	45	47.2 Å²	47.2	23%	0.231	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-47.9	-179.9	-66.1	174.2	0	0	0	109.3	L53 C310 M311 N312 Y316 V317 F318	L53-I314 HydrophobicContact CD1-CD1 4.12Å; C310-I314 WeakPolarHBondContact O-CD1 3.35Å; C310-I314 WeakPolarHBondContact O-CG1 3.36Å; M311-I314 PolarHBondContact O-N 3.23Å; M311-I314 HydrophobicContact SD-CD1 4.42Å; N312-I314 PolarHBondContact O-N 2.83Å; I314-Y316 VanDerWaalsContact C-N 3.32Å; I314-Y316 PolarHBondContact O-N 2.7Å; I314-V317 PolarHBondContact O-N 2.71Å; I314-F318 HydrophobicContact CB-CD2 4.35Å; I314-F318 HydrophobicContact CG2-CD2 3.39Å; I314-F318 HydrophobicContact CG2-CE2 3.58Å; I314-F318 HydrophobicContact CG2-CG 4.31Å; I314-F318 WeakPolarHBondContact O-CB 3.28Å; I314-F318 VanDerWaalsContact O-CD2 3.27Å; I314-F318 WeakPolarHBondContact O-CD2 3.49Å; I314-F318 PolarHBondContact O-N 2.65Å
315	L	61.4	Low	65.2	Low	16 Å²	16	52 Å²	52	8%	0.084	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-37.5	178.5	-69.4	176.5	0	0	0	112.4	T264 I265 T268 M311 N312 V317 M319	T264-L315 HydrophobicContact CG2-CD1 4.21Å; T264-L315 HydrophobicContact CG2-CD2 3.65Å; T264-L315 HydrophobicContact CG2-CG 4.49Å; I265-L315 HydrophobicContact CB-CD1 4.48Å; I265-L315 HydrophobicContact CG1-CB 4.15Å; I265-L315 HydrophobicContact CG1-CD1 3.91Å; T268-L315 HydrophobicContact CG2-CD1 4.06Å; M311-L315 HydrophobicContact CB-CD1 4.41Å; M311-L315 WeakPolarHBondContact O-CB 3.38Å; M311-L315 VanDerWaalsContact O-CG 3.24Å; M311-L315 WeakPolarHBondContact O-CG 3.49Å; M311-L315 PolarHBondContact O-N 3.17Å; N312-L315 PolarHBondContact O-N 2.78Å; L315-V317 VanDerWaalsContact C-N 3.26Å; L315-V317 PolarHBondContact O-N 2.54Å; L315-M319 HydrophobicContact CD2-SD 4.39Å; L315-M319 WeakPolarHBondContact O-CB 3.31Å; L315-M319 PolarHBondContact O-N 2.96Å
316	Y	64	Low	62.9	Low	23 Å²	23	56.6 Å²	56.6	9%	0.09	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-33.6	173.7	-60.5	-45	0	0	0	113	F78 I261 I265 N312 P313 I314	F78-Y316 HydrophobicContact CD1-CE1 4.02Å; F78-Y316 HydrophobicContact CD1-CE2 4.35Å; F78-Y316 AromaticContact CD1-CZ 3.61Å; F78-Y316 WeakPolarHBondContact CD1-OH 3.47Å; F78-Y316 AromaticContact CE1-CE1 3.56Å; F78-Y316 HydrophobicContact CE1-CE1 3.56Å; F78-Y316 AromaticContact CE1-CZ 3.61Å; F78-Y316 VanDerWaalsContact CE1-OH 3.22Å; F78-Y316 WeakPolarHBondContact CE1-OH 3.41Å; F78-Y316 HydrophobicContact CZ-CE1 4.22Å; I261-Y316 HydrophobicContact CG2-CD1 4.11Å; I261-Y316 HydrophobicContact CG2-CE1 4.44Å; I265-Y316 HydrophobicContact CD1-CD1 3.9Å; I265-Y316 HydrophobicContact CD1-CE1 3.19Å; I265-Y316 HydrophobicContact CG1-CE1 4.44Å; N312-Y316 HydrophobicContact CB-CE2 4.29Å; N312-Y316 WeakPolarHBondContact O-CD2 3.16Å; N312-Y316 VanDerWaalsContact O-CE2 3.25Å; N312-Y316 WeakPolarHBondContact O-CE2 3.39Å; N312-Y316 PolarHBondContact O-N 3.44Å; P313-Y316 PolarHBondContact O-N 3.43Å; I314-Y316 VanDerWaalsContact C-N 3.32Å; I314-Y316 PolarHBondContact O-N 2.7Å
