A0A077ZIE4_TRITR Loading...

microtubule-severing ATPase

AlphaFold DB , UniProt , Accession A0A077ZIE4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 394 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	38.2	Very low	233 Å²	233	131.4 Å²	131.4	100%	1.148	82%	0.823	S	S	*	*				0	118.4	0	-74.7	169.3	79.3	0	0	107.9
2	Q	38	Very low	37.9	Very low	184 Å²	184	134.2 Å²	134.2	86%	0.86	83%	0.827	S	S	*	*			trans	37.9	110.9	160.2	-73.5	163.4	-28	0	0	119.7
3	A	37.4	Very low	37.7	Very low	91 Å²	91	133.3 Å²	133.3	75%	0.752	82%	0.82	S	S	*	*				89.2	112.8	79.3	0	0	0	0	0	111.8
4	A	38.9	Very low	37.4	Very low	99 Å²	99	132 Å²	132	82%	0.818	81%	0.812	S	S	*	*				60.7	140.5	78.6	0	0	0	0	0	112.4
5	S	38	Very low	37.1	Very low	93 Å²	93	132.7 Å²	132.7	65%	0.65	82%	0.816	S	S	*	*			cis	176.6	171.1	-2.4	61.6	0	0	0	0	106.4
6	T	39	Very low	36.8	Very low	134 Å²	134	129.5 Å²	129.5	82%	0.822	82%	0.817	S	S	*	*			trans	68.7	153	151.9	58.3	0	0	0	0	119.6
7	A	39.1	Very low	36.5	Very low	88 Å²	88	132 Å²	132	73%	0.727	82%	0.822	S	S	*	*			cis	-170.7	160.7	-12	0	0	0	0	0	109.3
8	S	35.2	Very low	36.2	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	83%	0.827	S	S	*	*			trans	-4.7	148.8	162.6	65.9	0	0	0	0	123.6
9	K	41.1	Very low	35.9	Very low	212 Å²	212	134.3 Å²	134.3	92%	0.922	82%	0.824	S	S	*	*			trans	-166.2	129.1	130.5	-102.3	165.6	-173.4	-177.4	0	110.7
10	G	36	Very low	35.9	Very low	74 Å²	74	135.3 Å²	135.3	76%	0.763	82%	0.819	S	S	*	*			trans	-92.2	-142.2	-177.4	0	0	0	0	0	115
11	P	39.8	Very low	36.5	Very low	125 Å²	125	134 Å²	134	81%	0.812	81%	0.811	S	S	*	*				-120.3	169.7	-109.2	37.7	-25.1	0	0	0	115.4
12	L	34.4	Very low	36.7	Very low	165 Å²	165	129.1 Å²	129.1	86%	0.864	79%	0.786	S	S	*	*			trans	-159.9	99.9	167.5	-97.9	140.2	0	0	0	107.4
13	V	35.5	Very low	37.1	Very low	123 Å²	123	124.3 Å²	124.3	75%	0.745	77%	0.769	S	S	*	*				49.6	122.3	88.8	-160.8	0	0	0	0	114.1
14	V	33.5	Very low	37.6	Very low	115 Å²	115	125.7 Å²	125.7	70%	0.697	76%	0.76	S	S	*	*				155.6	124	121.2	172.7	0	0	0	0	112.5
15	T	33.8	Very low	38	Very low	142 Å²	142	126.6 Å²	126.6	87%	0.871	75%	0.751	S	S	*	*			trans	81.4	123.9	151.4	55.5	0	0	0	0	123.2
16	G	31.1	Very low	38.3	Very low	82 Å²	82	129.9 Å²	129.9	85%	0.845	75%	0.749	S	S	*	*			trans	151.3	18.9	160.2	0	0	0	0	0	118
17	L	31.7	Very low	38.9	Very low	172 Å²	172	128 Å²	128	90%	0.901	73%	0.733	S	S	*	*			trans	-122.3	106.7	175.3	-101.7	155.2	0	0	0	108.8
18	Q	32.4	Very low	39.2	Very low	195 Å²	195	130.4 Å²	130.4	91%	0.911	72%	0.724	S	S	*	*			trans	-169.6	124.6	153.9	-108.3	163.5	-2.6	0	0	110.6
19	C	30	Very low	39.5	Very low	113 Å²	113	132 Å²	132	76%	0.764	72%	0.717	S	S	*	*	S	Bend	trans	78.5	68.8	157.5	-124	0	0	0	0	118.9
20	Q	36.5	Very low	39.6	Very low	153 Å²	153	129 Å²	129	72%	0.715	70%	0.704	S	S	*	*			trans	-135.3	-4	156.6	-76.1	-166.3	-26.1	0	0	115.4	T23	Q20-T23 PolarHBondContact O-OG1 3.44Å
21	T	46.9	Very low	40	Very low	108 Å²	108	129.3 Å²	129.3	66%	0.663	69%	0.688	S	S	*	*	H	α-helix	trans	-83.7	-26.1	-173.8	49.4	0	0	0	0	114.7	T23 D25	T21-T23 VanDerWaalsContact C-N 3.3Å; T21-T23 PolarHBondContact O-N 3.21Å; T21-D25 PolarHBondContact O-N 3.12Å
22	E	42	Very low	40.3	Very low	131 Å²	131	126.7 Å²	126.7	61%	0.612	67%	0.673	S	S	*	*	H	α-helix	trans	-72.6	-23.9	174	-77.8	-168.7	158	0	0	113.2	R26	E22-R26 WeakPolarHBondContact O-CB 3.46Å; E22-R26 VanDerWaalsContact O-CG 3.23Å; E22-R26 WeakPolarHBondContact O-CG 3.35Å; E22-R26 PolarHBondContact O-N 3.39Å
23	T	46.7	Very low	41	Very low	83 Å²	83	121.8 Å²	121.8	51%	0.509	65%	0.65	S	S	.	*	H	α-helix	trans	-78	-40.2	179.4	-5.7	0	0	0	0	110.8	Q20 T21 R26 I27	Q20-T23 PolarHBondContact O-OG1 3.44Å; T21-T23 VanDerWaalsContact C-N 3.3Å; T21-T23 PolarHBondContact O-N 3.21Å; T23-R26 PolarHBondContact O-N 3.25Å; T23-I27 WeakPolarHBondContact O-CB 3.15Å; T23-I27 WeakPolarHBondContact O-CD1 3.42Å; T23-I27 WeakPolarHBondContact O-CG1 3.48Å; T23-I27 PolarHBondContact O-N 2.89Å
24	E	48.4	Very low	41.9	Very low	121 Å²	121	120.9 Å²	120.9	57%	0.565	64%	0.637	S	S	*	*	H	α-helix	trans	-67.8	-40.5	177.4	-69	-168.5	156.3	0	0	112.6	R26 I27 Y28	E24-R26 PolarHBondContact O-N 3.3Å; E24-I27 PolarHBondContact O-N 3.35Å; E24-Y28 WeakPolarHBondContact O-CD2 3.36Å; E24-Y28 PolarHBondContact O-N 3.45Å
25	D	48	Very low	43.1	Very low	118 Å²	118	122.2 Å²	122.2	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-66.2	-37.3	175.5	-82.1	-23.7	0	0	0	112.3	T21 Y28 F29	T21-D25 PolarHBondContact O-N 3.12Å; D25-Y28 PolarHBondContact O-N 2.95Å; D25-F29 WeakPolarHBondContact O-CB 3.38Å; D25-F29 PolarHBondContact O-N 3.29Å
26	R	44	Very low	44	Very low	162 Å²	162	118.3 Å²	118.3	61%	0.611	61%	0.612	S	S	*	*	H	α-helix	trans	-65.2	-40.9	171.3	-75.3	178.8	-174.9	-167.5	6	111.3	E22 T23 E24 Y28 F29 F30	E22-R26 WeakPolarHBondContact O-CB 3.46Å; E22-R26 VanDerWaalsContact O-CG 3.23Å; E22-R26 WeakPolarHBondContact O-CG 3.35Å; E22-R26 PolarHBondContact O-N 3.39Å; T23-R26 PolarHBondContact O-N 3.25Å; E24-R26 PolarHBondContact O-N 3.3Å; R26-Y28 PolarHBondContact O-N 3.44Å; R26-F29 PolarHBondContact O-N 3.45Å; R26-F30 WeakPolarHBondContact O-CB 3.47Å; R26-F30 VanDerWaalsContact O-CD2 3.31Å; R26-F30 WeakPolarHBondContact O-CD2 3.29Å; R26-F30 PolarHBondContact O-N 3.18Å
27	I	50.7	Low	45.3	Very low	93 Å²	93	117.5 Å²	117.5	48%	0.477	59%	0.591	S	S	.	*	H	α-helix	trans	-62.4	-42.1	176	-69.8	161.7	0	0	0	110.6	T23 E24 F30 L31	T23-I27 WeakPolarHBondContact O-CB 3.15Å; T23-I27 WeakPolarHBondContact O-CD1 3.42Å; T23-I27 WeakPolarHBondContact O-CG1 3.48Å; T23-I27 PolarHBondContact O-N 2.89Å; E24-I27 PolarHBondContact O-N 3.35Å; I27-F30 PolarHBondContact O-N 3.48Å; I27-L31 HydrophobicContact CG2-CD1 3.87Å; I27-L31 HydrophobicContact CG2-CG 4.36Å; I27-L31 WeakPolarHBondContact O-CB 3.42Å; I27-L31 VanDerWaalsContact O-CG 3.29Å; I27-L31 WeakPolarHBondContact O-CG 3.27Å; I27-L31 PolarHBondContact O-N 2.88Å
28	Y	45.3	Very low	46.3	Very low	139 Å²	139	114.8 Å²	114.8	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-67.1	-39.9	176.4	-92.8	-79.2	0	0	0	113.2	E24 D25 R26 L31 S32	E24-Y28 WeakPolarHBondContact O-CD2 3.36Å; E24-Y28 PolarHBondContact O-N 3.45Å; D25-Y28 PolarHBondContact O-N 2.95Å; R26-Y28 PolarHBondContact O-N 3.44Å; Y28-L31 PolarHBondContact O-N 3.35Å; Y28-S32 WeakPolarHBondContact O-CB 3.29Å; Y28-S32 PolarHBondContact O-N 3.3Å
29	F	42.2	Very low	47.7	Very low	146 Å²	146	110.1 Å²	110.1	64%	0.64	56%	0.555	S	S	*	*	H	α-helix	trans	-62.5	-44.8	172.8	-175.3	-97.8	0	0	0	110.8	D25 R26 L31 S32 V33	D25-F29 WeakPolarHBondContact O-CB 3.38Å; D25-F29 PolarHBondContact O-N 3.29Å; R26-F29 PolarHBondContact O-N 3.45Å; F29-L31 PolarHBondContact O-N 2.83Å; F29-S32 PolarHBondContact O-N 3.15Å; F29-V33 HydrophobicContact CD1-CG2 4.06Å; F29-V33 HydrophobicContact CE1-CG2 3.72Å; F29-V33 HydrophobicContact CE2-CG2 4.36Å; F29-V33 HydrophobicContact CZ-CG2 3.88Å; F29-V33 WeakPolarHBondContact O-CB 3.43Å; F29-V33 VanDerWaalsContact O-CG2 3.29Å; F29-V33 WeakPolarHBondContact O-CG2 3.48Å; F29-V33 PolarHBondContact O-N 3.25Å
30	F	41.8	Very low	49	Very low	148 Å²	148	108.8 Å²	108.8	65%	0.649	54%	0.539	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174.6	-96.1	-82.8	0	0	0	111.9	R26 I27 S32 V33 E34	R26-F30 WeakPolarHBondContact O-CB 3.47Å; R26-F30 VanDerWaalsContact O-CD2 3.31Å; R26-F30 WeakPolarHBondContact O-CD2 3.29Å; R26-F30 PolarHBondContact O-N 3.18Å; I27-F30 PolarHBondContact O-N 3.48Å; F30-S32 PolarHBondContact O-N 3.43Å; F30-V33 PolarHBondContact O-N 2.85Å; F30-E34 WeakPolarHBondContact O-CB 3.33Å; F30-E34 PolarHBondContact O-N 3.08Å
31	L	45.1	Very low	49.9	Very low	81 Å²	81	106.2 Å²	106.2	42%	0.424	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-34.8	177.2	-73.8	168.2	0	0	0	112.9	I27 Y28 F29 K35	I27-L31 HydrophobicContact CG2-CD1 3.87Å; I27-L31 HydrophobicContact CG2-CG 4.36Å; I27-L31 WeakPolarHBondContact O-CB 3.42Å; I27-L31 VanDerWaalsContact O-CG 3.29Å; I27-L31 WeakPolarHBondContact O-CG 3.27Å; I27-L31 PolarHBondContact O-N 2.88Å; Y28-L31 PolarHBondContact O-N 3.35Å; F29-L31 PolarHBondContact O-N 2.83Å; L31-K35 WeakPolarHBondContact O-CB 3.4Å; L31-K35 WeakPolarHBondContact O-CG 3.49Å; L31-K35 PolarHBondContact O-N 3.04Å
32	S	47.1	Very low	50.6	Low	71 Å²	71	106 Å²	106	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-71.4	-41.9	176.3	-174	0	0	0	0	111.9	Y28 F29 F30 S36	Y28-S32 WeakPolarHBondContact O-CB 3.29Å; Y28-S32 PolarHBondContact O-N 3.3Å; F29-S32 PolarHBondContact O-N 3.15Å; F30-S32 PolarHBondContact O-N 3.43Å; S32-S36 WeakPolarHBondContact O-CB 3.47Å; S32-S36 PolarHBondContact O-N 3.03Å; S32-S36 PolarHBondContact O-OG 3.36Å
33	V	49	Very low	51.4	Low	62 Å²	62	106 Å²	106	38%	0.376	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-42.4	171.8	172.9	0	0	0	0	109.9	F29 F30 S36 V37	F29-V33 HydrophobicContact CD1-CG2 4.06Å; F29-V33 HydrophobicContact CE1-CG2 3.72Å; F29-V33 HydrophobicContact CE2-CG2 4.36Å; F29-V33 HydrophobicContact CZ-CG2 3.88Å; F29-V33 WeakPolarHBondContact O-CB 3.43Å; F29-V33 VanDerWaalsContact O-CG2 3.29Å; F29-V33 WeakPolarHBondContact O-CG2 3.48Å; F29-V33 PolarHBondContact O-N 3.25Å; F30-V33 PolarHBondContact O-N 2.85Å; V33-S36 CarbonylContact O-C 3.58Å; V33-S36 WeakPolarHBondContact O-CB 3.38Å; V33-S36 PolarHBondContact O-N 3.2Å; V33-S36 VanDerWaalsContact O-N 3.16Å; V33-V37 HydrophobicContact CG1-CG2 4.11Å; V33-V37 WeakPolarHBondContact O-CB 3.38Å; V33-V37 VanDerWaalsContact O-CG2 3.23Å; V33-V37 WeakPolarHBondContact O-CG2 3.31Å; V33-V37 PolarHBondContact O-N 3.19Å
34	E	53.6	Low	51.9	Low	103 Å²	103	111 Å²	111	48%	0.481	53%	0.53	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178.7	-162.3	-178.6	-169.3	0	0	111.4	F30 S36 V37 Q38	F30-E34 WeakPolarHBondContact O-CB 3.33Å; F30-E34 PolarHBondContact O-N 3.08Å; E34-S36 VanDerWaalsContact C-N 3.34Å; E34-S36 PolarHBondContact O-N 3.31Å; E34-V37 PolarHBondContact O-N 3.12Å; E34-Q38 VanDerWaalsContact O-CB 3.3Å; E34-Q38 WeakPolarHBondContact O-CB 3.48Å; E34-Q38 VanDerWaalsContact O-CG 3.29Å; E34-Q38 WeakPolarHBondContact O-CG 3.44Å; E34-Q38 PolarHBondContact O-N 3.34Å
35	K	58.8	Low	52.3	Low	143 Å²	143	107.8 Å²	107.8	62%	0.622	52%	0.521	S	S	*	.	H	α-helix	trans	-61.5	-40.1	171.1	-80.4	-177.9	178.9	179.2	0	112.5	L31 Q38 N39	L31-K35 WeakPolarHBondContact O-CB 3.4Å; L31-K35 WeakPolarHBondContact O-CG 3.49Å; L31-K35 PolarHBondContact O-N 3.04Å; K35-Q38 PolarHBondContact O-N 3.11Å; K35-N39 WeakPolarHBondContact O-CB 3.23Å; K35-N39 PolarHBondContact O-N 2.96Å; K35-N39 PolarHBondContact O-ND2 3.25Å
36	S	53	Low	53	Low	60 Å²	60	107.6 Å²	107.6	42%	0.42	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-41.3	177.6	-60.8	0	0	0	0	111.6	S32 V33 E34 N39 I40	S32-S36 WeakPolarHBondContact O-CB 3.47Å; S32-S36 PolarHBondContact O-N 3.03Å; S32-S36 PolarHBondContact O-OG 3.36Å; V33-S36 CarbonylContact O-C 3.58Å; V33-S36 WeakPolarHBondContact O-CB 3.38Å; V33-S36 PolarHBondContact O-N 3.2Å; V33-S36 VanDerWaalsContact O-N 3.16Å; E34-S36 VanDerWaalsContact C-N 3.34Å; E34-S36 PolarHBondContact O-N 3.31Å; S36-N39 PolarHBondContact O-N 3.39Å; S36-I40 VanDerWaalsContact O-CG1 3.25Å; S36-I40 WeakPolarHBondContact O-CG1 3.41Å; S36-I40 PolarHBondContact O-N 3.38Å
37	V	58.1	Low	53.3	Low	66 Å²	66	102.8 Å²	102.8	40%	0.4	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-43.4	174.9	170.2	0	0	0	0	110.4	V33 E34 N39 I40 I41	V33-V37 HydrophobicContact CG1-CG2 4.11Å; V33-V37 WeakPolarHBondContact O-CB 3.38Å; V33-V37 VanDerWaalsContact O-CG2 3.23Å; V33-V37 WeakPolarHBondContact O-CG2 3.31Å; V33-V37 PolarHBondContact O-N 3.19Å; E34-V37 PolarHBondContact O-N 3.12Å; V37-N39 VanDerWaalsContact C-N 3.35Å; V37-N39 PolarHBondContact O-N 3.13Å; V37-I40 CarbonylContact O-C 3.59Å; V37-I40 PolarHBondContact O-N 2.92Å; V37-I41 HydrophobicContact CG1-CD1 3.71Å; V37-I41 HydrophobicContact CG1-CG1 4.28Å; V37-I41 WeakPolarHBondContact O-CB 3.45Å; V37-I41 VanDerWaalsContact O-CG1 3.25Å; V37-I41 WeakPolarHBondContact O-CG1 3.37Å; V37-I41 PolarHBondContact O-N 3.19Å
38	Q	53.2	Low	53.3	Low	114 Å²	114	100.7 Å²	100.7	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-40.8	173.9	-77.3	-174.4	3.5	0	0	111.6	E34 K35 I41 H42	E34-Q38 VanDerWaalsContact O-CB 3.3Å; E34-Q38 WeakPolarHBondContact O-CB 3.48Å; E34-Q38 VanDerWaalsContact O-CG 3.29Å; E34-Q38 WeakPolarHBondContact O-CG 3.44Å; E34-Q38 PolarHBondContact O-N 3.34Å; K35-Q38 PolarHBondContact O-N 3.11Å; Q38-I41 PolarHBondContact O-N 3.45Å; Q38-H42 VanDerWaalsContact O-CB 3.27Å; Q38-H42 WeakPolarHBondContact O-CB 3.18Å; Q38-H42 PolarHBondContact O-N 3.4Å
39	N	60.6	Low	54	Low	98 Å²	98	100.3 Å²	100.3	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-41.5	173	-80.2	-20.5	0	0	0	111.8	K35 S36 V37 H42 Q43	K35-N39 WeakPolarHBondContact O-CB 3.23Å; K35-N39 PolarHBondContact O-N 2.96Å; K35-N39 PolarHBondContact O-ND2 3.25Å; S36-N39 PolarHBondContact O-N 3.39Å; V37-N39 VanDerWaalsContact C-N 3.35Å; V37-N39 PolarHBondContact O-N 3.13Å; N39-H42 PolarHBondContact O-N 3.22Å; N39-Q43 WeakPolarHBondContact O-CB 3.29Å; N39-Q43 VanDerWaalsContact O-CG 3.24Å; N39-Q43 WeakPolarHBondContact O-CG 3.43Å; N39-Q43 PolarHBondContact O-N 3.49Å