317	V	56.7	Low	60.8	Low	18 Å²	18	65 Å²	65	11%	0.109	31%	0.313	C	S	.	.	H	α-helix	trans	-88.4	-45.6	-174.7	174	0	0	0	0	112.2	P313 I314 L315 G320 Q321 F326 L330 L334	P313-V317 VanDerWaalsContact O-CG2 3.3Å; P313-V317 WeakPolarHBondContact O-CG2 3.46Å; P313-V317 PolarHBondContact O-N 2.86Å; I314-V317 PolarHBondContact O-N 2.71Å; L315-V317 VanDerWaalsContact C-N 3.26Å; L315-V317 PolarHBondContact O-N 2.54Å; V317-G320 WeakPolarHBondContact O-CA 2.9Å; V317-G320 PolarHBondContact O-N 3.01Å; V317-Q321 WeakPolarHBondContact O-CG 3.32Å; V317-F326 HydrophobicContact CG1-CE2 4.33Å; V317-L330 HydrophobicContact CB-CD1 4.19Å; V317-L330 HydrophobicContact CG1-CD1 3.63Å; V317-L330 HydrophobicContact CG2-CD1 3.46Å; V317-L330 VanDerWaalsContact CG2-CD1 3.46Å; V317-L334 HydrophobicContact CG2-CD1 4.2Å; V317-L334 HydrophobicContact CG2-CG 4.39Å
318	F	49.4	Very low	58.9	Low	98 Å²	98	70.1 Å²	70.1	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-71.8	-30.8	-175	-84.6	-96.7	0	0	0	112.9	I314 G320 Q321 F323	I314-F318 HydrophobicContact CB-CD2 4.35Å; I314-F318 HydrophobicContact CG2-CD2 3.39Å; I314-F318 HydrophobicContact CG2-CE2 3.58Å; I314-F318 HydrophobicContact CG2-CG 4.31Å; I314-F318 WeakPolarHBondContact O-CB 3.28Å; I314-F318 VanDerWaalsContact O-CD2 3.27Å; I314-F318 WeakPolarHBondContact O-CD2 3.49Å; I314-F318 PolarHBondContact O-N 2.65Å; F318-G320 PolarHBondContact O-N 3.29Å; F318-G320 VanDerWaalsContact O-N 3.12Å; F318-Q321 PolarHBondContact O-N 3.47Å; F318-F323 AromaticContact CD1-CE1 3.95Å; F318-F323 HydrophobicContact CD1-CE1 3.95Å; F318-F323 AromaticContact CD1-CZ 3.68Å; F318-F323 HydrophobicContact CD1-CZ 3.68Å; F318-F323 AromaticContact CE1-CE1 3.49Å; F318-F323 HydrophobicContact CE1-CE1 3.49Å; F318-F323 VanDerWaalsContact CE1-CE1 3.49Å; F318-F323 AromaticContact CE1-CZ 3.66Å; F318-F323 HydrophobicContact CE1-CZ 3.66Å; F318-F323 HydrophobicContact CZ-CE1 4.45Å
319	M	49.4	Very low	57	Low	68 Å²	68	70.6 Å²	70.6	34%	0.335	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.8	169.9	-100.7	75.8	-172.7	0	0	113.6	K260 I261 T264 L315	K260-M319 HydrophobicContact CG-CE 4.45Å; I261-M319 HydrophobicContact CD1-CB 4.38Å; I261-M319 HydrophobicContact CG1-CB 3.76Å; I261-M319 HydrophobicContact CG1-CG 3.9Å; T264-M319 VanDerWaalsContact CB-CE 3.41Å; T264-M319 HydrophobicContact CG2-CE 3.5Å; T264-M319 HydrophobicContact CG2-SD 4.14Å; T264-M319 WeakPolarHBondContact OG1-CE 3.4Å; L315-M319 HydrophobicContact CD2-SD 4.39Å; L315-M319 WeakPolarHBondContact O-CB 3.31Å; L315-M319 PolarHBondContact O-N 2.96Å
320	G	45.1	Very low	55.3	Low	36 Å²	36	72.7 Å²	72.7	37%	0.371	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	9.5	-179.1	0	0	0	0	0	116.1	V317 F318 R333	V317-G320 WeakPolarHBondContact O-CA 2.9Å; V317-G320 PolarHBondContact O-N 3.01Å; F318-G320 PolarHBondContact O-N 3.29Å; F318-G320 VanDerWaalsContact O-N 3.12Å; G320-R333 PolarHBondContact O-NH1 3.25Å
321	Q	45.2	Very low	54	Low	28 Å²	28	76 Å²	76	13%	0.131	37%	0.371	C	S	.	.			trans	-112.9	133.8	-173.3	-67.3	-105.5	-25.8	0	0	113.3	V317 F318 F323	V317-Q321 WeakPolarHBondContact O-CG 3.32Å; F318-Q321 PolarHBondContact O-N 3.47Å; Q321-F323 HydrophobicContact CB-CD2 4.48Å
322	D	38.9	Very low	52.9	Low	146 Å²	146	75.9 Å²	75.9	78%	0.781	38%	0.376	S	S	*	.				-73.3	136.4	101.8	-56.1	-54.6	0	0	0	117.3	K324	D322-K324 PolarHBondContact O-N 3.35Å
323	F	41.8	Very low	52.2	Low	140 Å²	140	80.6 Å²	80.6	61%	0.614	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-77.2	-8.1	-154.1	-85.5	-97	0	0	0	119.7	F318 Q321	F318-F323 AromaticContact CD1-CE1 3.95Å; F318-F323 HydrophobicContact CD1-CE1 3.95Å; F318-F323 AromaticContact CD1-CZ 3.68Å; F318-F323 HydrophobicContact CD1-CZ 3.68Å; F318-F323 AromaticContact CE1-CE1 3.49Å; F318-F323 HydrophobicContact CE1-CE1 3.49Å; F318-F323 VanDerWaalsContact CE1-CE1 3.49Å; F318-F323 AromaticContact CE1-CZ 3.66Å; F318-F323 HydrophobicContact CE1-CZ 3.66Å; F318-F323 HydrophobicContact CZ-CE1 4.45Å; Q321-F323 HydrophobicContact CB-CD2 4.48Å
324	K	39.3	Very low	51.8	Low	214 Å²	214	80.5 Å²	80.5	93%	0.93	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-90.8	-7.3	-171.4	-86.4	-177.3	176.1	179	0	116.4	D322	D322-K324 PolarHBondContact O-N 3.35Å
325	K	43.1	Very low	51.6	Low	157 Å²	157	79.9 Å²	79.9	68%	0.683	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-105.5	22.3	-176.6	-69.3	-175.1	177.2	-180	0	114.2	K327 A329	K325-K327 PolarHBondContact O-N 3.48Å; K325-A329 HydrophobicContact CB-CB 3.95Å; K325-A329 WeakPolarHBondContact O-CB 3.19Å; K325-A329 PolarHBondContact O-N 3.46Å
326	F	43.4	Very low	51.7	Low	98 Å²	98	82.7 Å²	82.7	43%	0.43	41%	0.406	S	S	.	.	H	α-helix	trans	-47.8	-51.1	-159.6	-167.7	-106.5	0	0	0	116.5	V317 L330	V317-F326 HydrophobicContact CG1-CE2 4.33Å; F326-L330 WeakPolarHBondContact O-CA 3.32Å; F326-L330 WeakPolarHBondContact O-CB 3.36Å; F326-L330 PolarHBondContact O-N 2.98Å
327	K	48.6	Very low	51.5	Low	179 Å²	179	83.7 Å²	83.7	78%	0.778	42%	0.419	S	S	*	.	H	α-helix	trans	-76.7	-46.7	-171.2	-67.8	-177.4	-178.6	179.2	0	115	K325	K325-K327 PolarHBondContact O-N 3.48Å