40	I	57.4	Low	54.4	Low	84 Å²	84	95 Å²	95	43%	0.431	50%	0.497	S	S	.	.	H	α-helix	trans	-66	-41.8	175.6	-68.8	164	0	0	0	110.9	S36 V37 R44	S36-I40 VanDerWaalsContact O-CG1 3.25Å; S36-I40 WeakPolarHBondContact O-CG1 3.41Å; S36-I40 PolarHBondContact O-N 3.38Å; V37-I40 CarbonylContact O-C 3.59Å; V37-I40 PolarHBondContact O-N 2.92Å; I40-R44 VanDerWaalsContact O-CB 3.29Å; I40-R44 WeakPolarHBondContact O-CB 3.37Å; I40-R44 VanDerWaalsContact O-CG 3.24Å; I40-R44 WeakPolarHBondContact O-CG 3.29Å; I40-R44 PolarHBondContact O-N 3.32Å
41	I	55.5	Low	54.5	Low	100 Å²	100	92.6 Å²	92.6	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-63.9	-43.7	175.7	-69.5	167.3	0	0	0	109.8	V37 Q38 R44 S45	V37-I41 HydrophobicContact CG1-CD1 3.71Å; V37-I41 HydrophobicContact CG1-CG1 4.28Å; V37-I41 WeakPolarHBondContact O-CB 3.45Å; V37-I41 VanDerWaalsContact O-CG1 3.25Å; V37-I41 WeakPolarHBondContact O-CG1 3.37Å; V37-I41 PolarHBondContact O-N 3.19Å; Q38-I41 PolarHBondContact O-N 3.45Å; I41-R44 CarbonylContact O-C 3.15Å; I41-R44 PolarHBondContact O-N 3.19Å; I41-S45 WeakPolarHBondContact O-CB 3.5Å; I41-S45 PolarHBondContact O-N 3.17Å
42	H	61.7	Low	54.9	Low	104 Å²	104	96.3 Å²	96.3	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-47.7	179	-171.1	33.5	0	0	0	110.9	Q38 N39 R44 S45 E46	Q38-H42 VanDerWaalsContact O-CB 3.27Å; Q38-H42 WeakPolarHBondContact O-CB 3.18Å; Q38-H42 PolarHBondContact O-N 3.4Å; N39-H42 PolarHBondContact O-N 3.22Å; H42-R44 VanDerWaalsContact C-N 3.29Å; H42-R44 PolarHBondContact O-N 3.39Å; H42-S45 WeakPolarHBondContact CA-OG 3.42Å; H42-S45 PolarHBondContact ND1-OG 2.85Å; H42-S45 CarbonylContact O-C 3.6Å; H42-S45 WeakPolarHBondContact O-CA 3.27Å; H42-S45 WeakPolarHBondContact O-CB 3.39Å; H42-S45 PolarHBondContact O-N 2.98Å; H42-S45 PolarHBondContact O-OG 3.27Å; H42-E46 IonicContact CE1-OE1 3.87Å; H42-E46 IonicContact NE2-OE1 3.39Å; H42-E46 PolarHBondContact O-N 3Å
43	Q	59.5	Low	55.3	Low	131 Å²	131	99.3 Å²	99.3	61%	0.612	50%	0.502	S	S	*	.	H	α-helix	trans	-57.6	-40.5	172.6	-75.1	176.6	0.4	0	0	112.1	N39 A47	N39-Q43 WeakPolarHBondContact O-CB 3.29Å; N39-Q43 VanDerWaalsContact O-CG 3.24Å; N39-Q43 WeakPolarHBondContact O-CG 3.43Å; N39-Q43 PolarHBondContact O-N 3.49Å; Q43-A47 VanDerWaalsContact O-CB 3.23Å; Q43-A47 WeakPolarHBondContact O-CB 3.3Å; Q43-A47 PolarHBondContact O-N 3.17Å
44	R	56.2	Low	55	Low	186 Å²	186	96.5 Å²	96.5	70%	0.702	49%	0.486	S	S	*	.	H	α-helix	trans	-67.5	-35.8	174.2	-77.7	179.4	172.2	-171.9	-0.8	112.3	I40 I41 H42 A48	I40-R44 VanDerWaalsContact O-CB 3.29Å; I40-R44 WeakPolarHBondContact O-CB 3.37Å; I40-R44 VanDerWaalsContact O-CG 3.24Å; I40-R44 WeakPolarHBondContact O-CG 3.29Å; I40-R44 PolarHBondContact O-N 3.32Å; I41-R44 CarbonylContact O-C 3.15Å; I41-R44 PolarHBondContact O-N 3.19Å; H42-R44 VanDerWaalsContact C-N 3.29Å; H42-R44 PolarHBondContact O-N 3.39Å; R44-A48 VanDerWaalsContact O-CB 3.28Å; R44-A48 WeakPolarHBondContact O-CB 3.46Å; R44-A48 PolarHBondContact O-N 3.36Å
45	S	58.5	Low	54.8	Low	54 Å²	54	94 Å²	94	38%	0.378	48%	0.475	S	S	.	.	H	α-helix	trans	-69.2	-42.8	177.5	77.8	0	0	0	0	111.5	I41 H42 A48 L49	I41-S45 WeakPolarHBondContact O-CB 3.5Å; I41-S45 PolarHBondContact O-N 3.17Å; H42-S45 WeakPolarHBondContact CA-OG 3.42Å; H42-S45 PolarHBondContact ND1-OG 2.85Å; H42-S45 CarbonylContact O-C 3.6Å; H42-S45 WeakPolarHBondContact O-CA 3.27Å; H42-S45 WeakPolarHBondContact O-CB 3.39Å; H42-S45 PolarHBondContact O-N 2.98Å; H42-S45 PolarHBondContact O-OG 3.27Å; S45-A48 PolarHBondContact O-N 3.49Å; S45-L49 WeakPolarHBondContact O-CB 3.49Å; S45-L49 PolarHBondContact O-N 3.39Å
46	E	62.6	Low	54.4	Low	115 Å²	115	96 Å²	96	54%	0.537	48%	0.478	S	S	.	.	H	α-helix	trans	-64.6	-43.5	173.7	-71.7	-168.4	143.2	0	0	110.5	H42 A48 L49 A50	H42-E46 IonicContact CE1-OE1 3.87Å; H42-E46 IonicContact NE2-OE1 3.39Å; H42-E46 PolarHBondContact O-N 3Å; E46-A48 VanDerWaalsContact C-N 3.3Å; E46-A48 PolarHBondContact O-N 2.93Å; E46-L49 PolarHBondContact O-N 2.89Å; E46-A50 WeakPolarHBondContact O-CB 3.4Å; E46-A50 PolarHBondContact O-N 2.9Å
47	A	49	Very low	54.3	Low	61 Å²	61	97.7 Å²	97.7	50%	0.504	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-39.1	172.8	0	0	0	0	0	111.9	Q43 Y51	Q43-A47 VanDerWaalsContact O-CB 3.23Å; Q43-A47 WeakPolarHBondContact O-CB 3.3Å; Q43-A47 PolarHBondContact O-N 3.17Å; A47-Y51 WeakPolarHBondContact O-CB 3.36Å; A47-Y51 PolarHBondContact O-N 3.45Å
48	A	51.4	Low	53.7	Low	48 Å²	48	97.8 Å²	97.8	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-69.9	-36.5	176.3	0	0	0	0	0	112.6	R44 S45 E46 Y51 K52	R44-A48 VanDerWaalsContact O-CB 3.28Å; R44-A48 WeakPolarHBondContact O-CB 3.46Å; R44-A48 PolarHBondContact O-N 3.36Å; S45-A48 PolarHBondContact O-N 3.49Å; E46-A48 VanDerWaalsContact C-N 3.3Å; E46-A48 PolarHBondContact O-N 2.93Å; A48-Y51 WeakPolarHBondContact O-CB 3.48Å; A48-Y51 PolarHBondContact O-N 3.4Å; A48-K52 WeakPolarHBondContact O-CG 3.32Å; A48-K52 PolarHBondContact O-N 2.75Å
49	L	59.8	Low	53.4	Low	132 Å²	132	99.3 Å²	99.3	69%	0.691	48%	0.482	S	S	*	.	H	α-helix	trans	-70.2	-43.7	175.2	-139.9	104.8	0	0	0	110.7	S45 E46 Y51 K52 K53	S45-L49 WeakPolarHBondContact O-CB 3.49Å; S45-L49 PolarHBondContact O-N 3.39Å; E46-L49 PolarHBondContact O-N 2.89Å; L49-Y51 VanDerWaalsContact C-N 3.27Å; L49-Y51 PolarHBondContact O-N 3.28Å; L49-K52 PolarHBondContact O-N 3.33Å; L49-K53 WeakPolarHBondContact O-CB 3.39Å; L49-K53 PolarHBondContact O-N 3.48Å
50	A	49.6	Very low	52.6	Low	33 Å²	33	99.2 Å²	99.2	27%	0.273	48%	0.482	S	S	.	.	H	α-helix	trans	-61.1	-37.1	172.4	0	0	0	0	0	111.3	E46 G54 K96	E46-A50 WeakPolarHBondContact O-CB 3.4Å; E46-A50 PolarHBondContact O-N 2.9Å; A50-G54 PolarHBondContact O-N 3.5Å; A50-K96 PolarHBondContact O-NZ 3.4Å
51	Y	44.6	Very low	51.8	Low	99 Å²	99	97.5 Å²	97.5	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-51.3	172.1	176.1	-95.9	0	0	0	111.5	A47 A48 L49 K53 G54 I55	A47-Y51 WeakPolarHBondContact O-CB 3.36Å; A47-Y51 PolarHBondContact O-N 3.45Å; A48-Y51 WeakPolarHBondContact O-CB 3.48Å; A48-Y51 PolarHBondContact O-N 3.4Å; L49-Y51 VanDerWaalsContact C-N 3.27Å; L49-Y51 PolarHBondContact O-N 3.28Å; Y51-K53 VanDerWaalsContact C-N 3.33Å; Y51-K53 PolarHBondContact O-N 3.38Å; Y51-G54 PolarHBondContact O-N 2.91Å; Y51-G54 VanDerWaalsContact O-N 3.12Å; Y51-I55 HydrophobicContact CD1-CD1 4.44Å; Y51-I55 HydrophobicContact CE1-CD1 3.64Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 HydrophobicContact CE2-CD1 4.12Å; Y51-I55 HydrophobicContact CE2-CG1 4.48Å; Y51-I55 VanDerWaalsContact CZ-CD1 3.46Å; Y51-I55 PolarHBondContact O-N 3.49Å; Y51-I55 WeakPolarHBondContact OH-CD1 3.32Å
52	K	53.5	Low	50.8	Low	159 Å²	159	97.7 Å²	97.7	69%	0.691	49%	0.486	S	S	*	.	H	α-helix	trans	-59.1	-42.3	176.1	-76.7	-177.7	179.7	179.9	0	112.1	A48 L49 I55 R56	A48-K52 WeakPolarHBondContact O-CG 3.32Å; A48-K52 PolarHBondContact O-N 2.75Å; L49-K52 PolarHBondContact O-N 3.33Å; K52-I55 PolarHBondContact O-N 2.75Å; K52-R56 PolarHBondContact O-N 2.87Å
53	K	56.2	Low	49.6	Very low	133 Å²	133	95.8 Å²	95.8	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-42.3	175.1	-170.6	179.3	178.7	-173.7	0	111.2	L49 Y51 R56 E57	L49-K53 WeakPolarHBondContact O-CB 3.39Å; L49-K53 PolarHBondContact O-N 3.48Å; Y51-K53 VanDerWaalsContact C-N 3.33Å; Y51-K53 PolarHBondContact O-N 3.38Å; K53-R56 PolarHBondContact O-N 3.49Å; K53-E57 WeakPolarHBondContact CE-OE1 3.18Å; K53-E57 WeakPolarHBondContact O-CB 3.32Å; K53-E57 WeakPolarHBondContact O-CG 3.39Å; K53-E57 PolarHBondContact O-N 3.16Å
54	G	42.6	Very low	48.5	Very low	4 Å²	4	95 Å²	95	4%	0.041	49%	0.493	C	S	.	.	H	α-helix	trans	-63.3	-42	176.4	0	0	0	0	0	114.4	A50 Y51 R56 E57 L58 K96	A50-G54 PolarHBondContact O-N 3.5Å; Y51-G54 PolarHBondContact O-N 2.91Å; Y51-G54 VanDerWaalsContact O-N 3.12Å; G54-R56 VanDerWaalsContact C-N 3.31Å; G54-E57 PolarHBondContact O-N 2.95Å; G54-L58 WeakPolarHBondContact O-CB 3.42Å; G54-L58 PolarHBondContact O-N 2.75Å; G54-K96 VanDerWaalsContact N-NZ 3.18Å
55	I	49.6	Very low	47.3	Very low	50 Å²	50	94.1 Å²	94.1	26%	0.256	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-38.4	173.8	-71	-158.8	0	0	0	110.8	Y51 K52 K59	Y51-I55 HydrophobicContact CD1-CD1 4.44Å; Y51-I55 HydrophobicContact CE1-CD1 3.64Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 HydrophobicContact CE2-CD1 4.12Å; Y51-I55 HydrophobicContact CE2-CG1 4.48Å; Y51-I55 VanDerWaalsContact CZ-CD1 3.46Å; Y51-I55 PolarHBondContact O-N 3.49Å; Y51-I55 WeakPolarHBondContact OH-CD1 3.32Å; K52-I55 PolarHBondContact O-N 2.75Å; I55-K59 HydrophobicContact CG2-CD 4.31Å; I55-K59 WeakPolarHBondContact O-CB 3.49Å; I55-K59 VanDerWaalsContact O-CG 3.3Å; I55-K59 WeakPolarHBondContact O-CG 3.46Å; I55-K59 PolarHBondContact O-N 2.75Å
56	R	50	Low	46	Very low	184 Å²	184	98.7 Å²	98.7	69%	0.694	51%	0.514	S	S	*	.	H	α-helix	trans	-66.4	-41.1	175.4	-168.9	179.9	-88.2	170.3	-8.3	111.5	K52 K53 G54 K59 N60	K52-R56 PolarHBondContact O-N 2.87Å; K53-R56 PolarHBondContact O-N 3.49Å; G54-R56 VanDerWaalsContact C-N 3.31Å; R56-K59 PolarHBondContact O-N 3.34Å; R56-N60 WeakPolarHBondContact O-CB 3.25Å; R56-N60 PolarHBondContact O-N 3.45Å; R56-N60 PolarHBondContact O-OD1 3.33Å
57	E	50.9	Low	44.6	Very low	97 Å²	97	97.7 Å²	97.7	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-68.1	-38.8	175.7	-74.2	166.5	173.3	0	0	112.7	K53 G54 N60 G61 K96	K53-E57 WeakPolarHBondContact CE-OE1 3.18Å; K53-E57 WeakPolarHBondContact O-CB 3.32Å; K53-E57 WeakPolarHBondContact O-CG 3.39Å; K53-E57 PolarHBondContact O-N 3.16Å; G54-E57 PolarHBondContact O-N 2.95Å; E57-N60 PolarHBondContact O-N 3.4Å; E57-G61 PolarHBondContact O-N 2.84Å; E57-K96 IonicContact OE2-NZ 3.86Å
58	L	46.1	Very low	43.8	Very low	68 Å²	68	100.1 Å²	100.1	36%	0.356	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-46.1	172.2	-87.3	157.5	0	0	0	110.7	G54 N60 G61 L62	G54-L58 WeakPolarHBondContact O-CB 3.42Å; G54-L58 PolarHBondContact O-N 2.75Å; L58-N60 VanDerWaalsContact C-N 3.33Å; L58-N60 PolarHBondContact O-N 2.66Å; L58-G61 PolarHBondContact O-N 2.85Å; L58-L62 WeakPolarHBondContact O-CB 3.23Å; L58-L62 VanDerWaalsContact O-CD1 3.3Å; L58-L62 WeakPolarHBondContact O-CD1 3.25Å; L58-L62 WeakPolarHBondContact O-CG 3.37Å; L58-L62 PolarHBondContact O-N 3.26Å
59	K	45.4	Very low	43	Very low	145 Å²	145	102 Å²	102	63%	0.63	54%	0.54	S	S	*	.	H	α-helix	trans	-60.6	-40.9	174.7	-77.5	-176.2	175.6	-167.4	0	112.2	I55 R56 A63	I55-K59 HydrophobicContact CG2-CD 4.31Å; I55-K59 WeakPolarHBondContact O-CB 3.49Å; I55-K59 VanDerWaalsContact O-CG 3.3Å; I55-K59 WeakPolarHBondContact O-CG 3.46Å; I55-K59 PolarHBondContact O-N 2.75Å; R56-K59 PolarHBondContact O-N 3.34Å; K59-A63 PolarHBondContact O-N 3.11Å
60	N	45.4	Very low	41.8	Very low	97 Å²	97	104.2 Å²	104.2	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-74.2	-36.8	178.9	-69.3	-0.3	0	0	0	112.2	R56 E57 L58 L62 A63 V64	R56-N60 WeakPolarHBondContact O-CB 3.25Å; R56-N60 PolarHBondContact O-N 3.45Å; R56-N60 PolarHBondContact O-OD1 3.33Å; E57-N60 PolarHBondContact O-N 3.4Å; L58-N60 VanDerWaalsContact C-N 3.33Å; L58-N60 PolarHBondContact O-N 2.66Å; N60-L62 VanDerWaalsContact C-N 3.32Å; N60-A63 PolarHBondContact O-N 3.02Å; N60-A63 VanDerWaalsContact O-N 3.12Å; N60-V64 WeakPolarHBondContact O-CG2 3.5Å; N60-V64 PolarHBondContact O-N 3.4Å
61	G	39.3	Very low	41.2	Very low	47 Å²	47	104.7 Å²	104.7	49%	0.485	55%	0.548	S	S	.	.	H	α-helix	trans	-68.6	-31.7	175.4	0	0	0	0	0	112.6	E57 L58 A63 V64	E57-G61 PolarHBondContact O-N 2.84Å; L58-G61 PolarHBondContact O-N 2.85Å; G61-A63 VanDerWaalsContact C-N 3.27Å; G61-V64 PolarHBondContact O-N 3.47Å
62	L	35.7	Very low	40.8	Very low	104 Å²	104	101.9 Å²	101.9	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-69.1	-24.6	169.6	-74.8	160.6	0	0	0	112.7	L58 N60	L58-L62 WeakPolarHBondContact O-CB 3.23Å; L58-L62 VanDerWaalsContact O-CD1 3.3Å; L58-L62 WeakPolarHBondContact O-CD1 3.25Å; L58-L62 WeakPolarHBondContact O-CG 3.37Å; L58-L62 PolarHBondContact O-N 3.26Å; N60-L62 VanDerWaalsContact C-N 3.32Å
63	A	35.1	Very low	39.9	Very low	64 Å²	64	100.6 Å²	100.6	53%	0.529	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.1	178.5	0	0	0	0	0	113.8	K59 N60 G61	K59-A63 PolarHBondContact O-N 3.11Å; N60-A63 PolarHBondContact O-N 3.02Å; N60-A63 VanDerWaalsContact O-N 3.12Å; G61-A63 VanDerWaalsContact C-N 3.27Å
64	V	36.2	Very low	39.3	Very low	116 Å²	116	97.4 Å²	97.4	70%	0.703	54%	0.54	S	S	*	.	S	Bend	trans	-118.7	75	179.4	-175.1	0	0	0	0	109.2	N60 G61	N60-V64 WeakPolarHBondContact O-CG2 3.5Å; N60-V64 PolarHBondContact O-N 3.4Å; G61-V64 PolarHBondContact O-N 3.47Å
65	K	33	Very low	39.4	Very low	166 Å²	166	100.6 Å²	100.6	72%	0.722	55%	0.551	S	S	*	*			trans	174.9	69.6	150.2	-96.8	176.8	-178	-169.2	0	107.5	S67	K65-S67 VanDerWaalsContact C-N 3.25Å; K65-S67 PolarHBondContact O-N 2.95Å
66	D	30.4	Very low	39.2	Very low	151 Å²	151	103.1 Å²	103.1	81%	0.807	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	83.8	164.7	-79.1	-33.4	0	0	0	108.5
67	S	32.4	Very low	39.2	Very low	94 Å²	94	97.6 Å²	97.6	66%	0.657	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	-5.1	160.8	56.2	0	0	0	0	113.7	K65	K65-S67 VanDerWaalsContact C-N 3.25Å; K65-S67 PolarHBondContact O-N 2.95Å
68	D	32.7	Very low	39.2	Very low	111 Å²	111	95.7 Å²	95.7	59%	0.594	55%	0.547	S	S	*	.			trans	-135.8	70.9	178.5	-67.2	-49.2	0	0	0	112.1	Q70 S71	D68-Q70 PolarHBondContact O-N 2.89Å; D68-Q70 VanDerWaalsContact O-N 3.11Å; D68-S71 PolarHBondContact O-N 3.37Å; D68-S71 PolarHBondContact O-OG 3Å
69	A	34.3	Very low	39.4	Very low	87 Å²	87	93.7 Å²	93.7	72%	0.719	54%	0.536	S	S	*	.	H	α-helix	trans	-58.1	-23.6	-177.2	0	0	0	0	0	114.5	S71	A69-S71 VanDerWaalsContact C-N 3.34Å
70	Q	34.3	Very low	39.9	Very low	180 Å²	180	94.9 Å²	94.9	84%	0.841	54%	0.541	S	S	*	.	H	α-helix	trans	-76.4	-20.2	177.9	-70.9	177.7	-0.3	0	0	113.5	D68	D68-Q70 PolarHBondContact O-N 2.89Å; D68-Q70 VanDerWaalsContact O-N 3.11Å
71	S	37.7	Very low	40.4	Very low	42 Å²	42	95.9 Å²	95.9	29%	0.294	55%	0.547	S	S	.	.	H	α-helix	trans	-86.9	-23	-178.4	68.7	0	0	0	0	113.1	D68 A69 R75	D68-S71 PolarHBondContact O-N 3.37Å; D68-S71 PolarHBondContact O-OG 3Å; A69-S71 VanDerWaalsContact C-N 3.34Å; S71-R75 VanDerWaalsContact O-CG 3.26Å; S71-R75 WeakPolarHBondContact O-CG 3.5Å; S71-R75 PolarHBondContact O-N 2.65Å; S71-R75 PolarHBondContact O-NE 3.38Å; S71-R75 VanDerWaalsContact O-NE 3.08Å; S71-R75 PolarHBondContact OG-NH2 3.29Å
72	A	35.3	Very low	41.5	Very low	40 Å²	40	94.2 Å²	94.2	33%	0.331	53%	0.526	S	S	.	.	H	α-helix	trans	-71.7	-38.9	-179.6	0	0	0	0	0	112.5	S74 R75 D76	A72-S74 VanDerWaalsContact C-N 3.34Å; A72-S74 PolarHBondContact O-N 2.9Å; A72-R75 WeakPolarHBondContact O-CB 3.42Å; A72-R75 PolarHBondContact O-N 3.34Å; A72-D76 PolarHBondContact O-N 3.13Å
73	D	36.1	Very low	43	Very low	132 Å²	132	93.5 Å²	93.5	71%	0.706	52%	0.523	S	S	*	.	H	α-helix	trans	-69.9	-33.4	-179.2	-145.9	11.6	0	0	0	111.9	S77	D73-S77 WeakPolarHBondContact O-CB 3.29Å; D73-S77 PolarHBondContact O-N 3.2Å
74	S	42.2	Very low	44.7	Very low	67 Å²	67	94.8 Å²	94.8	47%	0.469	53%	0.529	S	S	.	.	H	α-helix	trans	-67.2	-35.1	172.1	-63.1	0	0	0	0	112.5	A72 S77 I78	A72-S74 VanDerWaalsContact C-N 3.34Å; A72-S74 PolarHBondContact O-N 2.9Å; S74-S77 PolarHBondContact O-N 2.74Å; S74-I78 VanDerWaalsContact O-CG1 3.31Å; S74-I78 WeakPolarHBondContact O-CG1 3.28Å; S74-I78 PolarHBondContact O-N 2.91Å; S74-I78 VanDerWaalsContact O-N 3.11Å
75	R	44.9	Very low	46.3	Very low	71 Å²	71	96 Å²	96	27%	0.268	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-45.5	-179.4	-77.5	175.6	-109.7	155.9	-11.9	111.6	S71 A72 M79 L195	S71-R75 VanDerWaalsContact O-CG 3.26Å; S71-R75 WeakPolarHBondContact O-CG 3.5Å; S71-R75 PolarHBondContact O-N 2.65Å; S71-R75 PolarHBondContact O-NE 3.38Å; S71-R75 VanDerWaalsContact O-NE 3.08Å; S71-R75 PolarHBondContact OG-NH2 3.29Å; A72-R75 WeakPolarHBondContact O-CB 3.42Å; A72-R75 PolarHBondContact O-N 3.34Å; R75-M79 WeakPolarHBondContact O-CG 3.23Å; R75-M79 PolarHBondContact O-N 3.05Å; R75-L195 HydrophobicContact CG-CD1 3.91Å
76	D	46.6	Very low	47.8	Very low	102 Å²	102	89.4 Å²	89.4	55%	0.545	50%	0.497	S	S	.	.	H	α-helix	trans	-69.8	-33.9	178.2	-86.8	-14.9	0	0	0	112.3	A72 M79 K80	A72-D76 PolarHBondContact O-N 3.13Å; D76-M79 PolarHBondContact O-N 3.34Å; D76-K80 VanDerWaalsContact O-CG 3.27Å; D76-K80 WeakPolarHBondContact O-CG 3.24Å; D76-K80 PolarHBondContact O-N 3.33Å
77	S	48.9	Very low	49.6	Very low	68 Å²	68	86 Å²	86	48%	0.476	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-45.4	176	-171.7	0	0	0	0	112.7	D73 S74 M79 K80	D73-S77 WeakPolarHBondContact O-CB 3.29Å; D73-S77 PolarHBondContact O-N 3.2Å; S74-S77 PolarHBondContact O-N 2.74Å; S77-M79 VanDerWaalsContact C-N 3.33Å; S77-M79 PolarHBondContact O-N 3.14Å; S77-K80 PolarHBondContact O-N 3.47Å
78	I	50.9	Low	51.4	Low	57 Å²	57	86.2 Å²	86.2	29%	0.292	47%	0.466	S	S	.	.	H	α-helix	trans	-66.4	-37.9	178.6	-64.8	165.4	0	0	0	110.9	S74 N81 I188	S74-I78 VanDerWaalsContact O-CG1 3.31Å; S74-I78 WeakPolarHBondContact O-CG1 3.28Å; S74-I78 PolarHBondContact O-N 2.91Å; S74-I78 VanDerWaalsContact O-N 3.11Å; I78-N81 PolarHBondContact O-N 2.8Å; I78-I188 HydrophobicContact CG2-CG2 4.19Å
79	M	51.6	Low	53.2	Low	26 Å²	26	81.8 Å²	81.8	13%	0.128	44%	0.441	C	S	.	.	H	α-helix	trans	-70.9	-28	178.2	-73.8	-147.4	85.6	0	0	114	R75 D76 S77 N81 I82 K87 L193	R75-M79 WeakPolarHBondContact O-CG 3.23Å; R75-M79 PolarHBondContact O-N 3.05Å; D76-M79 PolarHBondContact O-N 3.34Å; S77-M79 VanDerWaalsContact C-N 3.33Å; S77-M79 PolarHBondContact O-N 3.14Å; M79-N81 PolarHBondContact O-N 2.92Å; M79-I82 PolarHBondContact O-N 2.84Å; M79-K87 HydrophobicContact CE-CD 3.66Å; M79-K87 HydrophobicContact CE-CG 4.02Å; M79-L193 HydrophobicContact CE-CD1 3.83Å; M79-L193 HydrophobicContact CE-CD2 3.53Å; M79-L193 HydrophobicContact CE-CG 3.88Å; M79-L193 HydrophobicContact SD-CD2 3.43Å; M79-L193 WeakPolarHBondContact SD-CD2 3.33Å; M79-L193 HydrophobicContact SD-CG 4.16Å
80	K	55.2	Low	54.7	Low	171 Å²	171	77.7 Å²	77.7	74%	0.743	41%	0.408	S	S	*	.	H	α-helix	trans	-63.7	-25.4	176	-80.4	170	-175.8	175	0	112.4	D76 S77	D76-K80 VanDerWaalsContact O-CG 3.27Å; D76-K80 WeakPolarHBondContact O-CG 3.24Å; D76-K80 PolarHBondContact O-N 3.33Å; S77-K80 PolarHBondContact O-N 3.47Å
81	N	55.7	Low	56.2	Low	117 Å²	117	71 Å²	71	63%	0.626	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.4	-179.6	-66	-26.4	0	0	0	114.1	I78 M79	I78-N81 PolarHBondContact O-N 2.8Å; M79-N81 PolarHBondContact O-N 2.92Å
82	I	62.3	Low	57.6	Low	12 Å²	12	73.1 Å²	73.1	6%	0.062	38%	0.383	C	S	.	.	S	Bend	trans	-90.5	123.9	177.2	-59.3	166.3	0	0	0	108.1	M79 S84 L86 K87 I185	M79-I82 PolarHBondContact O-N 2.84Å; I82-S84 PolarHBondContact O-N 2.73Å; I82-L86 HydrophobicContact CG2-CB 3.89Å; I82-K87 HydrophobicContact CG2-CB 4.39Å; I82-I185 HydrophobicContact CG1-CG2 3.77Å
83	D	66.9	Low	58.9	Low	89 Å²	89	71.7 Å²	71.7	48%	0.476	37%	0.369	S	S	.	.			trans	-46.8	127.7	174	-179.4	-1.3	0	0	0	109.9	K85 L86 K87	D83-K85 PolarHBondContact O-N 2.81Å; D83-K85 PolarHBondContact OD1-N 3.41Å; D83-L86 HydrophobicContact CB-CB 4.35Å; D83-L86 HydrophobicContact CB-CD1 3.98Å; D83-L86 HydrophobicContact CB-CG 4.17Å; D83-L86 WeakPolarHBondContact O-CA 3.22Å; D83-L86 WeakPolarHBondContact O-CB 3.41Å; D83-L86 PolarHBondContact O-N 3.49Å; D83-K87 PolarHBondContact O-N 3.18Å
84	S	70.8	Confident	60.1	Low	92 Å²	92	66.3 Å²	66.3	64%	0.643	34%	0.34	S	S	*	.	H	α-helix	trans	-44.8	-36.9	175.8	63.2	0	0	0	0	112.8	I82 K87 Q88	I82-S84 PolarHBondContact O-N 2.73Å; S84-K87 PolarHBondContact O-N 2.93Å; S84-Q88 WeakPolarHBondContact O-CB 3.24Å; S84-Q88 PolarHBondContact O-N 2.92Å
85	K	69.2	Low	60.7	Low	142 Å²	142	65.5 Å²	65.5	62%	0.617	33%	0.33	S	S	*	.	H	α-helix	trans	-67.9	-40.8	177.4	-168.3	175.5	-176.3	175.9	0	112.4	D83 Q88 I89	D83-K85 PolarHBondContact O-N 2.81Å; D83-K85 PolarHBondContact OD1-N 3.41Å; K85-Q88 PolarHBondContact O-N 3.43Å; K85-I89 HydrophobicContact CG-CD1 4.48Å; K85-I89 VanDerWaalsContact O-CG1 3.27Å; K85-I89 WeakPolarHBondContact O-CG1 3.49Å; K85-I89 PolarHBondContact O-N 2.86Å
86	L	66.3	Low	61.1	Low	26 Å²	26	65.6 Å²	65.6	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-68.7	-42.4	175.8	-71.6	170.4	0	0	0	111.2	I82 D83 Q88 I89 I90 A176 A180 I186	I82-L86 HydrophobicContact CG2-CB 3.89Å; D83-L86 HydrophobicContact CB-CB 4.35Å; D83-L86 HydrophobicContact CB-CD1 3.98Å; D83-L86 HydrophobicContact CB-CG 4.17Å; D83-L86 WeakPolarHBondContact O-CA 3.22Å; D83-L86 WeakPolarHBondContact O-CB 3.41Å; D83-L86 PolarHBondContact O-N 3.49Å; L86-Q88 VanDerWaalsContact C-N 3.26Å; L86-Q88 PolarHBondContact O-N 3.2Å; L86-I89 PolarHBondContact O-N 2.91Å; L86-I89 VanDerWaalsContact O-N 3.12Å; L86-I90 WeakPolarHBondContact O-CD1 3.33Å; L86-I90 VanDerWaalsContact O-CG1 3.26Å; L86-I90 WeakPolarHBondContact O-CG1 3.19Å; L86-I90 PolarHBondContact O-N 2.77Å; L86-A176 HydrophobicContact CD2-CB 3.73Å; L86-A180 HydrophobicContact CD1-CB 4.13Å; L86-I186 HydrophobicContact CD1-CD1 3.63Å; L86-I186 HydrophobicContact CD1-CG1 3.97Å; L86-I186 HydrophobicContact CD2-CD1 3.95Å; L86-I186 HydrophobicContact CG-CD1 4.34Å
87	K	67.6	Low	61.5	Low	79 Å²	79	62.7 Å²	62.7	34%	0.343	32%	0.318	S	S	.	.	H	α-helix	trans	-56.8	-43.4	173.1	-176.8	173.2	178	163.6	0	110.9	M79 I82 D83 S84 I90 L91	M79-K87 HydrophobicContact CE-CD 3.66Å; M79-K87 HydrophobicContact CE-CG 4.02Å; I82-K87 HydrophobicContact CG2-CB 4.39Å; D83-K87 PolarHBondContact O-N 3.18Å; S84-K87 PolarHBondContact O-N 2.93Å; K87-I90 PolarHBondContact O-N 3.25Å; K87-L91 HydrophobicContact CG-CD1 4.02Å; K87-L91 HydrophobicContact CG-CG 4.47Å; K87-L91 WeakPolarHBondContact O-CB 3.48Å; K87-L91 VanDerWaalsContact O-CG 3.23Å; K87-L91 WeakPolarHBondContact O-CG 3.44Å; K87-L91 PolarHBondContact O-N 2.83Å
88	Q	70.6	Confident	61.5	Low	100 Å²	100	65.8 Å²	65.8	47%	0.467	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-46.1	174.7	-175.4	178.9	-8	0	0	111.9	S84 K85 L86 I90 L91 E92	S84-Q88 WeakPolarHBondContact O-CB 3.24Å; S84-Q88 PolarHBondContact O-N 2.92Å; K85-Q88 PolarHBondContact O-N 3.43Å; L86-Q88 VanDerWaalsContact C-N 3.26Å; L86-Q88 PolarHBondContact O-N 3.2Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 2.83Å; Q88-L91 PolarHBondContact O-N 3.4Å; Q88-E92 HydrophobicContact CG-CG 4.26Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.41Å; Q88-E92 PolarHBondContact NE2-OE1 3.25Å; Q88-E92 WeakPolarHBondContact O-CB 3.49Å; Q88-E92 VanDerWaalsContact O-CG 3.27Å; Q88-E92 WeakPolarHBondContact O-CG 3.31Å; Q88-E92 PolarHBondContact O-N 2.74Å
89	I	68.9	Low	61.7	Low	17 Å²	17	65.2 Å²	65.2	9%	0.087	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-40.8	178	-65.8	163.5	0	0	0	111.4	K85 L86 E92 Q93 L173 A176	K85-I89 HydrophobicContact CG-CD1 4.48Å; K85-I89 VanDerWaalsContact O-CG1 3.27Å; K85-I89 WeakPolarHBondContact O-CG1 3.49Å; K85-I89 PolarHBondContact O-N 2.86Å; L86-I89 PolarHBondContact O-N 2.91Å; L86-I89 VanDerWaalsContact O-N 3.12Å; I89-E92 PolarHBondContact O-N 3.05Å; I89-Q93 WeakPolarHBondContact O-CB 3.36Å; I89-Q93 WeakPolarHBondContact O-CG 3.49Å; I89-Q93 PolarHBondContact O-N 2.85Å; I89-Q93 VanDerWaalsContact O-N 3.14Å; I89-L173 HydrophobicContact CG2-CB 4.04Å; I89-L173 HydrophobicContact CG2-CD1 3.92Å; I89-L173 HydrophobicContact CG2-CG 4.47Å; I89-A176 HydrophobicContact CD1-CB 3.92Å; I89-A176 HydrophobicContact CG2-CB 4.41Å
90	I	66	Low	62.2	Low	2 Å²	2	69.5 Å²	69.5	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-63.2	-50.7	176.3	-63.9	159.8	0	0	0	109.9	L86 K87 Q88 E92 Q93 I94 L173 I186 M190 L193	L86-I90 WeakPolarHBondContact O-CD1 3.33Å; L86-I90 VanDerWaalsContact O-CG1 3.26Å; L86-I90 WeakPolarHBondContact O-CG1 3.19Å; L86-I90 PolarHBondContact O-N 2.77Å; K87-I90 PolarHBondContact O-N 3.25Å; Q88-I90 VanDerWaalsContact C-N 3.32Å; Q88-I90 PolarHBondContact O-N 2.83Å; I90-E92 VanDerWaalsContact C-N 3.31Å; I90-E92 PolarHBondContact O-N 3.26Å; I90-Q93 PolarHBondContact O-N 3.39Å; I90-Q93 VanDerWaalsContact O-N 3.08Å; I90-I94 WeakPolarHBondContact O-CG1 3.37Å; I90-I94 PolarHBondContact O-N 2.85Å; I90-L173 HydrophobicContact CB-CD2 4.38Å; I90-L173 HydrophobicContact CG1-CD1 3.8Å; I90-L173 HydrophobicContact CG1-CD2 3.86Å; I90-I186 HydrophobicContact CD1-CG2 3.78Å; I90-I186 HydrophobicContact CG1-CG2 4.42Å; I90-M190 HydrophobicContact CD1-CG 4.03Å; I90-M190 HydrophobicContact CG1-CG 4.31Å; I90-M190 HydrophobicContact CG1-SD 4.4Å; I90-M190 HydrophobicContact CG2-CG 4.03Å; I90-L193 HydrophobicContact CG2-CD1 4.43Å
91	L	66.7	Low	62.7	Low	40 Å²	40	63.4 Å²	63.4	21%	0.209	34%	0.339	C	S	.	.	H	α-helix	trans	-63	-35.4	179.4	-69.2	173.9	0	0	0	112.9	K87 Q88 Q93 I94	K87-L91 HydrophobicContact CG-CD1 4.02Å; K87-L91 HydrophobicContact CG-CG 4.47Å; K87-L91 WeakPolarHBondContact O-CB 3.48Å; K87-L91 VanDerWaalsContact O-CG 3.23Å; K87-L91 WeakPolarHBondContact O-CG 3.44Å; K87-L91 PolarHBondContact O-N 2.83Å; Q88-L91 PolarHBondContact O-N 3.4Å; L91-Q93 VanDerWaalsContact C-N 3.28Å; L91-Q93 PolarHBondContact O-N 3.47Å; L91-I94 HydrophobicContact CD2-CD1 3.76Å
92	E	67	Low	63.4	Low	85 Å²	85	59.8 Å²	59.8	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-29.4	174.4	-79.7	177	-169.3	0	0	112.7	Q88 I89 I90 R172	Q88-E92 HydrophobicContact CG-CG 4.26Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.41Å; Q88-E92 PolarHBondContact NE2-OE1 3.25Å; Q88-E92 WeakPolarHBondContact O-CB 3.49Å; Q88-E92 VanDerWaalsContact O-CG 3.27Å; Q88-E92 WeakPolarHBondContact O-CG 3.31Å; Q88-E92 PolarHBondContact O-N 2.74Å; I89-E92 PolarHBondContact O-N 3.05Å; I90-E92 VanDerWaalsContact C-N 3.31Å; I90-E92 PolarHBondContact O-N 3.26Å; E92-R172 IonicContact OE2-CZ 2.86Å; E92-R172 IonicContact OE2-NH1 4Å; E92-R172 PolarHBondContact OE2-NH1 3.02Å; E92-R172 IonicContact OE2-NH2 2.9Å
93	Q	61.8	Low	63.7	Low	10 Å²	10	61.5 Å²	61.5	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-98	-6.2	-178.1	-68.2	-169.1	20.2	0	0	114.4	I89 I90 L91 I95 Y167 S168 L173	I89-Q93 WeakPolarHBondContact O-CB 3.36Å; I89-Q93 WeakPolarHBondContact O-CG 3.49Å; I89-Q93 PolarHBondContact O-N 2.85Å; I89-Q93 VanDerWaalsContact O-N 3.14Å; I90-Q93 PolarHBondContact O-N 3.39Å; I90-Q93 VanDerWaalsContact O-N 3.08Å; L91-Q93 VanDerWaalsContact C-N 3.28Å; L91-Q93 PolarHBondContact O-N 3.47Å; Q93-I95 PolarHBondContact O-N 2.78Å; Q93-Y167 HydrophobicContact CB-CD2 4.14Å; Q93-Y167 HydrophobicContact CB-CE2 3.67Å; Q93-Y167 WeakPolarHBondContact O-CD2 3.26Å; Q93-S168 PolarHBondContact OE1-O 3.43Å; Q93-L173 HydrophobicContact CB-CD2 4.49Å; Q93-L173 VanDerWaalsContact NE2-CB 3.33Å