328	V	52.2	Low	51.8	Low	127 Å²	127	83.2 Å²	83.2	77%	0.77	42%	0.416	S	S	*	.	H	α-helix	trans	-74.5	-32.9	177.8	178.4	0	0	0	0	110.7	S332	V328-S332 WeakPolarHBondContact O-CB 3.33Å; V328-S332 PolarHBondContact O-N 3.01Å
329	A	51.6	Low	52.1	Low	10 Å²	10	80.7 Å²	80.7	8%	0.083	41%	0.411	C	S	.	.	H	α-helix	trans	-72.6	-34.4	173.8	0	0	0	0	0	112.6	K325 F331 S332 R333	K325-A329 HydrophobicContact CB-CB 3.95Å; K325-A329 WeakPolarHBondContact O-CB 3.19Å; K325-A329 PolarHBondContact O-N 3.46Å; A329-F331 VanDerWaalsContact C-N 3.32Å; A329-F331 PolarHBondContact O-N 3.26Å; A329-S332 PolarHBondContact O-N 2.89Å; A329-R333 HydrophobicContact CB-CG 4.37Å; A329-R333 WeakPolarHBondContact O-CA 3.47Å; A329-R333 WeakPolarHBondContact O-CB 3.17Å; A329-R333 WeakPolarHBondContact O-CG 3.35Å; A329-R333 PolarHBondContact O-N 3.41Å
330	L	54.1	Low	52.2	Low	45 Å²	45	84.6 Å²	84.6	24%	0.236	43%	0.428	C	S	.	.	H	α-helix	trans	-53.1	-53.9	177.5	-176.5	81.8	0	0	0	110.2	L60 V317 F326 L334	L60-L330 HydrophobicContact CD2-CD2 3.67Å; L60-L330 HydrophobicContact CD2-CG 4.25Å; V317-L330 HydrophobicContact CB-CD1 4.19Å; V317-L330 HydrophobicContact CG1-CD1 3.63Å; V317-L330 HydrophobicContact CG2-CD1 3.46Å; V317-L330 VanDerWaalsContact CG2-CD1 3.46Å; F326-L330 WeakPolarHBondContact O-CA 3.32Å; F326-L330 WeakPolarHBondContact O-CB 3.36Å; F326-L330 PolarHBondContact O-N 2.98Å; L330-L334 HydrophobicContact CD1-CD1 4.44Å; L330-L334 HydrophobicContact CG-CD1 4.32Å; L330-L334 WeakPolarHBondContact O-CB 3.36Å; L330-L334 PolarHBondContact O-N 2.87Å
331	F	58.2	Low	52.3	Low	75 Å²	75	86.3 Å²	86.3	33%	0.329	43%	0.429	S	S	.	.	H	α-helix	trans	-68.9	-47.4	-176.5	-176.9	-92.8	0	0	0	112.1	I64 K68 A329 R333 V335	I64-F331 HydrophobicContact CD1-CD2 3.93Å; I64-F331 HydrophobicContact CD1-CE2 3.9Å; I64-F331 HydrophobicContact CG1-CD2 4.28Å; I64-F331 HydrophobicContact CG1-CE2 3.77Å; K68-F331 HydrophobicContact CD-CE1 4.19Å; K68-F331 HydrophobicContact CD-CE2 3.67Å; K68-F331 HydrophobicContact CD-CZ 3.15Å; K68-F331 HydrophobicContact CG-CZ 4.49Å; A329-F331 VanDerWaalsContact C-N 3.32Å; A329-F331 PolarHBondContact O-N 3.26Å; F331-R333 PolarHBondContact O-N 3.4Å; F331-V335 HydrophobicContact CE1-CG2 4.42Å; F331-V335 HydrophobicContact CZ-CG2 4.1Å; F331-V335 VanDerWaalsContact O-CG2 3.3Å; F331-V335 WeakPolarHBondContact O-CG2 3.28Å; F331-V335 PolarHBondContact O-N 3.33Å
332	S	58.5	Low	52.1	Low	59 Å²	59	89.7 Å²	89.7	41%	0.413	45%	0.451	S	S	.	.	H	α-helix	trans	-67.3	-32.7	178.6	171.6	0	0	0	0	113.2	V328 A329 N336	V328-S332 WeakPolarHBondContact O-CB 3.33Å; V328-S332 PolarHBondContact O-N 3.01Å; A329-S332 PolarHBondContact O-N 2.89Å; S332-N336 PolarHBondContact O-N 2.89Å; S332-N336 VanDerWaalsContact O-N 3.07Å; S332-N336 PolarHBondContact O-ND2 2.93Å; S332-N336 PolarHBondContact O-OD1 2.64Å