94	I	61.2	Low	64.1	Low	20 Å²	20	63.1 Å²	63.1	10%	0.103	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	104.5	162.8	-71.3	166.3	0	0	0	106.9	I90 L91 K96 V165 F194	I90-I94 WeakPolarHBondContact O-CG1 3.37Å; I90-I94 PolarHBondContact O-N 2.85Å; L91-I94 HydrophobicContact CD2-CD1 3.76Å; I94-K96 PolarHBondContact O-N 2.8Å; I94-K96 VanDerWaalsContact O-N 3.14Å; I94-V165 HydrophobicContact CB-CG1 4.42Å; I94-V165 HydrophobicContact CG1-CG1 4.24Å; I94-V165 HydrophobicContact CG2-CB 4.31Å; I94-V165 HydrophobicContact CG2-CG1 3.45Å; I94-V165 VanDerWaalsContact CG2-CG1 3.45Å; I94-V165 HydrophobicContact CG2-CG2 4.06Å; I94-F194 HydrophobicContact CD1-CE1 4.13Å; I94-F194 HydrophobicContact CD1-CZ 3.55Å; I94-F194 HydrophobicContact CG1-CZ 4.05Å
95	I	56.3	Low	64.5	Low	49 Å²	49	61 Å²	61	25%	0.251	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	108.5	175.3	-62.2	-179.4	0	0	0	105.7	Q93 T97 S166 S168	Q93-I95 PolarHBondContact O-N 2.78Å; I95-T97 PolarHBondContact O-N 3.25Å; I95-S166 PolarHBondContact N-O 2.84Å; I95-S166 VanDerWaalsContact N-O 3.12Å; I95-S166 VanDerWaalsContact O-O 3.06Å; I95-S168 VanDerWaalsContact CD1-CB 3.4Å
96	K	53.4	Low	65.3	Low	74 Å²	74	54.5 Å²	54.5	32%	0.322	29%	0.294	S	S	.	.			trans	-58	130.1	158	-79.9	-172.5	160.6	-155.4	0	107.9	A50 G54 E57 I94 D98	A50-K96 PolarHBondContact O-NZ 3.4Å; G54-K96 VanDerWaalsContact N-NZ 3.18Å; E57-K96 IonicContact OE2-NZ 3.86Å; I94-K96 PolarHBondContact O-N 2.8Å; I94-K96 VanDerWaalsContact O-N 3.14Å; K96-D98 PolarHBondContact O-N 2.79Å
97	T	53.3	Low	66.4	Low	41 Å²	41	53.4 Å²	53.4	25%	0.252	29%	0.288	S	S	.	.			trans	-71.3	47.8	-179.1	-29.7	0	0	0	0	111.5	I95 S99 K159	I95-T97 PolarHBondContact O-N 3.25Å; T97-S99 VanDerWaalsContact C-N 3.31Å; T97-S99 PolarHBondContact O-N 3.37Å; T97-S99 VanDerWaalsContact O-N 3.1Å; T97-K159 HydrophobicContact CG2-CB 4.23Å; T97-K159 HydrophobicContact CG2-CG 4.34Å
98	D	50.1	Low	67.3	Low	132 Å²	132	49.9 Å²	49.9	71%	0.706	28%	0.275	S	S	*	.			trans	-87.3	77.8	175.9	-70.6	-28.4	0	0	0	108.4	K96	K96-D98 PolarHBondContact O-N 2.79Å
99	S	54	Low	68.1	Low	46 Å²	46	45.8 Å²	45.8	32%	0.322	26%	0.256	S	S	.	.			trans	-144	132.2	159.7	59.3	0	0	0	0	108.8	T97 L101 K159	T97-S99 VanDerWaalsContact C-N 3.31Å; T97-S99 PolarHBondContact O-N 3.37Å; T97-S99 VanDerWaalsContact O-N 3.1Å; S99-L101 PolarHBondContact O-N 2.85Å; S99-L101 WeakPolarHBondContact OG-CD1 3.43Å; S99-K159 PolarHBondContact O-NZ 2.9Å
100	S	62.8	Low	69	Low	116 Å²	116	50.4 Å²	50.4	81%	0.811	28%	0.277	S	S	*	.			trans	-61.7	7.9	177.3	53.7	0	0	0	0	114.2	S102	S100-S102 PolarHBondContact O-N 2.83Å
101	L	66.8	Low	70.1	Confident	43 Å²	43	54.6 Å²	54.6	23%	0.225	30%	0.302	C	S	.	.			trans	-60.2	119.2	-177.5	-63.3	173.7	0	0	0	110.6	S99 D105 M152 K159	S99-L101 PolarHBondContact O-N 2.85Å; S99-L101 WeakPolarHBondContact OG-CD1 3.43Å; L101-D105 WeakPolarHBondContact CA-OD2 3.35Å; L101-D105 HydrophobicContact CD2-CB 4.43Å; L101-M152 HydrophobicContact CD1-CG 4.34Å; L101-K159 WeakPolarHBondContact O-CD 3.13Å; L101-K159 PolarHBondContact O-NZ 3.15Å
102	S	70.5	Confident	71.2	Confident	41 Å²	41	52.9 Å²	52.9	29%	0.287	29%	0.294	S	S	.	.			trans	-90.7	166.9	165.2	72.4	0	0	0	0	109.5	S100 D104 D105	S100-S102 PolarHBondContact O-N 2.83Å; S102-D104 PolarHBondContact O-N 3.28Å; S102-D104 WeakPolarHBondContact OG-CB 3.28Å; S102-D104 PolarHBondContact OG-N 3.42Å; S102-D105 PolarHBondContact N-OD2 3.23Å; S102-D105 WeakPolarHBondContact O-CB 3.36Å; S102-D105 PolarHBondContact O-N 3.22Å; S102-D105 PolarHBondContact OG-N 3.12Å; S102-D105 PolarHBondContact OG-OD2 2.72Å
103	L	68.2	Low	72.2	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.246	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-62.9	-30.5	169.6	-171.2	74.6	0	0	0	111.3	D105 V106 E157 K160	L103-D105 PolarHBondContact O-N 3.16Å; L103-D105 VanDerWaalsContact O-N 3.15Å; L103-V106 PolarHBondContact O-N 2.68Å; L103-E157 HydrophobicContact CD1-CG 4.46Å; L103-E157 WeakPolarHBondContact CD1-OE1 3.48Å; L103-K160 VanDerWaalsContact CD1-NZ 3.33Å; L103-K160 VanDerWaalsContact CD2-CE 3.47Å
104	D	75	Confident	73.5	Confident	123 Å²	123	55.6 Å²	55.6	66%	0.658	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-65.7	-17.1	-179.5	-51.7	-39.6	0	0	0	111.9	S102 V106	S102-D104 PolarHBondContact O-N 3.28Å; S102-D104 WeakPolarHBondContact OG-CB 3.28Å; S102-D104 PolarHBondContact OG-N 3.42Å; D104-V106 VanDerWaalsContact C-N 3.31Å
105	D	79	Confident	74.9	Confident	49 Å²	49	54.8 Å²	54.8	26%	0.262	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-77.6	-15.2	172.6	-61.4	-32.5	0	0	0	113.1	L101 S102 L103 M152 M284	L101-D105 WeakPolarHBondContact CA-OD2 3.35Å; L101-D105 HydrophobicContact CD2-CB 4.43Å; S102-D105 PolarHBondContact N-OD2 3.23Å; S102-D105 WeakPolarHBondContact O-CB 3.36Å; S102-D105 PolarHBondContact O-N 3.22Å; S102-D105 PolarHBondContact OG-N 3.12Å; S102-D105 PolarHBondContact OG-OD2 2.72Å; L103-D105 PolarHBondContact O-N 3.16Å; L103-D105 VanDerWaalsContact O-N 3.15Å; D105-M152 VanDerWaalsContact O-CE 3.23Å; D105-M152 WeakPolarHBondContact O-CE 3.27Å; D105-M284 HydrophobicContact CB-CE 4.47Å; D105-M284 WeakPolarHBondContact O-CE 3.18Å
106	V	85.3	Confident	76.3	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.024	29%	0.288	C	S	.	.	S	Bend	trans	-91.9	105.3	175.6	-172.9	0	0	0	0	110.2	L103 D104 K113 M152 L153 S156	L103-V106 PolarHBondContact O-N 2.68Å; D104-V106 VanDerWaalsContact C-N 3.31Å; V106-K113 WeakPolarHBondContact O-CE 3.44Å; V106-K113 PolarHBondContact O-NZ 3.35Å; V106-M152 HydrophobicContact CB-CE 4.13Å; V106-M152 HydrophobicContact CG1-CE 4.32Å; V106-M152 HydrophobicContact CG2-CE 3.77Å; V106-M152 HydrophobicContact CG2-CG 4.21Å; V106-L153 HydrophobicContact CG1-CD1 4.15Å; V106-S156 VanDerWaalsContact CG2-OG 3.31Å; V106-S156 WeakPolarHBondContact CG2-OG 3.44Å
107	V	89.4	Confident	77.8	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.018	29%	0.289	C	S	.	.			trans	-73.5	132.4	173.6	-178	0	0	0	0	110.3	E277 K280 M281 M284 F310	V107-E277 HydrophobicContact CG1-CB 3.91Å; V107-E277 HydrophobicContact CG1-CG 4.22Å; V107-E277 WeakPolarHBondContact CG1-O 3.3Å; V107-K280 HydrophobicContact CG1-CB 4.03Å; V107-K280 HydrophobicContact CG1-CD 4.08Å; V107-K280 HydrophobicContact CG1-CG 4.07Å; V107-K280 HydrophobicContact CG2-CG 4.16Å; V107-M281 HydrophobicContact CG2-CB 4.38Å; V107-M281 HydrophobicContact CG2-SD 4.14Å; V107-M284 HydrophobicContact CG2-CE 3.97Å; V107-M284 HydrophobicContact CG2-SD 3.29Å; V107-M284 WeakPolarHBondContact CG2-SD 3.44Å; V107-F310 HydrophobicContact CB-CE1 4.12Å; V107-F310 HydrophobicContact CB-CZ 3.92Å; V107-F310 HydrophobicContact CG1-CE1 4Å; V107-F310 HydrophobicContact CG1-CZ 3.95Å
108	G	88.1	Confident	79.4	Confident	6 Å²	6	54.5 Å²	54.5	6%	0.062	30%	0.295	C	S	.	.	S	Bend	trans	74.2	-158.3	168.5	0	0	0	0	0	115.7	E110 K113 E277	G108-E110 VanDerWaalsContact C-N 3.34Å; G108-E110 PolarHBondContact O-N 3.48Å; G108-K113 WeakPolarHBondContact O-CE 3.48Å; G108-K113 PolarHBondContact O-NZ 3.29Å; G108-E277 WeakPolarHBondContact CA-OE1 3.34Å
109	N	86.4	Confident	81	Confident	13 Å²	13	48.8 Å²	48.8	7%	0.07	27%	0.265	C	S	.	.			trans	58.5	38.3	175.2	-61.7	-66.6	0	0	0	114.4	V111 A112 K113 I270 E277	N109-V111 VanDerWaalsContact C-N 3.27Å; N109-V111 PolarHBondContact O-N 3.41Å; N109-A112 HydrophobicContact CB-CB 4.33Å; N109-A112 PolarHBondContact O-N 2.93Å; N109-K113 WeakPolarHBondContact O-CG 3.46Å; N109-K113 PolarHBondContact O-N 2.8Å; N109-I270 HydrophobicContact CB-CD1 4.47Å; N109-I270 WeakPolarHBondContact OD1-CG2 3.45Å; N109-E277 PolarHBondContact N-OE1 2.96Å
110	E	88.2	Confident	82.2	Confident	115 Å²	115	46.9 Å²	46.9	54%	0.537	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-36.5	-174.3	-61.3	-53.3	139.2	0	0	112.9	G108 K113 K114	G108-E110 VanDerWaalsContact C-N 3.34Å; G108-E110 PolarHBondContact O-N 3.48Å; E110-K113 PolarHBondContact O-N 2.82Å; E110-K113 IonicContact OE1-NZ 2.63Å; E110-K113 PolarHBondContact OE1-NZ 3.05Å; E110-K113 IonicContact OE2-NZ 2.92Å; E110-K114 WeakPolarHBondContact O-CB 3.35Å; E110-K114 PolarHBondContact O-N 2.91Å
111	V	88.6	Confident	83	Confident	89 Å²	89	41.5 Å²	41.5	54%	0.539	21%	0.214	S	C	.	.	H	α-helix	trans	-59	-50.7	173.4	179.7	0	0	0	0	110.6	N109 K113 K114 S115 C394	N109-V111 VanDerWaalsContact C-N 3.27Å; N109-V111 PolarHBondContact O-N 3.41Å; V111-K113 PolarHBondContact O-N 3.22Å; V111-K114 PolarHBondContact O-N 3.34Å; V111-S115 WeakPolarHBondContact O-CB 3.43Å; V111-S115 PolarHBondContact O-N 3.49Å; V111-C394 HydrophobicContact CG1-CB 3.92Å
112	A	89.3	Confident	83.9	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-36.4	-179.4	0	0	0	0	0	112.6	N109 S115 L116 L153 L268 I270	N109-A112 HydrophobicContact CB-CB 4.33Å; N109-A112 PolarHBondContact O-N 2.93Å; A112-S115 PolarHBondContact O-N 3.44Å; A112-L116 WeakPolarHBondContact O-CB 3.35Å; A112-L116 VanDerWaalsContact O-CG 3.3Å; A112-L116 WeakPolarHBondContact O-CG 3.3Å; A112-L116 PolarHBondContact O-N 3.08Å; A112-L153 HydrophobicContact CB-CD2 3.73Å; A112-L268 HydrophobicContact CB-CB 4.48Å; A112-L268 HydrophobicContact CB-CD1 4.38Å; A112-I270 HydrophobicContact CB-CD1 3.37Å
113	K	88.6	Confident	84.4	Confident	15 Å²	15	40.6 Å²	40.6	7%	0.065	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-51.2	173.4	-74	174.3	-179.5	167	0	111.6	V106 G108 N109 E110 V111 S115 L116 F117 L153	V106-K113 WeakPolarHBondContact O-CE 3.44Å; V106-K113 PolarHBondContact O-NZ 3.35Å; G108-K113 WeakPolarHBondContact O-CE 3.48Å; G108-K113 PolarHBondContact O-NZ 3.29Å; N109-K113 WeakPolarHBondContact O-CG 3.46Å; N109-K113 PolarHBondContact O-N 2.8Å; E110-K113 PolarHBondContact O-N 2.82Å; E110-K113 IonicContact OE1-NZ 2.63Å; E110-K113 PolarHBondContact OE1-NZ 3.05Å; E110-K113 IonicContact OE2-NZ 2.92Å; V111-K113 PolarHBondContact O-N 3.22Å; K113-S115 VanDerWaalsContact C-N 3.29Å; K113-S115 PolarHBondContact O-N 3.33Å; K113-L116 PolarHBondContact O-N 2.86Å; K113-F117 VanDerWaalsContact O-CB 3.28Å; K113-F117 WeakPolarHBondContact O-CB 3.19Å; K113-F117 PolarHBondContact O-N 3.2Å; K113-L153 HydrophobicContact CG-CD1 3.5Å; K113-L153 VanDerWaalsContact CG-CD1 3.5Å
114	K	89.6	Confident	84.9	Confident	137 Å²	137	39.5 Å²	39.5	60%	0.596	20%	0.204	S	C	*	.	H	α-helix	trans	-58.2	-45.8	177	-177.6	-178.6	175.6	-173.6	0	110.8	E110 V111 L116 F117 E118	E110-K114 WeakPolarHBondContact O-CB 3.35Å; E110-K114 PolarHBondContact O-N 2.91Å; V111-K114 PolarHBondContact O-N 3.34Å; K114-L116 PolarHBondContact O-N 3.22Å; K114-F117 WeakPolarHBondContact O-CB 3.33Å; K114-F117 PolarHBondContact O-N 2.91Å; K114-E118 WeakPolarHBondContact CE-OE1 3.34Å; K114-E118 WeakPolarHBondContact O-CG 3.35Å; K114-E118 PolarHBondContact O-N 3.29Å
115	S	89.8	Confident	85.2	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-40	-178.1	-150.4	0	0	0	0	112.9	V111 A112 K113 T119 K266 L268	V111-S115 WeakPolarHBondContact O-CB 3.43Å; V111-S115 PolarHBondContact O-N 3.49Å; A112-S115 PolarHBondContact O-N 3.44Å; K113-S115 VanDerWaalsContact C-N 3.29Å; K113-S115 PolarHBondContact O-N 3.33Å; S115-T119 WeakPolarHBondContact O-CB 3.45Å; S115-T119 PolarHBondContact O-N 3.31Å; S115-T119 PolarHBondContact O-OG1 3.26Å; S115-K266 PolarHBondContact O-NZ 3.31Å; S115-K266 WeakPolarHBondContact OG-CE 3.3Å; S115-K266 PolarHBondContact OG-NZ 3.04Å; S115-L268 WeakPolarHBondContact OG-CD2 3.35Å
116	L	85.8	Confident	85.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69.2	-39.7	172.1	-75.4	171.6	0	0	0	111.7	A112 K113 K114 E118 T119 V120 V140 L153 V154 E157 I247 L268	A112-L116 WeakPolarHBondContact O-CB 3.35Å; A112-L116 VanDerWaalsContact O-CG 3.3Å; A112-L116 WeakPolarHBondContact O-CG 3.3Å; A112-L116 PolarHBondContact O-N 3.08Å; K113-L116 PolarHBondContact O-N 2.86Å; K114-L116 PolarHBondContact O-N 3.22Å; L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.01Å; L116-T119 PolarHBondContact O-N 3.33Å; L116-V120 HydrophobicContact CD2-CG2 4.33Å; L116-V120 WeakPolarHBondContact O-CA 3.31Å; L116-V120 WeakPolarHBondContact O-CB 3.44Å; L116-V120 WeakPolarHBondContact O-CG2 3.37Å; L116-V120 PolarHBondContact O-N 2.96Å; L116-V140 HydrophobicContact CD2-CG1 4.09Å; L116-L153 HydrophobicContact CD1-CD1 4.25Å; L116-L153 HydrophobicContact CD1-CD2 3.71Å; L116-L153 HydrophobicContact CD1-CG 3.62Å; L116-V154 HydrophobicContact CD1-CG2 4.12Å; L116-E157 HydrophobicContact CB-CG 4.14Å; L116-E157 HydrophobicContact CD1-CG 4.26Å; L116-I247 HydrophobicContact CD2-CD1 3.99Å; L116-L268 HydrophobicContact CD2-CD1 4.38Å; L116-L268 HydrophobicContact CG-CD1 4.12Å
117	F	86	Confident	85.3	Confident	77 Å²	77	44.4 Å²	44.4	34%	0.338	23%	0.226	S	C	.	.	I	π-helix	trans	-58.4	-45.8	176.1	177.6	-93.1	0	0	0	111.3	K113 K114 T119 V121 L122	K113-F117 VanDerWaalsContact O-CB 3.28Å; K113-F117 WeakPolarHBondContact O-CB 3.19Å; K113-F117 PolarHBondContact O-N 3.2Å; K114-F117 WeakPolarHBondContact O-CB 3.33Å; K114-F117 PolarHBondContact O-N 2.91Å; F117-T119 PolarHBondContact O-N 3.31Å; F117-V121 HydrophobicContact CB-CG2 4.38Å; F117-V121 HydrophobicContact CD2-CB 3.61Å; F117-V121 HydrophobicContact CD2-CG1 3.8Å; F117-V121 HydrophobicContact CD2-CG2 3.63Å; F117-V121 HydrophobicContact CE2-CB 3.87Å; F117-V121 HydrophobicContact CE2-CG1 3.54Å; F117-V121 HydrophobicContact CE2-CG2 4.26Å; F117-V121 HydrophobicContact CG-CB 4.14Å; F117-V121 HydrophobicContact CG-CG2 4.25Å; F117-V121 HydrophobicContact CZ-CG1 4.28Å; F117-V121 WeakPolarHBondContact O-CA 3.38Å; F117-V121 VanDerWaalsContact O-CB 3.28Å; F117-V121 WeakPolarHBondContact O-CB 3.33Å; F117-V121 PolarHBondContact O-N 3.42Å; F117-L122 HydrophobicContact CD1-CD2 4.28Å; F117-L122 HydrophobicContact CD1-CG 4.09Å; F117-L122 HydrophobicContact CE1-CD1 4.34Å; F117-L122 HydrophobicContact CE1-CD2 3.5Å; F117-L122 HydrophobicContact CE1-CG 3.81Å; F117-L122 HydrophobicContact CZ-CD2 3.9Å; F117-L122 PolarHBondContact O-N 2.97Å
118	E	87.1	Confident	85.1	Confident	81 Å²	81	52.3 Å²	52.3	38%	0.379	26%	0.263	S	S	.	.	I	π-helix	trans	-67	-34.6	177.7	-71.9	171	-173.9	0	0	113.6	K114 L116 L122 P123	K114-E118 WeakPolarHBondContact CE-OE1 3.34Å; K114-E118 WeakPolarHBondContact O-CG 3.35Å; K114-E118 PolarHBondContact O-N 3.29Å; L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.01Å; E118-L122 HydrophobicContact CB-CD1 4.24Å; E118-L122 HydrophobicContact CG-CD1 3.96Å; E118-P123 VanDerWaalsContact O-CD 3.3Å; E118-P123 WeakPolarHBondContact O-CD 3.4Å
119	T	83.7	Confident	85.1	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	28%	0.281	C	S	.	.	I	π-helix	trans	-84.6	-29.9	-178.3	-67.8	0	0	0	0	113.5	S115 L116 F117 P123 V137 V140 L245 K266	S115-T119 WeakPolarHBondContact O-CB 3.45Å; S115-T119 PolarHBondContact O-N 3.31Å; S115-T119 PolarHBondContact O-OG1 3.26Å; L116-T119 PolarHBondContact O-N 3.33Å; F117-T119 PolarHBondContact O-N 3.31Å; T119-P123 WeakPolarHBondContact O-CG 3.34Å; T119-V137 HydrophobicContact CG2-CG2 3.38Å; T119-V140 HydrophobicContact CG2-CG2 3.74Å; T119-L245 HydrophobicContact CG2-CD1 4.17Å; T119-L245 HydrophobicContact CG2-CD2 4.08Å; T119-K266 VanDerWaalsContact OG1-CD 3.29Å; T119-K266 WeakPolarHBondContact OG1-CD 3.44Å; T119-K266 PolarHBondContact OG1-NZ 3.22Å
120	V	78	Confident	85.1	Confident	6 Å²	6	57.5 Å²	57.5	4%	0.036	29%	0.287	C	S	.	.	I	π-helix	trans	-109.4	-56.2	-170.9	-175.4	0	0	0	0	110.7	L116 A124 M158 T161 F162 L245 I247	L116-V120 HydrophobicContact CD2-CG2 4.33Å; L116-V120 WeakPolarHBondContact O-CA 3.31Å; L116-V120 WeakPolarHBondContact O-CB 3.44Å; L116-V120 WeakPolarHBondContact O-CG2 3.37Å; L116-V120 PolarHBondContact O-N 2.96Å; V120-A124 VanDerWaalsContact O-CB 3.32Å; V120-A124 WeakPolarHBondContact O-CB 3.27Å; V120-A124 PolarHBondContact O-N 3.38Å; V120-M158 HydrophobicContact CB-CE 4.44Å; V120-M158 HydrophobicContact CG1-CE 3.75Å; V120-M158 HydrophobicContact CG1-SD 3.53Å; V120-M158 VanDerWaalsContact CG1-SD 3.53Å; V120-M158 HydrophobicContact CG2-CE 3.76Å; V120-T161 HydrophobicContact CG1-CG2 4.33Å; V120-F162 HydrophobicContact CG1-CD2 4.42Å; V120-F162 HydrophobicContact CG1-CE2 3.49Å; V120-F162 VanDerWaalsContact CG1-CE2 3.49Å; V120-F162 HydrophobicContact CG1-CZ 4.12Å; V120-L245 HydrophobicContact CB-CD2 4.44Å; V120-L245 HydrophobicContact CG2-CD2 3.53Å; V120-I247 HydrophobicContact CG2-CD1 4.28Å
121	V	80.4	Confident	84.8	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	28%	0.283	C	S	.	.	I	π-helix	trans	-77.3	-46.6	-167.3	-176.3	0	0	0	0	110.2	F117 A124 K125 T161	F117-V121 HydrophobicContact CB-CG2 4.38Å; F117-V121 HydrophobicContact CD2-CB 3.61Å; F117-V121 HydrophobicContact CD2-CG1 3.8Å; F117-V121 HydrophobicContact CD2-CG2 3.63Å; F117-V121 HydrophobicContact CE2-CB 3.87Å; F117-V121 HydrophobicContact CE2-CG1 3.54Å; F117-V121 HydrophobicContact CE2-CG2 4.26Å; F117-V121 HydrophobicContact CG-CB 4.14Å; F117-V121 HydrophobicContact CG-CG2 4.25Å; F117-V121 HydrophobicContact CZ-CG1 4.28Å; F117-V121 WeakPolarHBondContact O-CA 3.38Å; F117-V121 VanDerWaalsContact O-CB 3.28Å; F117-V121 WeakPolarHBondContact O-CB 3.33Å; F117-V121 PolarHBondContact O-N 3.42Å; V121-A124 PolarHBondContact O-N 2.67Å; V121-K125 HydrophobicContact CG1-CD 4.08Å; V121-K125 HydrophobicContact CG1-CG 4.41Å; V121-K125 WeakPolarHBondContact O-CG 3.4Å; V121-K125 PolarHBondContact O-N 3.35Å; V121-T161 WeakPolarHBondContact CG2-OG1 3.26Å
122	L	85	Confident	84.7	Confident	57 Å²	57	54.4 Å²	54.4	30%	0.298	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-47	-178.5	-62.7	-178.5	0	0	0	113.3	F117 E118 A124 K125 N126 F130	F117-L122 HydrophobicContact CD1-CD2 4.28Å; F117-L122 HydrophobicContact CD1-CG 4.09Å; F117-L122 HydrophobicContact CE1-CD1 4.34Å; F117-L122 HydrophobicContact CE1-CD2 3.5Å; F117-L122 HydrophobicContact CE1-CG 3.81Å; F117-L122 HydrophobicContact CZ-CD2 3.9Å; F117-L122 PolarHBondContact O-N 2.97Å; E118-L122 HydrophobicContact CB-CD1 4.24Å; E118-L122 HydrophobicContact CG-CD1 3.96Å; L122-A124 VanDerWaalsContact C-N 3.26Å; L122-A124 PolarHBondContact O-N 2.76Å; L122-K125 PolarHBondContact O-N 3.09Å; L122-N126 PolarHBondContact O-N 3Å; L122-F130 VanDerWaalsContact C-CE2 3.43Å; L122-F130 HydrophobicContact CB-CE1 4.28Å; L122-F130 HydrophobicContact CB-CE2 3.68Å; L122-F130 HydrophobicContact CB-CZ 3.32Å; L122-F130 HydrophobicContact CD1-CZ 4.16Å; L122-F130 HydrophobicContact CG-CZ 4.38Å; L122-F130 WeakPolarHBondContact O-CE2 3.39Å
123	P	81.8	Confident	84.6	Confident	8 Å²	8	63 Å²	63	5%	0.052	33%	0.334	C	S	.	.	H	α-helix	trans	-68.5	-26.3	-179.7	-19.6	34.4	0	0	0	113.2	E118 T119 P127 F130 P136 R243	E118-P123 VanDerWaalsContact O-CD 3.3Å; E118-P123 WeakPolarHBondContact O-CD 3.4Å; T119-P123 WeakPolarHBondContact O-CG 3.34Å; P123-P127 WeakPolarHBondContact O-CA 3.41Å; P123-F130 VanDerWaalsContact CA-CD2 3.46Å; P123-F130 HydrophobicContact CB-CB 4.11Å; P123-F130 HydrophobicContact CB-CD1 4Å; P123-F130 HydrophobicContact CB-CD2 4.03Å; P123-F130 HydrophobicContact CB-CE1 4.49Å; P123-F130 HydrophobicContact CB-CG 3.76Å; P123-F130 HydrophobicContact CG-CD1 3.59Å; P123-F130 HydrophobicContact CG-CD2 4.23Å; P123-F130 HydrophobicContact CG-CE1 3.72Å; P123-F130 HydrophobicContact CG-CE2 4.33Å; P123-F130 HydrophobicContact CG-CG 3.88Å; P123-F130 HydrophobicContact CG-CZ 4.11Å; P123-P136 HydrophobicContact CB-CB 4Å; P123-P136 HydrophobicContact CB-CG 4.27Å; P123-P136 HydrophobicContact CG-CB 3.94Å; P123-R243 PolarHBondContact O-NH1 3.48Å; P123-R243 VanDerWaalsContact O-NH1 3.08Å
124	A	77.7	Confident	84.5	Confident	25 Å²	25	69.3 Å²	69.3	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-74.9	-37	174	0	0	0	0	0	112.2	V120 V121 L122 T161 F162 F197	V120-A124 VanDerWaalsContact O-CB 3.32Å; V120-A124 WeakPolarHBondContact O-CB 3.27Å; V120-A124 PolarHBondContact O-N 3.38Å; V121-A124 PolarHBondContact O-N 2.67Å; L122-A124 VanDerWaalsContact C-N 3.26Å; L122-A124 PolarHBondContact O-N 2.76Å; A124-T161 HydrophobicContact CB-CG2 3.23Å; A124-F162 HydrophobicContact CB-CE1 4.13Å; A124-F162 HydrophobicContact CB-CZ 4.21Å; A124-F197 HydrophobicContact CB-CE1 4.38Å
125	K	81	Confident	84.1	Confident	141 Å²	141	66.1 Å²	66.1	61%	0.613	35%	0.352	S	S	*	.	H	α-helix	trans	-76.9	-41.3	179.5	-75.3	-171.9	175	-170.7	0	113.5	V121 L122 P127	V121-K125 HydrophobicContact CG1-CD 4.08Å; V121-K125 HydrophobicContact CG1-CG 4.41Å; V121-K125 WeakPolarHBondContact O-CG 3.4Å; V121-K125 PolarHBondContact O-N 3.35Å; L122-K125 PolarHBondContact O-N 3.09Å; K125-P127 VanDerWaalsContact C-CD 3.49Å; K125-P127 WeakPolarHBondContact O-CD 3.29Å
126	N	84.5	Confident	83.7	Confident	86 Å²	86	67.8 Å²	67.8	46%	0.46	36%	0.363	S	S	.	.			trans	-128.5	66.9	-173.6	-70.2	60.7	0	0	0	110.7	L122 E128 L129 F130	L122-N126 PolarHBondContact O-N 3Å; N126-E128 PolarHBondContact O-N 3.27Å; N126-L129 HydrophobicContact CB-CB 4.46Å; N126-L129 HydrophobicContact CB-CD1 3.83Å; N126-L129 HydrophobicContact CB-CG 4.13Å; N126-L129 PolarHBondContact O-N 3.21Å; N126-F130 WeakPolarHBondContact O-CD2 3.42Å
127	P	81.8	Confident	83.6	Confident	52 Å²	52	70.3 Å²	70.3	34%	0.338	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.5	-170.6	21	-34	0	0	0	114.9	P123 K125 F130 R243	P123-P127 WeakPolarHBondContact O-CA 3.41Å; K125-P127 VanDerWaalsContact C-CD 3.49Å; K125-P127 WeakPolarHBondContact O-CD 3.29Å; P127-F130 PolarHBondContact O-N 3.48Å; P127-R243 PolarHBondContact O-NH2 3.18Å
128	E	86.1	Confident	83.2	Confident	168 Å²	168	69.6 Å²	69.6	79%	0.785	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-29.7	-179.4	-60.4	178	-175.7	0	0	113.3	N126 F130 T131	N126-E128 PolarHBondContact O-N 3.27Å; E128-F130 VanDerWaalsContact C-N 3.29Å; E128-F130 PolarHBondContact O-N 3.08Å; E128-T131 WeakPolarHBondContact O-CG2 3.23Å; E128-T131 PolarHBondContact O-OG1 3.21Å
129	L	88.5	Confident	83	Confident	86 Å²	86	65.8 Å²	65.8	45%	0.45	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-22.7	177.8	-63.7	-179.3	0	0	0	112.3	N126 T131 R134	N126-L129 HydrophobicContact CB-CB 4.46Å; N126-L129 HydrophobicContact CB-CD1 3.83Å; N126-L129 HydrophobicContact CB-CG 4.13Å; N126-L129 PolarHBondContact O-N 3.21Å; L129-T131 PolarHBondContact O-N 2.9Å; L129-R134 PolarHBondContact O-NE 2.9Å; L129-R134 PolarHBondContact O-NH2 3.12Å
130	F	85.5	Confident	83.2	Confident	42 Å²	42	65.1 Å²	65.1	18%	0.184	35%	0.354	C	S	.	.	S	Bend	trans	-100.7	60.3	-174	-68.8	-93.3	0	0	0	111.1	L122 P123 N126 P127 E128 R134	L122-F130 VanDerWaalsContact C-CE2 3.43Å; L122-F130 HydrophobicContact CB-CE1 4.28Å; L122-F130 HydrophobicContact CB-CE2 3.68Å; L122-F130 HydrophobicContact CB-CZ 3.32Å; L122-F130 HydrophobicContact CD1-CZ 4.16Å; L122-F130 HydrophobicContact CG-CZ 4.38Å; L122-F130 WeakPolarHBondContact O-CE2 3.39Å; P123-F130 VanDerWaalsContact CA-CD2 3.46Å; P123-F130 HydrophobicContact CB-CB 4.11Å; P123-F130 HydrophobicContact CB-CD1 4Å; P123-F130 HydrophobicContact CB-CD2 4.03Å; P123-F130 HydrophobicContact CB-CE1 4.49Å; P123-F130 HydrophobicContact CB-CG 3.76Å; P123-F130 HydrophobicContact CG-CD1 3.59Å; P123-F130 HydrophobicContact CG-CD2 4.23Å; P123-F130 HydrophobicContact CG-CE1 3.72Å; P123-F130 HydrophobicContact CG-CE2 4.33Å; P123-F130 HydrophobicContact CG-CG 3.88Å; P123-F130 HydrophobicContact CG-CZ 4.11Å; N126-F130 WeakPolarHBondContact O-CD2 3.42Å; P127-F130 PolarHBondContact O-N 3.48Å; E128-F130 VanDerWaalsContact C-N 3.29Å; E128-F130 PolarHBondContact O-N 3.08Å; F130-R134 CarbonylContact C-O 3.54Å; F130-R134 VanDerWaalsContact CA-O 3.28Å; F130-R134 WeakPolarHBondContact CA-O 3.34Å; F130-R134 WeakPolarHBondContact CB-O 3.35Å; F130-R134 WeakPolarHBondContact CD1-O 3.42Å
131	T	82.7	Confident	83.7	Confident	75 Å²	75	64.9 Å²	64.9	46%	0.46	35%	0.352	S	S	.	.			trans	-121	158.5	180	52.8	0	0	0	0	111	E128 L129 L133 R134	E128-T131 WeakPolarHBondContact O-CG2 3.23Å; E128-T131 PolarHBondContact O-OG1 3.21Å; L129-T131 PolarHBondContact O-N 2.9Å; T131-L133 PolarHBondContact O-N 3.24Å; T131-R134 PolarHBondContact O-N 3.44Å; T131-R134 VanDerWaalsContact O-N 3.1Å
132	G	85.6	Confident	84.2	Confident	64 Å²	64	64.8 Å²	64.8	66%	0.66	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	59	-130.9	-177.3	0	0	0	0	0	111.8	R134 S135	G132-R134 PolarHBondContact O-N 3.39Å; G132-R134 VanDerWaalsContact O-N 3.15Å; G132-S135 VanDerWaalsContact O-CB 3.31Å; G132-S135 WeakPolarHBondContact O-CB 3.32Å; G132-S135 PolarHBondContact O-N 2.91Å; G132-S135 PolarHBondContact O-OG 3.38Å
133	L	86.5	Confident	84.6	Confident	186 Å²	186	62 Å²	62	97%	0.974	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-64	-16.5	178	-63.2	177.6	0	0	0	114	T131 S135	T131-L133 PolarHBondContact O-N 3.24Å; L133-S135 VanDerWaalsContact C-N 3.29Å
134	R	86.7	Confident	85.1	Confident	146 Å²	146	61.7 Å²	61.7	55%	0.551	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-89.6	8.8	175.2	-61.9	179.9	-67	175.7	3.1	112.3	L129 F130 T131 G132	L129-R134 PolarHBondContact O-NE 2.9Å; L129-R134 PolarHBondContact O-NH2 3.12Å; F130-R134 CarbonylContact C-O 3.54Å; F130-R134 VanDerWaalsContact CA-O 3.28Å; F130-R134 WeakPolarHBondContact CA-O 3.34Å; F130-R134 WeakPolarHBondContact CB-O 3.35Å; F130-R134 WeakPolarHBondContact CD1-O 3.42Å; T131-R134 PolarHBondContact O-N 3.44Å; T131-R134 VanDerWaalsContact O-N 3.1Å; G132-R134 PolarHBondContact O-N 3.39Å; G132-R134 VanDerWaalsContact O-N 3.15Å
135	S	82.8	Confident	85.9	Confident	70 Å²	70	60.5 Å²	60.5	49%	0.49	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-55.8	140	174.7	59	0	0	0	0	110.7	G132 L133	G132-S135 VanDerWaalsContact O-CB 3.31Å; G132-S135 WeakPolarHBondContact O-CB 3.32Å; G132-S135 PolarHBondContact O-N 2.91Å; G132-S135 PolarHBondContact O-OG 3.38Å; L133-S135 VanDerWaalsContact C-N 3.29Å
136	P	80.5	Confident	86.3	Confident	39 Å²	39	56 Å²	56	25%	0.253	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-61.4	145.2	179.1	27.7	-34	0	0	0	110.8	P123	P123-P136 HydrophobicContact CB-CB 4Å; P123-P136 HydrophobicContact CB-CG 4.27Å; P123-P136 HydrophobicContact CG-CB 3.94Å