333	R	59.3	Low	52.1	Low	101 Å²	101	85.6 Å²	85.6	38%	0.381	44%	0.444	S	S	.	.	H	α-helix	trans	-89.9	-30.2	-175.1	-65.4	-175.1	169.6	167.3	-1.8	114	G320 A329 F331 V335 N336 A337	G320-R333 PolarHBondContact O-NH1 3.25Å; A329-R333 HydrophobicContact CB-CG 4.37Å; A329-R333 WeakPolarHBondContact O-CA 3.47Å; A329-R333 WeakPolarHBondContact O-CB 3.17Å; A329-R333 WeakPolarHBondContact O-CG 3.35Å; A329-R333 PolarHBondContact O-N 3.41Å; F331-R333 PolarHBondContact O-N 3.4Å; R333-V335 PolarHBondContact O-N 2.88Å; R333-N336 PolarHBondContact O-N 2.81Å; R333-A337 VanDerWaalsContact O-CB 3.31Å; R333-A337 WeakPolarHBondContact O-CB 3.34Å; R333-A337 PolarHBondContact O-N 2.9Å
334	L	62	Low	51.9	Low	7 Å²	7	86 Å²	86	4%	0.037	45%	0.447	C	S	.	.	H	α-helix	trans	-57.1	-45.5	164.8	-103.6	153.3	0	0	0	109.7	L60 V61 I64 V317 L330 N336 L338	L60-L334 HydrophobicContact CD2-CD1 3.97Å; L60-L334 HydrophobicContact CG-CD1 4.49Å; V61-L334 HydrophobicContact CG2-CD2 3.93Å; I64-L334 HydrophobicContact CD1-CB 3.98Å; I64-L334 HydrophobicContact CD1-CD1 4.12Å; V317-L334 HydrophobicContact CG2-CD1 4.2Å; V317-L334 HydrophobicContact CG2-CG 4.39Å; L330-L334 HydrophobicContact CD1-CD1 4.44Å; L330-L334 HydrophobicContact CG-CD1 4.32Å; L330-L334 WeakPolarHBondContact O-CB 3.36Å; L330-L334 PolarHBondContact O-N 2.87Å; L334-N336 PolarHBondContact O-N 2.98Å; L334-L338 HydrophobicContact CD2-CD1 4.01Å; L334-L338 VanDerWaalsContact O-CB 3.26Å; L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 WeakPolarHBondContact O-CD1 3.42Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.16Å
335	V	62.1	Low	51.9	Low	32 Å²	32	80.7 Å²	80.7	19%	0.194	44%	0.437	C	S	.	.	H	α-helix	trans	-60.5	-43.7	174.3	173.8	0	0	0	0	111.3	I64 F331 R333 S339	I64-V335 HydrophobicContact CG2-CG2 3.69Å; F331-V335 HydrophobicContact CE1-CG2 4.42Å; F331-V335 HydrophobicContact CZ-CG2 4.1Å; F331-V335 VanDerWaalsContact O-CG2 3.3Å; F331-V335 WeakPolarHBondContact O-CG2 3.28Å; F331-V335 PolarHBondContact O-N 3.33Å; R333-V335 PolarHBondContact O-N 2.88Å; V335-S339 WeakPolarHBondContact O-CB 3.32Å; V335-S339 PolarHBondContact O-N 3.46Å; V335-S339 PolarHBondContact O-OG 3.1Å
336	N	62.5	Low	51.3	Low	76 Å²	76	79 Å²	79	41%	0.406	45%	0.445	S	S	.	.	H	α-helix	trans	-67.8	-45.9	178.5	-67.8	-9.8	0	0	0	113.3	S332 R333 L334 L338 S339 E340	S332-N336 PolarHBondContact O-N 2.89Å; S332-N336 VanDerWaalsContact O-N 3.07Å; S332-N336 PolarHBondContact O-ND2 2.93Å; S332-N336 PolarHBondContact O-OD1 2.64Å; R333-N336 PolarHBondContact O-N 2.81Å; L334-N336 PolarHBondContact O-N 2.98Å; N336-L338 VanDerWaalsContact C-N 3.27Å; N336-L338 PolarHBondContact O-N 3.23Å; N336-S339 WeakPolarHBondContact CA-OG 3.44Å; N336-S339 PolarHBondContact O-N 3.12Å; N336-S339 PolarHBondContact O-OG 3.26Å; N336-E340 WeakPolarHBondContact O-CB 3.16Å; N336-E340 WeakPolarHBondContact O-CG 3.37Å; N336-E340 PolarHBondContact O-N 3.15Å