137	V	83	Confident	86.5	Confident	52 Å²	52	53.3 Å²	53.3	32%	0.315	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65.6	143	171.5	-63.5	0	0	0	0	110	T119 V140 L245 P265 K266	T119-V137 HydrophobicContact CG2-CG2 3.38Å; V137-V140 HydrophobicContact CG2-CG2 4.14Å; V137-L245 WeakPolarHBondContact O-CD1 3.35Å; V137-P265 HydrophobicContact CB-CG 4.32Å; V137-P265 HydrophobicContact CG1-CG 4.43Å; V137-K266 HydrophobicContact CG2-CB 4.08Å; V137-K266 HydrophobicContact CG2-CD 3.95Å
138	Q	77.7	Confident	86.9	Confident	63 Å²	63	50.9 Å²	50.9	29%	0.294	29%	0.287	S	S	.	.	S	Bend	trans	-83.8	-18.2	-178.1	-68.7	152.1	26.8	0	0	113.1	F233 V236 N237 V246	Q138-F233 HydrophobicContact CB-CE1 4.05Å; Q138-F233 HydrophobicContact CB-CZ 4.07Å; Q138-V236 HydrophobicContact CG-CG1 4.41Å; Q138-N237 PolarHBondContact NE2-ND2 3.47Å; Q138-N237 PolarHBondContact NE2-OD1 3.15Å; Q138-N237 PolarHBondContact OE1-ND2 2.97Å; Q138-V246 PolarHBondContact O-N 3.22Å
139	G	83.2	Confident	86.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	126.3	-171.1	0	0	0	0	0	112.8	V246 P265 K266	G139-V246 CarbonylContact C-O 3.59Å; G139-V246 WeakPolarHBondContact CA-O 3Å; G139-P265 WeakPolarHBondContact O-CD 3.34Å; G139-K266 PolarHBondContact O-N 2.81Å
140	V	87.6	Confident	86.8	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.9	171	177.6	0	0	0	0	109.4	L116 T119 V137 L142 L245 V246 I247 G248 K266 L268	L116-V140 HydrophobicContact CD2-CG1 4.09Å; T119-V140 HydrophobicContact CG2-CG2 3.74Å; V137-V140 HydrophobicContact CG2-CG2 4.14Å; V140-L142 HydrophobicContact CG1-CD2 4.22Å; V140-L245 HydrophobicContact CB-CD1 4.49Å; V140-L245 HydrophobicContact CG2-CD1 3.84Å; V140-V246 PolarHBondContact N-O 3.02Å; V140-I247 HydrophobicContact CB-CG1 4.22Å; V140-I247 HydrophobicContact CB-CG2 4.06Å; V140-I247 HydrophobicContact CG1-CG2 4.13Å; V140-I247 CarbonylContact O-C 3.56Å; V140-I247 VanDerWaalsContact O-CA 3.26Å; V140-I247 WeakPolarHBondContact O-CA 3.19Å; V140-G248 PolarHBondContact O-N 3.43Å; V140-K266 CarbonylContact C-O 3.48Å; V140-K266 VanDerWaalsContact CA-O 3.27Å; V140-K266 WeakPolarHBondContact CA-O 3.04Å; V140-K266 HydrophobicContact CG2-CB 4.02Å; V140-K266 HydrophobicContact CG2-CD 4.2Å; V140-K266 HydrophobicContact CG2-CG 4.36Å; V140-L268 HydrophobicContact CG1-CD1 4Å; V140-L268 HydrophobicContact CG1-CG 4.41Å
141	L	90.1	Very high	86.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.7	171.8	179.3	62	0	0	0	109.5	F143 I207 T250 L256 L261 L264 K266 R267 L268	L141-F143 HydrophobicContact CD2-CD1 4.47Å; L141-F143 HydrophobicContact CG-CD1 4.42Å; L141-I207 HydrophobicContact CD1-CD1 3.44Å; L141-I207 VanDerWaalsContact CD1-CD1 3.44Å; L141-T250 HydrophobicContact CD1-CG2 3.87Å; L141-T250 HydrophobicContact CG-CG2 4.5Å; L141-L256 HydrophobicContact CD1-CD1 4.14Å; L141-L256 HydrophobicContact CD2-CD1 3.95Å; L141-L261 HydrophobicContact CD2-CD2 3.93Å; L141-L264 HydrophobicContact CB-CB 3.98Å; L141-L264 HydrophobicContact CB-CD1 4Å; L141-L264 HydrophobicContact CD1-CD1 4Å; L141-L264 HydrophobicContact CG-CD1 4.45Å; L141-K266 PolarHBondContact N-O 3.07Å; L141-R267 HydrophobicContact CB-CB 4.47Å; L141-R267 HydrophobicContact CB-CG 4.09Å; L141-R267 HydrophobicContact CD2-CG 4.23Å; L141-R267 CarbonylContact O-C 3.54Å; L141-R267 WeakPolarHBondContact O-CA 3.41Å; L141-L268 PolarHBondContact O-N 3.11Å
142	L	90.5	Very high	86.5	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.8	164.7	-59.1	-172.5	0	0	0	109.3	V140 K150 L153 V154 I247 G248 A249 T250 L268	V140-L142 HydrophobicContact CG1-CD2 4.22Å; L142-K150 HydrophobicContact CB-CB 4.46Å; L142-K150 HydrophobicContact CB-CD 4.44Å; L142-K150 HydrophobicContact CB-CG 4.45Å; L142-K150 WeakPolarHBondContact CD1-O 3.4Å; L142-L153 HydrophobicContact CD1-CD2 4.35Å; L142-V154 HydrophobicContact CD1-CG2 3.22Å; L142-V154 HydrophobicContact CG-CG2 4.35Å; L142-I247 HydrophobicContact CG-CG2 4.28Å; L142-G248 PolarHBondContact N-O 3.45Å; L142-A249 HydrophobicContact CB-CB 4.47Å; L142-A249 CarbonylContact O-C 3.48Å; L142-A249 VanDerWaalsContact O-CA 3.25Å; L142-A249 WeakPolarHBondContact O-CA 3.44Å; L142-T250 PolarHBondContact O-N 3.01Å; L142-L268 HydrophobicContact CD2-CB 3.71Å; L142-L268 HydrophobicContact CD2-CD1 3.75Å; L142-L268 HydrophobicContact CD2-CG 4.19Å
143	F	92.8	Very high	86.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	157.3	177.5	71.2	-85.1	0	0	0	111.7	L141 T250 P253 R267 L268 Y269 I270 L383 F386 N387	L141-F143 HydrophobicContact CD2-CD1 4.47Å; L141-F143 HydrophobicContact CG-CD1 4.42Å; F143-T250 WeakPolarHBondContact CA-O 3.48Å; F143-T250 HydrophobicContact CB-CG2 3.62Å; F143-P253 HydrophobicContact CB-CB 3.89Å; F143-P253 HydrophobicContact CB-CG 4.04Å; F143-P253 HydrophobicContact CD2-CB 4.21Å; F143-P253 HydrophobicContact CD2-CG 3.72Å; F143-P253 HydrophobicContact CE2-CG 4.47Å; F143-P253 HydrophobicContact CG-CB 4.08Å; F143-P253 HydrophobicContact CG-CG 4.08Å; F143-R267 HydrophobicContact CD1-CB 4.43Å; F143-R267 HydrophobicContact CE1-CB 3.96Å; F143-L268 WeakPolarHBondContact CD1-O 3.44Å; F143-L268 PolarHBondContact N-O 2.75Å; F143-Y269 AromaticContact CD2-CD2 3.83Å; F143-Y269 HydrophobicContact CD2-CD2 3.83Å; F143-Y269 AromaticContact CE2-CD2 3.52Å; F143-Y269 HydrophobicContact CE2-CD2 3.52Å; F143-Y269 HydrophobicContact CE2-CE2 4.43Å; F143-Y269 AromaticContact CE2-CG 3.99Å; F143-Y269 HydrophobicContact CE2-CG 3.99Å; F143-Y269 HydrophobicContact CZ-CD2 4.21Å; F143-Y269 HydrophobicContact CZ-CG 4.24Å; F143-Y269 CarbonylContact O-C 3.56Å; F143-Y269 WeakPolarHBondContact O-CA 2.76Å; F143-I270 PolarHBondContact O-N 3.45Å; F143-L383 HydrophobicContact CD2-CD2 4.2Å; F143-F386 HydrophobicContact CD1-CE1 4.44Å; F143-F386 HydrophobicContact CD2-CD1 4.1Å; F143-F386 HydrophobicContact CE1-CD1 4.34Å; F143-F386 HydrophobicContact CE1-CE1 4.22Å; F143-F386 AromaticContact CE2-CD1 3.67Å; F143-F386 HydrophobicContact CE2-CD1 3.67Å; F143-F386 HydrophobicContact CE2-CE1 4.31Å; F143-F386 AromaticContact CZ-CD1 3.8Å; F143-F386 HydrophobicContact CZ-CD1 3.8Å; F143-F386 HydrophobicContact CZ-CE1 4.14Å; F143-N387 HydrophobicContact CE2-CB 3.97Å; F143-N387 HydrophobicContact CZ-CB 3.81Å
144	G	93.1	Very high	86.1	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	152.7	-174.6	-179.7	0	0	0	0	0	112.2	K150 T250 N251 I270	G144-K150 VanDerWaalsContact C-NZ 3.33Å; G144-K150 PolarHBondContact O-NZ 3.37Å; G144-T250 PolarHBondContact N-O 2.91Å; G144-N251 WeakPolarHBondContact O-CA 3.13Å; G144-I270 WeakPolarHBondContact CA-O 3.42Å
145	P	93	Very high	85.6	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-66.9	152.2	-178.9	8.4	1.6	0	0	0	111.9	N148 K150 I270 L272 V375 L383	P145-N148 WeakPolarHBondContact CB-ND2 3.33Å; P145-N148 WeakPolarHBondContact CG-ND2 3.23Å; P145-N148 PolarHBondContact O-ND2 3Å; P145-K150 PolarHBondContact O-NZ 3.12Å; P145-I270 WeakPolarHBondContact CD-O 3.35Å; P145-L272 HydrophobicContact CB-CD2 4.21Å; P145-L272 HydrophobicContact CG-CD2 3.91Å; P145-L272 HydrophobicContact CG-CG 3.88Å; P145-V375 HydrophobicContact CB-CB 4.49Å; P145-V375 HydrophobicContact CB-CG1 3.79Å; P145-V375 HydrophobicContact CB-CG2 3.92Å; P145-L383 HydrophobicContact CB-CD1 4.26Å; P145-L383 HydrophobicContact CG-CD1 4.21Å
146	P	90.5	Very high	85.3	Confident	48 Å²	48	20.4 Å²	20.4	31%	0.312	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	149.7	178.7	27.3	-34.9	0	0	0	111.2	N148 N251 V375	P146-N148 PolarHBondContact O-N 2.63Å; P146-N148 PolarHBondContact O-ND2 2.97Å; P146-N251 WeakPolarHBondContact CA-OD1 3.41Å; P146-V375 HydrophobicContact CG-CG2 4.2Å
147	G	88.3	Confident	85.2	Confident	29 Å²	29	18.7 Å²	18.7	30%	0.299	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	4.7	171.9	0	0	0	0	0	116.9	F310 S311	G147-F310 WeakPolarHBondContact O-CB 3.38Å; G147-S311 WeakPolarHBondContact CA-OG 3.42Å; G147-S311 PolarHBondContact O-N 2.9Å; G147-S311 PolarHBondContact O-OG 2.55Å; G147-S311 VanDerWaalsContact O-OG 3.13Å
148	N	91.2	Very high	84.6	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.091	C	C	.	.	S	Bend	trans	-97.1	24.8	-179.4	-59.9	-59.6	0	0	0	114.6	P145 P146 K150 I270 P273 S309 F310	P145-N148 WeakPolarHBondContact CB-ND2 3.33Å; P145-N148 WeakPolarHBondContact CG-ND2 3.23Å; P145-N148 PolarHBondContact O-ND2 3Å; P146-N148 PolarHBondContact O-N 2.63Å; P146-N148 PolarHBondContact O-ND2 2.97Å; N148-K150 PolarHBondContact O-N 3.48Å; N148-I270 HydrophobicContact CB-CG2 4.01Å; N148-I270 WeakPolarHBondContact O-CG2 3.27Å; N148-P273 WeakPolarHBondContact OD1-CD 3.4Å; N148-S309 VanDerWaalsContact OD1-CA 3.29Å; N148-S309 WeakPolarHBondContact OD1-CA 3.35Å; N148-S309 VanDerWaalsContact OD1-CB 3.31Å; N148-S309 WeakPolarHBondContact OD1-CB 3.41Å; N148-F310 HydrophobicContact CB-CD2 4.44Å; N148-F310 PolarHBondContact OD1-N 3.19Å
149	G	84.8	Confident	84.3	Confident	19 Å²	19	17.2 Å²	17.2	20%	0.196	9%	0.094	C	C	.	.	S	Bend	trans	81.9	10.7	169.1	0	0	0	0	0	116.7	T151 M152 L153	G149-T151 PolarHBondContact O-N 2.75Å; G149-T151 VanDerWaalsContact O-N 3.15Å; G149-M152 CarbonylContact O-C 3.49Å; G149-M152 PolarHBondContact O-N 3.34Å; G149-L153 WeakPolarHBondContact O-CB 3.45Å; G149-L153 PolarHBondContact O-N 3.48Å
150	K	87.5	Confident	83.7	Confident	6 Å²	6	21.7 Å²	21.7	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-45.2	-47.6	173.4	-67.1	-173.2	-74.5	-88.7	0	113.2	L142 G144 P145 N148 R201 A249 T250 N251 I270	L142-K150 HydrophobicContact CB-CB 4.46Å; L142-K150 HydrophobicContact CB-CD 4.44Å; L142-K150 HydrophobicContact CB-CG 4.45Å; L142-K150 WeakPolarHBondContact CD1-O 3.4Å; G144-K150 VanDerWaalsContact C-NZ 3.33Å; G144-K150 PolarHBondContact O-NZ 3.37Å; P145-K150 PolarHBondContact O-NZ 3.12Å; N148-K150 PolarHBondContact O-N 3.48Å; K150-R201 PolarHBondContact O-NH2 2.86Å; K150-A249 HydrophobicContact CB-CB 4.47Å; K150-T250 VanDerWaalsContact CE-O 3.29Å; K150-T250 WeakPolarHBondContact CE-O 3.49Å; K150-N251 WeakPolarHBondContact CE-OD1 3.18Å; K150-N251 PolarHBondContact NZ-OD1 2.82Å; K150-I270 HydrophobicContact CG-CB 3.96Å; K150-I270 HydrophobicContact CG-CG1 3.9Å; K150-I270 HydrophobicContact CG-CG2 4.09Å
151	T	79.8	Confident	82.6	Confident	15 Å²	15	23.1 Å²	23.1	9%	0.092	12%	0.122	C	C	.	.	H	α-helix	trans	-72.8	-36.6	-179.7	-76.6	0	0	0	0	112.3	G149 R155 L203 D205	G149-T151 PolarHBondContact O-N 2.75Å; G149-T151 VanDerWaalsContact O-N 3.15Å; T151-R155 VanDerWaalsContact CG2-NH2 3.35Å; T151-R155 WeakPolarHBondContact O-CG 3.23Å; T151-R155 PolarHBondContact O-N 2.79Å; T151-L203 HydrophobicContact CG2-CD2 3.6Å; T151-L203 VanDerWaalsContact OG1-CD2 3.29Å; T151-L203 WeakPolarHBondContact OG1-CD2 3.3Å; T151-D205 PolarHBondContact OG1-OD1 3.1Å; T151-D205 PolarHBondContact OG1-OD2 2.94Å
152	M	81.2	Confident	81.3	Confident	59 Å²	59	24.3 Å²	24.3	29%	0.291	13%	0.128	S	C	.	.	H	α-helix	trans	-71.2	-41.9	178.8	-166	171.4	86.8	0	0	112.2	L101 D105 V106 G149 V154 R155 S156	L101-M152 HydrophobicContact CD1-CG 4.34Å; D105-M152 VanDerWaalsContact O-CE 3.23Å; D105-M152 WeakPolarHBondContact O-CE 3.27Å; V106-M152 HydrophobicContact CB-CE 4.13Å; V106-M152 HydrophobicContact CG1-CE 4.32Å; V106-M152 HydrophobicContact CG2-CE 3.77Å; V106-M152 HydrophobicContact CG2-CG 4.21Å; G149-M152 CarbonylContact O-C 3.49Å; G149-M152 PolarHBondContact O-N 3.34Å; M152-V154 VanDerWaalsContact C-N 3.3Å; M152-V154 PolarHBondContact O-N 3.17Å; M152-R155 PolarHBondContact O-N 3.42Å; M152-R155 VanDerWaalsContact O-N 3.15Å; M152-S156 PolarHBondContact O-N 2.85Å; M152-S156 PolarHBondContact O-OG 3.08Å
153	L	84.4	Confident	79.3	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-54.9	-45.4	178.7	174.9	63.5	0	0	0	111.5	V106 A112 K113 L116 L142 G149 S156 E157 I270	V106-L153 HydrophobicContact CG1-CD1 4.15Å; A112-L153 HydrophobicContact CB-CD2 3.73Å; K113-L153 HydrophobicContact CG-CD1 3.5Å; K113-L153 VanDerWaalsContact CG-CD1 3.5Å; L116-L153 HydrophobicContact CD1-CD1 4.25Å; L116-L153 HydrophobicContact CD1-CD2 3.71Å; L116-L153 HydrophobicContact CD1-CG 3.62Å; L142-L153 HydrophobicContact CD1-CD2 4.35Å; G149-L153 WeakPolarHBondContact O-CB 3.45Å; G149-L153 PolarHBondContact O-N 3.48Å; L153-S156 PolarHBondContact O-OG 3.27Å; L153-E157 WeakPolarHBondContact O-CG 3.08Å; L153-E157 PolarHBondContact O-N 3.41Å; L153-E157 VanDerWaalsContact O-N 3.09Å; L153-I270 HydrophobicContact CD2-CD1 3.81Å
154	V	78.8	Confident	77.3	Confident	1 Å²	1	39 Å²	39	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-77.8	-34.9	179.4	-173.7	0	0	0	0	111.8	L116 L142 M152 S156 E157 M158 R201 I247	L116-V154 HydrophobicContact CD1-CG2 4.12Å; L142-V154 HydrophobicContact CD1-CG2 3.22Å; L142-V154 HydrophobicContact CG-CG2 4.35Å; M152-V154 VanDerWaalsContact C-N 3.3Å; M152-V154 PolarHBondContact O-N 3.17Å; V154-S156 PolarHBondContact O-N 2.89Å; V154-E157 PolarHBondContact O-N 3.41Å; V154-M158 HydrophobicContact CG1-CE 3.62Å; V154-M158 HydrophobicContact CG1-CG 3.59Å; V154-M158 HydrophobicContact CG1-SD 4.44Å; V154-M158 VanDerWaalsContact O-CB 3.27Å; V154-M158 WeakPolarHBondContact O-CB 3.31Å; V154-M158 WeakPolarHBondContact O-CG 3.11Å; V154-M158 PolarHBondContact O-N 2.9Å; V154-R201 VanDerWaalsContact CG1-CD 3.43Å; V154-R201 HydrophobicContact CG1-CG 4.41Å; V154-R201 VanDerWaalsContact CG1-CZ 3.41Å; V154-I247 HydrophobicContact CG1-CD1 3.95Å; V154-I247 HydrophobicContact CG2-CG2 4.21Å
155	R	76.1	Confident	75.4	Confident	94 Å²	94	40.7 Å²	40.7	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-58.2	-41.1	174.1	-75.9	178.4	-176.6	143.3	7.8	111.4	T151 M152 K159 L203	T151-R155 VanDerWaalsContact CG2-NH2 3.35Å; T151-R155 WeakPolarHBondContact O-CG 3.23Å; T151-R155 PolarHBondContact O-N 2.79Å; M152-R155 PolarHBondContact O-N 3.42Å; M152-R155 VanDerWaalsContact O-N 3.15Å; R155-K159 WeakPolarHBondContact O-CB 3.42Å; R155-K159 PolarHBondContact O-N 3.1Å; R155-K159 VanDerWaalsContact O-N 3.15Å; R155-L203 HydrophobicContact CG-CD1 4.15Å
156	S	77.8	Confident	73.6	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-70.4	-43.8	178.2	65.1	0	0	0	0	112.7	V106 M152 L153 V154 K159 K160	V106-S156 VanDerWaalsContact CG2-OG 3.31Å; V106-S156 WeakPolarHBondContact CG2-OG 3.44Å; M152-S156 PolarHBondContact O-N 2.85Å; M152-S156 PolarHBondContact O-OG 3.08Å; L153-S156 PolarHBondContact O-OG 3.27Å; V154-S156 PolarHBondContact O-N 2.89Å; S156-K159 PolarHBondContact O-N 2.86Å; S156-K160 PolarHBondContact O-N 3.25Å
157	E	77.5	Confident	71.9	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-37.6	178	-72.9	-58.3	157	0	0	112.6	L103 L116 L153 V154 K159 K160 T161	L103-E157 HydrophobicContact CD1-CG 4.46Å; L103-E157 WeakPolarHBondContact CD1-OE1 3.48Å; L116-E157 HydrophobicContact CB-CG 4.14Å; L116-E157 HydrophobicContact CD1-CG 4.26Å; L153-E157 WeakPolarHBondContact O-CG 3.08Å; L153-E157 PolarHBondContact O-N 3.41Å; L153-E157 VanDerWaalsContact O-N 3.09Å; V154-E157 PolarHBondContact O-N 3.41Å; E157-K159 VanDerWaalsContact C-N 3.34Å; E157-K159 PolarHBondContact O-N 3.46Å; E157-K160 VanDerWaalsContact CD-NZ 3.3Å; E157-K160 PolarHBondContact O-N 3.37Å; E157-K160 IonicContact OE1-NZ 3Å; E157-K160 PolarHBondContact OE1-NZ 2.86Å; E157-K160 IonicContact OE2-NZ 2.76Å; E157-K160 PolarHBondContact OE2-NZ 3.47Å; E157-T161 PolarHBondContact O-N 3.35Å; E157-T161 PolarHBondContact O-OG1 2.98Å
158	M	71.5	Confident	70.6	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-67.5	-36.3	176.7	-66.7	-48.2	171.1	0	0	112.4	V120 V154 K160 T161 F162 L199 L245 I247	V120-M158 HydrophobicContact CB-CE 4.44Å; V120-M158 HydrophobicContact CG1-CE 3.75Å; V120-M158 HydrophobicContact CG1-SD 3.53Å; V120-M158 VanDerWaalsContact CG1-SD 3.53Å; V120-M158 HydrophobicContact CG2-CE 3.76Å; V154-M158 HydrophobicContact CG1-CE 3.62Å; V154-M158 HydrophobicContact CG1-CG 3.59Å; V154-M158 HydrophobicContact CG1-SD 4.44Å; V154-M158 VanDerWaalsContact O-CB 3.27Å; V154-M158 WeakPolarHBondContact O-CB 3.31Å; V154-M158 WeakPolarHBondContact O-CG 3.11Å; V154-M158 PolarHBondContact O-N 2.9Å; M158-K160 VanDerWaalsContact C-N 3.26Å; M158-K160 PolarHBondContact O-N 2.84Å; M158-T161 PolarHBondContact O-N 3.28Å; M158-F162 PolarHBondContact O-N 3.13Å; M158-F162 HydrophobicContact SD-CD2 3.68Å; M158-F162 HydrophobicContact SD-CE2 3.68Å; M158-L199 HydrophobicContact CB-CD2 4.36Å; M158-L199 HydrophobicContact CE-CD1 3.47Å; M158-L199 VanDerWaalsContact CE-CD1 3.47Å; M158-L199 HydrophobicContact CE-CD2 3.49Å; M158-L199 VanDerWaalsContact CE-CD2 3.49Å; M158-L199 HydrophobicContact CE-CG 4.02Å; M158-L199 HydrophobicContact CG-CD2 3.56Å; M158-L199 HydrophobicContact SD-CD1 3.95Å; M158-L199 HydrophobicContact SD-CD2 3.11Å; M158-L199 WeakPolarHBondContact SD-CD2 3.42Å; M158-L199 HydrophobicContact SD-CG 4.12Å; M158-L245 HydrophobicContact CE-CD2 4.49Å; M158-I247 HydrophobicContact CE-CD1 3.13Å; M158-I247 HydrophobicContact CE-CG1 4.18Å
159	K	71.2	Confident	69.2	Low	83 Å²	83	38.5 Å²	38.5	36%	0.361	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-33.3	175.9	-174.4	178.6	173.9	-177.1	0	112.8	T97 S99 L101 R155 S156 E157	T97-K159 HydrophobicContact CG2-CB 4.23Å; T97-K159 HydrophobicContact CG2-CG 4.34Å; S99-K159 PolarHBondContact O-NZ 2.9Å; L101-K159 WeakPolarHBondContact O-CD 3.13Å; L101-K159 PolarHBondContact O-NZ 3.15Å; R155-K159 WeakPolarHBondContact O-CB 3.42Å; R155-K159 PolarHBondContact O-N 3.1Å; R155-K159 VanDerWaalsContact O-N 3.15Å; S156-K159 PolarHBondContact O-N 2.86Å; E157-K159 VanDerWaalsContact C-N 3.34Å; E157-K159 PolarHBondContact O-N 3.46Å
160	K	69.1	Low	68.2	Low	94 Å²	94	44 Å²	44	41%	0.409	21%	0.208	S	C	.	.	H	α-helix	trans	-68	-35.9	176.3	-69.3	-177.4	-168.3	154.1	0	113.1	L103 S156 E157 M158	L103-K160 VanDerWaalsContact CD1-NZ 3.33Å; L103-K160 VanDerWaalsContact CD2-CE 3.47Å; S156-K160 PolarHBondContact O-N 3.25Å; E157-K160 VanDerWaalsContact CD-NZ 3.3Å; E157-K160 PolarHBondContact O-N 3.37Å; E157-K160 IonicContact OE1-NZ 3Å; E157-K160 PolarHBondContact OE1-NZ 2.86Å; E157-K160 IonicContact OE2-NZ 2.76Å; E157-K160 PolarHBondContact OE2-NZ 3.47Å; M158-K160 VanDerWaalsContact C-N 3.26Å; M158-K160 PolarHBondContact O-N 2.84Å
161	T	65.2	Low	67.1	Low	29 Å²	29	49.5 Å²	49.5	18%	0.178	23%	0.233	C	C	.	.	H	α-helix	trans	-96.7	-44.3	-168.1	-47.8	0	0	0	0	111.5	V120 V121 A124 E157 M158	V120-T161 HydrophobicContact CG1-CG2 4.33Å; V121-T161 WeakPolarHBondContact CG2-OG1 3.26Å; A124-T161 HydrophobicContact CB-CG2 3.23Å; E157-T161 PolarHBondContact O-N 3.35Å; E157-T161 PolarHBondContact O-OG1 2.98Å; M158-T161 PolarHBondContact O-N 3.28Å
162	F	63	Low	66.5	Low	26 Å²	26	55.8 Å²	55.8	11%	0.114	26%	0.255	C	S	.	.			trans	-116.7	104	-172	-53.8	-67.5	0	0	0	108.8	V120 A124 M158 R164 F197 L199	V120-F162 HydrophobicContact CG1-CD2 4.42Å; V120-F162 HydrophobicContact CG1-CE2 3.49Å; V120-F162 VanDerWaalsContact CG1-CE2 3.49Å; V120-F162 HydrophobicContact CG1-CZ 4.12Å; A124-F162 HydrophobicContact CB-CE1 4.13Å; A124-F162 HydrophobicContact CB-CZ 4.21Å; M158-F162 PolarHBondContact O-N 3.13Å; M158-F162 HydrophobicContact SD-CD2 3.68Å; M158-F162 HydrophobicContact SD-CE2 3.68Å; F162-R164 PolarHBondContact O-N 3.3Å; F162-F197 HydrophobicContact CD1-CB 4.17Å; F162-F197 HydrophobicContact CD1-CD1 4.26Å; F162-F197 HydrophobicContact CD1-CG 4.08Å; F162-F197 HydrophobicContact CE1-CB 3.99Å; F162-F197 AromaticContact CE1-CD1 3.45Å; F162-F197 HydrophobicContact CE1-CD1 3.45Å; F162-F197 VanDerWaalsContact CE1-CD1 3.45Å; F162-F197 HydrophobicContact CE1-CE1 4.04Å; F162-F197 AromaticContact CE1-CG 3.71Å; F162-F197 HydrophobicContact CE1-CG 3.71Å; F162-F197 HydrophobicContact CZ-CD1 4.28Å; F162-L199 HydrophobicContact CD2-CD2 4.02Å; F162-L199 HydrophobicContact CE2-CB 4.4Å; F162-L199 HydrophobicContact CE2-CD1 4.17Å; F162-L199 HydrophobicContact CE2-CD2 4.11Å; F162-L199 HydrophobicContact CE2-CG 4.45Å
163	A	49.3	Very low	65.8	Low	93 Å²	93	53 Å²	53	77%	0.769	24%	0.242	S	C	*	.	S	Bend	trans	-67.5	-10.9	169.5	0	0	0	0	0	112.4
164	R	50.9	Low	64.9	Low	216 Å²	216	53.1 Å²	53.1	82%	0.815	24%	0.242	S	C	*	.	S	Bend	trans	-133.1	106.6	-163.9	-64.6	178.5	-177.3	144.2	0.6	109.9	F162	F162-R164 PolarHBondContact O-N 3.3Å
165	V	51.7	Low	64.4	Low	35 Å²	35	55.3 Å²	55.3	21%	0.212	25%	0.254	C	S	.	.			trans	61.4	109.1	162.4	179.3	0	0	0	0	116.3	I94 F194	I94-V165 HydrophobicContact CB-CG1 4.42Å; I94-V165 HydrophobicContact CG1-CG1 4.24Å; I94-V165 HydrophobicContact CG2-CB 4.31Å; I94-V165 HydrophobicContact CG2-CG1 3.45Å; I94-V165 VanDerWaalsContact CG2-CG1 3.45Å; I94-V165 HydrophobicContact CG2-CG2 4.06Å; V165-F194 HydrophobicContact CB-CE1 4.32Å; V165-F194 HydrophobicContact CG1-CD1 4.11Å; V165-F194 HydrophobicContact CG1-CE1 3.59Å; V165-F194 HydrophobicContact CG1-CZ 4.12Å
166	S	55.3	Low	64.1	Low	14 Å²	14	51.7 Å²	51.7	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	138	157.5	-68.3	0	0	0	0	108.9	I95	I95-S166 PolarHBondContact N-O 2.84Å; I95-S166 VanDerWaalsContact N-O 3.12Å; I95-S166 VanDerWaalsContact O-O 3.06Å
167	Y	56	Low	63.5	Low	9 Å²	9	51.5 Å²	51.5	4%	0.035	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	157.1	171	166.2	-116.8	0	0	0	109.9	Q93 F169 L173 M190 R201	Q93-Y167 HydrophobicContact CB-CD2 4.14Å; Q93-Y167 HydrophobicContact CB-CE2 3.67Å; Q93-Y167 WeakPolarHBondContact O-CD2 3.26Å; Y167-F169 AromaticContact CD1-CD2 3.52Å; Y167-F169 HydrophobicContact CD1-CD2 3.52Å; Y167-F169 HydrophobicContact CD1-CE1 4.47Å; Y167-F169 AromaticContact CD1-CE2 3.51Å; Y167-F169 HydrophobicContact CD1-CE2 3.51Å; Y167-F169 HydrophobicContact CD1-CG 4.08Å; Y167-F169 HydrophobicContact CD1-CZ 4.01Å; Y167-F169 HydrophobicContact CE1-CB 3.94Å; Y167-F169 AromaticContact CE1-CD1 3.32Å; Y167-F169 HydrophobicContact CE1-CD1 3.32Å; Y167-F169 AromaticContact CE1-CD2 2.97Å; Y167-F169 HydrophobicContact CE1-CD2 2.97Å; Y167-F169 AromaticContact CE1-CE1 3.46Å; Y167-F169 HydrophobicContact CE1-CE1 3.46Å; Y167-F169 VanDerWaalsContact CE1-CE1 3.46Å; Y167-F169 AromaticContact CE1-CE2 3.17Å; Y167-F169 HydrophobicContact CE1-CE2 3.17Å; Y167-F169 AromaticContact CE1-CG 3.09Å; Y167-F169 HydrophobicContact CE1-CG 3.09Å; Y167-F169 AromaticContact CE1-CZ 3.41Å; Y167-F169 HydrophobicContact CE1-CZ 3.41Å; Y167-F169 VanDerWaalsContact CE1-CZ 3.41Å; Y167-F169 VanDerWaalsContact CZ-CA 3.41Å; Y167-F169 AromaticContact CZ-CD1 3.61Å; Y167-F169 AromaticContact CZ-CD2 3.84Å; Y167-F169 AromaticContact CZ-CG 3.49Å; Y167-F169 VanDerWaalsContact CZ-CG 3.49Å; Y167-F169 WeakPolarHBondContact OH-CA 3.41Å; Y167-F169 WeakPolarHBondContact OH-CB 3.28Å; Y167-F169 WeakPolarHBondContact OH-CD1 3.46Å; Y167-F169 WeakPolarHBondContact OH-CG 3.01Å; Y167-L173 HydrophobicContact CD2-CD2 4.47Å; Y167-L173 HydrophobicContact CE1-CD2 4.31Å; Y167-L173 HydrophobicContact CE2-CD2 3.36Å; Y167-L173 WeakPolarHBondContact OH-CB 3.01Å; Y167-L173 WeakPolarHBondContact OH-CD2 2.9Å; Y167-L173 WeakPolarHBondContact OH-CG 3.49Å; Y167-M190 HydrophobicContact CD1-CE 3.49Å; Y167-M190 VanDerWaalsContact CD1-CE 3.49Å; Y167-M190 HydrophobicContact CE1-CE 3.2Å; Y167-M190 HydrophobicContact CE2-CE 4.47Å; Y167-M190 HydrophobicContact CG-CE 4.18Å; Y167-R201 CarbonylContact C-O 3.54Å; Y167-R201 CarbonylContact O-C 3.6Å; Y167-R201 WeakPolarHBondContact O-CB 3.15Å
168	S	61.4	Low	63	Low	6 Å²	6	52.1 Å²	52.1	4%	0.042	25%	0.248	C	C	.	.			trans	-131.7	115.2	170	166	0	0	0	0	106.8	Q93 I95 R170 L203	Q93-S168 PolarHBondContact OE1-O 3.43Å; I95-S168 VanDerWaalsContact CD1-CB 3.4Å; S168-R170 VanDerWaalsContact C-N 3.32Å; S168-R170 PolarHBondContact O-N 3.21Å; S168-L203 PolarHBondContact OG-O 2.9Å
169	F	61.5	Low	62.9	Low	3 Å²	3	60.4 Å²	60.4	1%	0.013	28%	0.279	C	S	.	.			trans	-68.9	96.4	171.9	-62.5	-104.6	0	0	0	109.6	Y167 L174 I177 F187 M190 A200 L202	Y167-F169 AromaticContact CD1-CD2 3.52Å; Y167-F169 HydrophobicContact CD1-CD2 3.52Å; Y167-F169 HydrophobicContact CD1-CE1 4.47Å; Y167-F169 AromaticContact CD1-CE2 3.51Å; Y167-F169 HydrophobicContact CD1-CE2 3.51Å; Y167-F169 HydrophobicContact CD1-CG 4.08Å; Y167-F169 HydrophobicContact CD1-CZ 4.01Å; Y167-F169 HydrophobicContact CE1-CB 3.94Å; Y167-F169 AromaticContact CE1-CD1 3.32Å; Y167-F169 HydrophobicContact CE1-CD1 3.32Å; Y167-F169 AromaticContact CE1-CD2 2.97Å; Y167-F169 HydrophobicContact CE1-CD2 2.97Å; Y167-F169 AromaticContact CE1-CE1 3.46Å; Y167-F169 HydrophobicContact CE1-CE1 3.46Å; Y167-F169 VanDerWaalsContact CE1-CE1 3.46Å; Y167-F169 AromaticContact CE1-CE2 3.17Å; Y167-F169 HydrophobicContact CE1-CE2 3.17Å; Y167-F169 AromaticContact CE1-CG 3.09Å; Y167-F169 HydrophobicContact CE1-CG 3.09Å; Y167-F169 AromaticContact CE1-CZ 3.41Å; Y167-F169 HydrophobicContact CE1-CZ 3.41Å; Y167-F169 VanDerWaalsContact CE1-CZ 3.41Å; Y167-F169 VanDerWaalsContact CZ-CA 3.41Å; Y167-F169 AromaticContact CZ-CD1 3.61Å; Y167-F169 AromaticContact CZ-CD2 3.84Å; Y167-F169 AromaticContact CZ-CG 3.49Å; Y167-F169 VanDerWaalsContact CZ-CG 3.49Å; Y167-F169 WeakPolarHBondContact OH-CA 3.41Å; Y167-F169 WeakPolarHBondContact OH-CB 3.28Å; Y167-F169 WeakPolarHBondContact OH-CD1 3.46Å; Y167-F169 WeakPolarHBondContact OH-CG 3.01Å; F169-L174 HydrophobicContact CB-CD1 3.97Å; F169-L174 HydrophobicContact CB-CD2 4.16Å; F169-L174 HydrophobicContact CB-CG 3.97Å; F169-L174 HydrophobicContact CD1-CD2 3.58Å; F169-L174 HydrophobicContact CD1-CG 4.14Å; F169-L174 HydrophobicContact CE1-CD2 4.39Å; F169-L174 HydrophobicContact CG-CD2 4.25Å; F169-I177 HydrophobicContact CD1-CD1 4.41Å; F169-I177 HydrophobicContact CE1-CD1 4.19Å; F169-F187 HydrophobicContact CE1-CD1 4.45Å; F169-F187 AromaticContact CE1-CE1 3.65Å; F169-F187 HydrophobicContact CE1-CE1 3.65Å; F169-F187 HydrophobicContact CE1-CZ 4.32Å; F169-F187 AromaticContact CZ-CE1 3.94Å; F169-F187 HydrophobicContact CZ-CE1 3.94Å; F169-M190 HydrophobicContact CE1-CE 3.91Å; F169-M190 HydrophobicContact CZ-CE 3.82Å; F169-A200 HydrophobicContact CE2-CB 3.98Å; F169-L202 HydrophobicContact CB-CD1 4.02Å; F169-L202 HydrophobicContact CB-CD2 4.37Å; F169-L202 HydrophobicContact CB-CG 3.76Å; F169-L202 HydrophobicContact CD1-CD1 4.03Å; F169-L202 HydrophobicContact CD2-CB 3.74Å; F169-L202 HydrophobicContact CD2-CD1 3.25Å; F169-L202 HydrophobicContact CD2-CG 3.29Å; F169-L202 HydrophobicContact CE1-CD1 4.3Å; F169-L202 HydrophobicContact CE2-CB 4.19Å; F169-L202 HydrophobicContact CE2-CD1 3.55Å; F169-L202 HydrophobicContact CE2-CG 3.98Å; F169-L202 HydrophobicContact CG-CD1 3.5Å; F169-L202 VanDerWaalsContact CG-CD1 3.5Å; F169-L202 HydrophobicContact CG-CG 3.66Å; F169-L202 HydrophobicContact CZ-CD1 4.07Å