337	A	60.3	Low	50.8	Low	44 Å²	44	85 Å²	85	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-35.8	179.4	0	0	0	0	0	112.1	R333	R333-A337 VanDerWaalsContact O-CB 3.31Å; R333-A337 WeakPolarHBondContact O-CB 3.34Å; R333-A337 PolarHBondContact O-N 2.9Å
338	L	62.1	Low	50.1	Low	8 Å²	8	82 Å²	82	4%	0.042	47%	0.466	C	S	.	.	H	α-helix	trans	-81.5	-16.9	176.5	-65.2	171	0	0	0	112.8	I64 M69 F78 L334 N336	I64-L338 HydrophobicContact CG2-CD1 4.43Å; M69-L338 HydrophobicContact CE-CB 3.13Å; M69-L338 HydrophobicContact CE-CG 4.43Å; M69-L338 WeakPolarHBondContact CE-O 3.31Å; M69-L338 HydrophobicContact SD-CB 3.25Å; M69-L338 WeakPolarHBondContact SD-CB 3.14Å; M69-L338 HydrophobicContact SD-CD1 3.47Å; M69-L338 WeakPolarHBondContact SD-CD1 3.42Å; M69-L338 HydrophobicContact SD-CG 3.99Å; F78-L338 HydrophobicContact CB-CD2 3.82Å; F78-L338 HydrophobicContact CD2-CD2 3.33Å; F78-L338 HydrophobicContact CE2-CD2 4.02Å; F78-L338 HydrophobicContact CG-CD2 3.71Å; L334-L338 HydrophobicContact CD2-CD1 4.01Å; L334-L338 VanDerWaalsContact O-CB 3.26Å; L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 WeakPolarHBondContact O-CD1 3.42Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.16Å; N336-L338 VanDerWaalsContact C-N 3.27Å; N336-L338 PolarHBondContact O-N 3.23Å
339	S	56.3	Low	49	Very low	45 Å²	45	81.2 Å²	81.2	32%	0.315	47%	0.466	S	S	.	.	H	α-helix	trans	-106.2	-12.6	-176.2	61.9	0	0	0	0	115.7	V335 N336 D341 T342	V335-S339 WeakPolarHBondContact O-CB 3.32Å; V335-S339 PolarHBondContact O-N 3.46Å; V335-S339 PolarHBondContact O-OG 3.1Å; N336-S339 WeakPolarHBondContact CA-OG 3.44Å; N336-S339 PolarHBondContact O-N 3.12Å; N336-S339 PolarHBondContact O-OG 3.26Å; S339-D341 PolarHBondContact O-N 3.13Å; S339-T342 PolarHBondContact O-N 3.4Å; S339-T342 PolarHBondContact O-OG1 3.05Å
340	E	52.5	Low	48.3	Very low	149 Å²	149	89.5 Å²	89.5	70%	0.696	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	8.8	-172.9	-101.7	-175.1	174.6	0	0	116.5	N336	N336-E340 WeakPolarHBondContact O-CB 3.16Å; N336-E340 WeakPolarHBondContact O-CG 3.37Å; N336-E340 PolarHBondContact O-N 3.15Å
341	D	46.9	Very low	47.3	Very low	73 Å²	73	98.8 Å²	98.8	39%	0.39	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	14.3	-178.1	-134.4	31	0	0	0	114.3	N74 R137 R151 S339	N74-D341 WeakPolarHBondContact ND2-CB 3.38Å; N74-D341 PolarHBondContact ND2-OD2 3.4Å; R137-D341 IonicContact CZ-OD2 2.75Å; R137-D341 VanDerWaalsContact NH1-CG 3.35Å; R137-D341 IonicContact NH1-OD1 3.8Å; R137-D341 PolarHBondContact NH1-OD1 3.01Å; R137-D341 IonicContact NH1-OD2 2.71Å; R137-D341 PolarHBondContact NH1-OD2 3.49Å; R137-D341 IonicContact NH2-OD2 3.28Å; R137-D341 PolarHBondContact NH2-OD2 2.83Å; R151-D341 IonicContact NH1-OD2 2.73Å; R151-D341 IonicContact NH2-OD2 3.36Å; S339-D341 PolarHBondContact O-N 3.13Å
342	T	40.8	Very low	46	Very low	98 Å²	98	99.6 Å²	99.6	60%	0.601	55%	0.549	S	S	*	.	S	Bend	trans	-101.3	8.6	-179.2	-27.7	0	0	0	0	113.4	T72 S339	T72-T342 HydrophobicContact CG2-CG2 4.5Å; S339-T342 PolarHBondContact O-N 3.4Å; S339-T342 PolarHBondContact O-OG1 3.05Å
343	G	37.8	Very low	44.8	Very low	61 Å²	61	107 Å²	107	63%	0.629	57%	0.574	S	S	*	*			trans	-121.9	58.1	-166.5	0	0	0	0	0	115.4
344	H	39.4	Very low	43.7	Very low	147 Å²	147	108.1 Å²	108.1	68%	0.681	59%	0.592	S	S	*	*			trans	-124.5	68.9	161.1	-87	-27.4	0	0	0	111.8	K254	K254-H344 PolarHBondContact NZ-CE1 3.45Å; K254-H344 PolarHBondContact NZ-NE2 2.89Å
345	S	38.1	Very low	42.4	Very low	103 Å²	103	117 Å²	117	72%	0.72	63%	0.631	S	S	*	*			trans	-160	105.2	147	60.3	0	0	0	0	108.7
346	S	30.6	Very low	40.8	Very low	121 Å²	121	123.9 Å²	123.9	85%	0.846	66%	0.663	S	S	*	*			trans	179.3	123.9	140.6	-78.1	0	0	0	0	109.1
347	Y	32.2	Very low	39.3	Very low	224 Å²	224	125.1 Å²	125.1	88%	0.878	68%	0.677	S	S	*	*			trans	-42.6	139.9	170.3	-83.2	-106	0	0	0	112.9	S349	Y347-S349 PolarHBondContact O-N 3.29Å
348	P	34.3	Very low	37.8	Very low	118 Å²	118	127.6 Å²	127.6	77%	0.766	69%	0.692	S	S	*	*			trans	-80.9	98.9	158.4	30.5	-23.8	0	0	0	108.1	H350	P348-H350 PolarHBondContact O-N 2.74Å
349	S	30.6	Very low	36.2	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	73%	0.73	S	S	*	*			trans	-66.6	112.7	161.9	57	0	0	0	0	108.1	Y347 R351	Y347-S349 PolarHBondContact O-N 3.29Å; S349-R351 PolarHBondContact O-N 2.93Å
350	H	35	Very low	35	Very low	183 Å²	183	139.3 Å²	139.3	85%	0.847	75%	0.748	S	S	*	*			trans	-48.2	122.9	164.1	-97.8	-106.4	0	0	0	110.3	P348	P348-H350 PolarHBondContact O-N 2.74Å
351	R	33.9	Very low	33.9	Very low	241 Å²	241	139.9 Å²	139.9	91%	0.909	75%	0.75	S	S	*	*			trans	-134	100.7	147.1	-129.8	178.1	-176.5	-176.4	0.5	108.3	S349 F353	S349-R351 PolarHBondContact O-N 2.93Å; R351-F353 PolarHBondContact O-N 3.02Å
352	S	30.7	Very low	33.3	Very low	92 Å²	92	148.3 Å²	148.3	64%	0.643	78%	0.776	S	S	*	*			trans	-58.9	122.7	173.3	47.2	0	0	0	0	110.5
353	F	34.1	Very low	32.9	Very low	215 Å²	215	149.7 Å²	149.7	94%	0.943	79%	0.785	S	S	*	*			trans	-88.8	103.6	157.7	-118.1	-88.2	0	0	0	107.1	R351	R351-F353 PolarHBondContact O-N 3.02Å
354	T	34.8	Very low	32.6	Very low	123 Å²	123	152 Å²	152	76%	0.755	79%	0.792	S	S	*	*			trans	-113.9	118.9	167.1	-24.6	0	0	0	0	107.7
355	K	34.7	Very low	32.3	Very low	195 Å²	195	153.8 Å²	153.8	85%	0.848	80%	0.802	S	S	*	*			trans	-56.7	144.1	166.6	-81.6	173.2	166.7	177.5	0	110.6
356	M	28.7	Very low	32.1	Very low	176 Å²	176	156.5 Å²	156.5	87%	0.867	81%	0.809	S	S	*	*				179.8	131.2	112	-150.9	89	96.2	0	0	112
357	S	30.7	Very low	32.3	Very low	101 Å²	101	159.4 Å²	159.4	71%	0.706	81%	0.809	S	S	*	*			trans	31.2	139.5	135.6	-171.8	0	0	0	0	124
358	S	29.1	Very low	32.4	Very low	96 Å²	96	160 Å²	160	67%	0.671	81%	0.81	S	S	*	*			trans	80.4	114	142.7	67.8	0	0	0	0	121.5
359	M	29.1	Very low	32.4	Very low	174 Å²	174	163 Å²	163	86%	0.857	81%	0.813	S	S	*	*				65.1	106.3	116.9	-154.5	145.8	73.9	0	0	117.2
360	N	30.9	Very low	32.7	Very low	126 Å²	126	164 Å²	164	67%	0.674	82%	0.815	S	S	*	*				-172.2	141.7	111.1	-129.3	10.8	0	0	0	113.9
361	E	30.5	Very low	32.6	Very low	161 Å²	161	159.4 Å²	159.4	75%	0.752	80%	0.804	S	S	*	*			trans	37.6	115.7	141.7	-72	171	144.6	0	0	121
362	R	33.2	Very low	32.7	Very low	249 Å²	249	156.4 Å²	156.4	94%	0.94	80%	0.802	S	S	*	*			trans	-118	93.1	143.4	-88.4	-175.4	178.5	171.1	0	109.5
363	T	33.7	Very low	32.9	Very low	127 Å²	127	164 Å²	164	78%	0.779	83%	0.834	S	S	*	*			trans	14	110.9	134.3	7.4	0	0	0	0	117.1
364	S	30.5	Very low	32.8	Very low	110 Å²	110	161.5 Å²	161.5	77%	0.769	83%	0.829	S	S	*	*			trans	-53.6	130.7	144.3	51.3	0	0	0	0	111.3
365	M	33.4	Very low	32.7	Very low	184 Å²	184	163.5 Å²	163.5	91%	0.906	83%	0.833	S	S	*	*			trans	-174.9	87.2	139.2	-103.1	-179.7	81.9	0	0	107.6
366	N	34.3	Very low	32.6	Very low	161 Å²	161	161.8 Å²	161.8	86%	0.861	83%	0.832	S	S	*	*			trans	-104.3	100.7	161.4	-169.9	42.6	0	0	0	105.4
367	E	34.6	Very low	32.8	Very low	182 Å²	182	160.9 Å²	160.9	85%	0.85	83%	0.83	S	S	*	*			trans	-179.8	104.6	156.3	-103.7	164.5	-163.9	0	0	108.8
368	R	34.4	Very low	32.9	Very low	237 Å²	237	164.7 Å²	164.7	89%	0.894	84%	0.838	S	S	*	*			trans	-116.4	112.6	154	-104.4	-172.9	-170.2	174	3.3	107.1
369	E	34.2	Very low	33.2	Very low	179 Å²	179	169.3 Å²	169.3	84%	0.836	85%	0.849	S	S	*	*			trans	13.7	121.2	140.8	-66.6	174.3	129.7	0	0	118.7
370	T	36.5	Very low	33.5	Very low	131 Å²	131	168.9 Å²	168.9	80%	0.804	85%	0.848	S	S	*	*			trans	-155.6	97.2	131.7	20	0	0	0	0	105.4
371	S	31.9	Very low	33.7	Very low	87 Å²	87	172.2 Å²	172.2	61%	0.608	86%	0.862	S	S	*	*				71.6	107.4	80.9	72.5	0	0	0	0	114.2
372	M	37.5	Very low	34	Very low	178 Å²	178	173.2 Å²	173.2	88%	0.877	87%	0.871	S	S	*	*			trans	70.1	125.7	140.7	-60.2	-174	-141.3	0	0	120.3
373	L	33.3	Very low	34	Very low	253 Å²	253	166.3 Å²	166.3	100%	1.325	87%	0.865	S	S	*	*			trans	86.8	0	162.2	-69.2	158.1	0	0	0	117.2

Retrieved 373 of 373 residues in 138.9 ms (Link to these results)

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