170	R	63.4	Low	62.8	Low	134 Å²	134	57.4 Å²	57.4	51%	0.506	27%	0.27	S	S	.	.			trans	-85	152.3	167.2	-65.6	-174	172	152.7	-2.8	108.9	S168 R172 L173 L174	S168-R170 VanDerWaalsContact C-N 3.32Å; S168-R170 PolarHBondContact O-N 3.21Å; R170-R172 PolarHBondContact O-N 3.42Å; R170-L173 PolarHBondContact O-N 3.39Å; R170-L174 PolarHBondContact O-N 3.39Å
171	H	64.5	Low	62.5	Low	122 Å²	122	58 Å²	58	57%	0.565	29%	0.292	S	S	*	.	H	α-helix	trans	-43.9	-36.7	176.7	-174.7	-108	0	0	0	113.1	L174 L175	H171-L174 PolarHBondContact O-N 2.99Å; H171-L175 WeakPolarHBondContact CE1-CD1 3.37Å; H171-L175 VanDerWaalsContact ND1-CD1 3.28Å; H171-L175 WeakPolarHBondContact ND1-CD1 3.41Å; H171-L175 VanDerWaalsContact O-CB 3.28Å; H171-L175 WeakPolarHBondContact O-CB 3.4Å; H171-L175 VanDerWaalsContact O-CG 3.31Å; H171-L175 WeakPolarHBondContact O-CG 3.48Å; H171-L175 PolarHBondContact O-N 2.93Å
172	R	67.4	Low	62.6	Low	147 Å²	147	62.2 Å²	62.2	56%	0.555	31%	0.31	S	S	*	.	H	α-helix	trans	-62.3	-42.1	177.6	-174.6	177.5	-176.4	-142.7	-0.9	114.3	E92 R170 A176	E92-R172 IonicContact OE2-CZ 2.86Å; E92-R172 IonicContact OE2-NH1 4Å; E92-R172 PolarHBondContact OE2-NH1 3.02Å; E92-R172 IonicContact OE2-NH2 2.9Å; R170-R172 PolarHBondContact O-N 3.42Å; R172-A176 WeakPolarHBondContact O-CB 2.98Å; R172-A176 PolarHBondContact O-N 2.87Å
173	L	66.7	Low	62.6	Low	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-77.9	-35.7	177.8	176.4	49.1	0	0	0	110.4	I89 I90 Q93 Y167 R170 L175 A176 I177 M190	I89-L173 HydrophobicContact CG2-CB 4.04Å; I89-L173 HydrophobicContact CG2-CD1 3.92Å; I89-L173 HydrophobicContact CG2-CG 4.47Å; I90-L173 HydrophobicContact CB-CD2 4.38Å; I90-L173 HydrophobicContact CG1-CD1 3.8Å; I90-L173 HydrophobicContact CG1-CD2 3.86Å; Q93-L173 HydrophobicContact CB-CD2 4.49Å; Q93-L173 VanDerWaalsContact NE2-CB 3.33Å; Y167-L173 HydrophobicContact CD2-CD2 4.47Å; Y167-L173 HydrophobicContact CE1-CD2 4.31Å; Y167-L173 HydrophobicContact CE2-CD2 3.36Å; Y167-L173 WeakPolarHBondContact OH-CB 3.01Å; Y167-L173 WeakPolarHBondContact OH-CD2 2.9Å; Y167-L173 WeakPolarHBondContact OH-CG 3.49Å; R170-L173 PolarHBondContact O-N 3.39Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.45Å; L173-A176 HydrophobicContact CD1-CB 4.35Å; L173-A176 CarbonylContact O-C 3.59Å; L173-A176 WeakPolarHBondContact O-CB 3.21Å; L173-A176 PolarHBondContact O-N 3.37Å; L173-I177 HydrophobicContact CD1-CD1 3.93Å; L173-I177 HydrophobicContact CD1-CG1 3.83Å; L173-I177 HydrophobicContact CG-CD1 3.81Å; L173-I177 HydrophobicContact CG-CG1 4.25Å; L173-I177 WeakPolarHBondContact O-CB 3.49Å; L173-I177 VanDerWaalsContact O-CG1 3.24Å; L173-I177 WeakPolarHBondContact O-CG1 3.27Å; L173-I177 PolarHBondContact O-N 2.86Å; L173-M190 HydrophobicContact CD2-CE 4.46Å; L173-M190 HydrophobicContact CD2-SD 4.36Å
174	L	65.4	Low	63.3	Low	3 Å²	3	59.4 Å²	59.4	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-43.4	173.9	-72.3	169.3	0	0	0	112.3	F169 R170 H171 A176 I177 A178 I210 L225	F169-L174 HydrophobicContact CB-CD1 3.97Å; F169-L174 HydrophobicContact CB-CD2 4.16Å; F169-L174 HydrophobicContact CB-CG 3.97Å; F169-L174 HydrophobicContact CD1-CD2 3.58Å; F169-L174 HydrophobicContact CD1-CG 4.14Å; F169-L174 HydrophobicContact CE1-CD2 4.39Å; F169-L174 HydrophobicContact CG-CD2 4.25Å; R170-L174 PolarHBondContact O-N 3.39Å; H171-L174 PolarHBondContact O-N 2.99Å; L174-A176 VanDerWaalsContact C-N 3.33Å; L174-A176 PolarHBondContact O-N 2.96Å; L174-I177 PolarHBondContact O-N 3.38Å; L174-A178 VanDerWaalsContact O-CB 3.3Å; L174-A178 WeakPolarHBondContact O-CB 3.43Å; L174-A178 PolarHBondContact O-N 3.5Å; L174-I210 HydrophobicContact CD1-CD1 3.16Å; L174-I210 HydrophobicContact CD1-CG1 3.71Å; L174-L225 HydrophobicContact CB-CD2 3.86Å; L174-L225 HydrophobicContact CD2-CD1 4.11Å; L174-L225 HydrophobicContact CD2-CD2 4.21Å
175	L	67.5	Low	63.7	Low	47 Å²	47	51 Å²	51	25%	0.246	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-39.6	170.9	-82.5	171.4	0	0	0	112.8	H171 L173 I177 R179	H171-L175 WeakPolarHBondContact CE1-CD1 3.37Å; H171-L175 VanDerWaalsContact ND1-CD1 3.28Å; H171-L175 WeakPolarHBondContact ND1-CD1 3.41Å; H171-L175 VanDerWaalsContact O-CB 3.28Å; H171-L175 WeakPolarHBondContact O-CB 3.4Å; H171-L175 VanDerWaalsContact O-CG 3.31Å; H171-L175 WeakPolarHBondContact O-CG 3.48Å; H171-L175 PolarHBondContact O-N 2.93Å; L173-L175 VanDerWaalsContact C-N 3.33Å; L173-L175 PolarHBondContact O-N 3.45Å; L175-I177 VanDerWaalsContact C-N 3.33Å; L175-R179 WeakPolarHBondContact O-CB 3.38Å; L175-R179 VanDerWaalsContact O-CG 3.3Å; L175-R179 WeakPolarHBondContact O-CG 3.4Å; L175-R179 PolarHBondContact O-N 3.28Å
176	A	69	Low	64.2	Low	17 Å²	17	49.5 Å²	49.5	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-38.8	178.1	0	0	0	0	0	111.2	L86 I89 R172 L173 L174 A180	L86-A176 HydrophobicContact CD2-CB 3.73Å; I89-A176 HydrophobicContact CD1-CB 3.92Å; I89-A176 HydrophobicContact CG2-CB 4.41Å; R172-A176 WeakPolarHBondContact O-CB 2.98Å; R172-A176 PolarHBondContact O-N 2.87Å; L173-A176 HydrophobicContact CD1-CB 4.35Å; L173-A176 CarbonylContact O-C 3.59Å; L173-A176 WeakPolarHBondContact O-CB 3.21Å; L173-A176 PolarHBondContact O-N 3.37Å; L174-A176 VanDerWaalsContact C-N 3.33Å; L174-A176 PolarHBondContact O-N 2.96Å; A176-A180 PolarHBondContact O-N 2.9Å; A176-A180 VanDerWaalsContact O-N 3.13Å
177	I	67	Low	64.6	Low	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-54.4	172.1	-69.2	164.8	0	0	0	109.7	F169 L173 L174 L175 R179 A180 P183 I186 F187 M190 L225	F169-I177 HydrophobicContact CD1-CD1 4.41Å; F169-I177 HydrophobicContact CE1-CD1 4.19Å; L173-I177 HydrophobicContact CD1-CD1 3.93Å; L173-I177 HydrophobicContact CD1-CG1 3.83Å; L173-I177 HydrophobicContact CG-CD1 3.81Å; L173-I177 HydrophobicContact CG-CG1 4.25Å; L173-I177 WeakPolarHBondContact O-CB 3.49Å; L173-I177 VanDerWaalsContact O-CG1 3.24Å; L173-I177 WeakPolarHBondContact O-CG1 3.27Å; L173-I177 PolarHBondContact O-N 2.86Å; L174-I177 PolarHBondContact O-N 3.38Å; L175-I177 VanDerWaalsContact C-N 3.33Å; I177-R179 PolarHBondContact O-N 3.47Å; I177-R179 VanDerWaalsContact O-N 3.13Å; I177-A180 VanDerWaalsContact O-CB 3.28Å; I177-A180 WeakPolarHBondContact O-CB 3.35Å; I177-A180 PolarHBondContact O-N 3.14Å; I177-P183 HydrophobicContact CG2-CB 3.68Å; I177-P183 WeakPolarHBondContact O-CB 3.48Å; I177-I186 HydrophobicContact CB-CD1 4.22Å; I177-I186 HydrophobicContact CD1-CG2 4.04Å; I177-I186 HydrophobicContact CG1-CB 4.12Å; I177-I186 HydrophobicContact CG1-CD1 3.89Å; I177-I186 HydrophobicContact CG1-CG2 3.57Å; I177-F187 HydrophobicContact CD1-CE2 4.42Å; I177-F187 HydrophobicContact CD1-CZ 4.22Å; I177-F187 HydrophobicContact CG2-CD2 4.05Å; I177-F187 HydrophobicContact CG2-CE2 3.46Å; I177-F187 VanDerWaalsContact CG2-CE2 3.46Å; I177-F187 HydrophobicContact CG2-CZ 4.13Å; I177-M190 HydrophobicContact CD1-SD 4.39Å; I177-L225 HydrophobicContact CB-CD1 4.25Å; I177-L225 HydrophobicContact CG2-CD1 3.87Å
178	A	66.8	Low	64.9	Low	14 Å²	14	52.1 Å²	52.1	12%	0.116	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-29.3	-177	0	0	0	0	0	113.6	L174 V221 L225	L174-A178 VanDerWaalsContact O-CB 3.3Å; L174-A178 WeakPolarHBondContact O-CB 3.43Å; L174-A178 PolarHBondContact O-N 3.5Å; A178-V221 HydrophobicContact CB-CG1 3.46Å; A178-V221 VanDerWaalsContact CB-CG1 3.46Å; A178-L225 HydrophobicContact CB-CB 3.86Å; A178-L225 HydrophobicContact CB-CD1 4.1Å; A178-L225 HydrophobicContact CB-CD2 4.26Å; A178-L225 HydrophobicContact CB-CG 4.29Å
179	R	69	Low	64.8	Low	177 Å²	177	51.9 Å²	51.9	67%	0.668	26%	0.259	S	S	*	.	H	α-helix	trans	-88.3	-12.3	176.4	-71.6	-172.3	179.7	103.4	0.3	114	L175 I177	L175-R179 WeakPolarHBondContact O-CB 3.38Å; L175-R179 VanDerWaalsContact O-CG 3.3Å; L175-R179 WeakPolarHBondContact O-CG 3.4Å; L175-R179 PolarHBondContact O-N 3.28Å; I177-R179 PolarHBondContact O-N 3.47Å; I177-R179 VanDerWaalsContact O-N 3.13Å
180	A	68	Low	64.9	Low	20 Å²	20	51.7 Å²	51.7	17%	0.165	26%	0.258	C	S	.	.	S	Bend	trans	-68.1	142.2	178	0	0	0	0	0	109.9	L86 A176 I177 Q182 I186	L86-A180 HydrophobicContact CD1-CB 4.13Å; A176-A180 PolarHBondContact O-N 2.9Å; A176-A180 VanDerWaalsContact O-N 3.13Å; I177-A180 VanDerWaalsContact O-CB 3.28Å; I177-A180 WeakPolarHBondContact O-CB 3.35Å; I177-A180 PolarHBondContact O-N 3.14Å; A180-Q182 PolarHBondContact O-N 2.96Å; A180-I186 HydrophobicContact CB-CD1 3.34Å; A180-I186 HydrophobicContact CB-CG1 4.42Å
181	A	63.9	Low	64.7	Low	106 Å²	106	46.8 Å²	46.8	88%	0.876	24%	0.239	S	C	*	.	S	Bend	trans	-59.5	-33.2	177.7	0	0	0	0	0	111.9
182	Q	66.7	Low	64.4	Low	118 Å²	118	41.8 Å²	41.8	55%	0.551	22%	0.218	S	C	*	.			trans	-132	82.2	178.6	-70.5	175	-18.3	0	0	108.8	A180 S184 I185	A180-Q182 PolarHBondContact O-N 2.96Å; Q182-S184 PolarHBondContact O-N 3.15Å; Q182-I185 HydrophobicContact CB-CB 4.33Å; Q182-I185 HydrophobicContact CB-CD1 3.98Å; Q182-I185 HydrophobicContact CB-CG1 3.97Å; Q182-I185 PolarHBondContact O-N 3.37Å; Q182-I185 VanDerWaalsContact O-N 3.12Å
183	P	63.1	Low	63.9	Low	24 Å²	24	37.3 Å²	37.3	16%	0.156	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-27.7	-178.6	30.1	-37.2	0	0	0	111.5	I177 I185 I186 F187 E228	I177-P183 HydrophobicContact CG2-CB 3.68Å; I177-P183 WeakPolarHBondContact O-CB 3.48Å; P183-I185 VanDerWaalsContact C-N 3.31Å; P183-I185 PolarHBondContact O-N 3.03Å; P183-I186 WeakPolarHBondContact O-CB 3.49Å; P183-I186 PolarHBondContact O-N 3.22Å; P183-F187 WeakPolarHBondContact O-CD2 3.5Å; P183-F187 PolarHBondContact O-N 3.12Å; P183-E228 HydrophobicContact CB-CB 4.41Å; P183-E228 HydrophobicContact CB-CG 3.81Å; P183-E228 HydrophobicContact CG-CB 4.17Å; P183-E228 HydrophobicContact CG-CG 3.73Å
184	S	63.4	Low	63.4	Low	35 Å²	35	38.9 Å²	38.9	25%	0.245	21%	0.212	C	C	.	.	H	α-helix	trans	-53.7	-42.9	171.7	58.1	0	0	0	0	113.2	Q182 I186 F187 I188 E228	Q182-S184 PolarHBondContact O-N 3.15Å; S184-I186 VanDerWaalsContact C-N 3.25Å; S184-I186 PolarHBondContact O-N 3.43Å; S184-F187 PolarHBondContact O-N 3Å; S184-I188 WeakPolarHBondContact O-CB 3.19Å; S184-I188 WeakPolarHBondContact O-CD1 3.26Å; S184-I188 WeakPolarHBondContact O-CG1 3.35Å; S184-I188 PolarHBondContact O-N 3.23Å; S184-E228 WeakPolarHBondContact CA-OE1 3.42Å; S184-E228 WeakPolarHBondContact CB-OE1 3.26Å; S184-E228 PolarHBondContact N-OE1 3.02Å
185	I	60.1	Low	62.4	Low	40 Å²	40	42.4 Å²	42.4	21%	0.205	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-33.8	178.4	-68.5	-172.8	0	0	0	111.3	I82 Q182 P183 G189	I82-I185 HydrophobicContact CG1-CG2 3.77Å; Q182-I185 HydrophobicContact CB-CB 4.33Å; Q182-I185 HydrophobicContact CB-CD1 3.98Å; Q182-I185 HydrophobicContact CB-CG1 3.97Å; Q182-I185 PolarHBondContact O-N 3.37Å; Q182-I185 VanDerWaalsContact O-N 3.12Å; P183-I185 VanDerWaalsContact C-N 3.31Å; P183-I185 PolarHBondContact O-N 3.03Å; I185-G189 WeakPolarHBondContact O-CA 3.37Å; I185-G189 PolarHBondContact O-N 3.14Å
186	I	62.9	Low	61.3	Low	3 Å²	3	46.1 Å²	46.1	2%	0.015	25%	0.25	C	S	.	.	H	α-helix	trans	-68.7	-45.4	177.6	-62.5	164.4	0	0	0	110.2	L86 I90 I177 A180 P183 S184 G189 M190	L86-I186 HydrophobicContact CD1-CD1 3.63Å; L86-I186 HydrophobicContact CD1-CG1 3.97Å; L86-I186 HydrophobicContact CD2-CD1 3.95Å; L86-I186 HydrophobicContact CG-CD1 4.34Å; I90-I186 HydrophobicContact CD1-CG2 3.78Å; I90-I186 HydrophobicContact CG1-CG2 4.42Å; I177-I186 HydrophobicContact CB-CD1 4.22Å; I177-I186 HydrophobicContact CD1-CG2 4.04Å; I177-I186 HydrophobicContact CG1-CB 4.12Å; I177-I186 HydrophobicContact CG1-CD1 3.89Å; I177-I186 HydrophobicContact CG1-CG2 3.57Å; A180-I186 HydrophobicContact CB-CD1 3.34Å; A180-I186 HydrophobicContact CB-CG1 4.42Å; P183-I186 WeakPolarHBondContact O-CB 3.49Å; P183-I186 PolarHBondContact O-N 3.22Å; S184-I186 VanDerWaalsContact C-N 3.25Å; S184-I186 PolarHBondContact O-N 3.43Å; I186-G189 PolarHBondContact O-N 2.84Å; I186-M190 HydrophobicContact CG2-CG 4.31Å; I186-M190 HydrophobicContact CG2-SD 3.88Å; I186-M190 WeakPolarHBondContact O-CB 3.29Å; I186-M190 WeakPolarHBondContact O-CG 3.42Å; I186-M190 PolarHBondContact O-N 3.39Å
187	F	62.5	Low	60	Low	11 Å²	11	50 Å²	50	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-42.7	176.8	-77.6	-77.7	0	0	0	112.3	F169 I177 P183 S184 G189 M190 R191 E228 F229 Q232	F169-F187 HydrophobicContact CE1-CD1 4.45Å; F169-F187 AromaticContact CE1-CE1 3.65Å; F169-F187 HydrophobicContact CE1-CE1 3.65Å; F169-F187 HydrophobicContact CE1-CZ 4.32Å; F169-F187 AromaticContact CZ-CE1 3.94Å; F169-F187 HydrophobicContact CZ-CE1 3.94Å; I177-F187 HydrophobicContact CD1-CE2 4.42Å; I177-F187 HydrophobicContact CD1-CZ 4.22Å; I177-F187 HydrophobicContact CG2-CD2 4.05Å; I177-F187 HydrophobicContact CG2-CE2 3.46Å; I177-F187 VanDerWaalsContact CG2-CE2 3.46Å; I177-F187 HydrophobicContact CG2-CZ 4.13Å; P183-F187 WeakPolarHBondContact O-CD2 3.5Å; P183-F187 PolarHBondContact O-N 3.12Å; S184-F187 PolarHBondContact O-N 3Å; F187-G189 VanDerWaalsContact C-N 3.32Å; F187-G189 PolarHBondContact O-N 3.23Å; F187-M190 PolarHBondContact O-N 3.15Å; F187-R191 WeakPolarHBondContact O-CB 3.35Å; F187-R191 PolarHBondContact O-N 3.18Å; F187-E228 HydrophobicContact CD2-CG 3.78Å; F187-E228 HydrophobicContact CE2-CB 4.34Å; F187-E228 HydrophobicContact CE2-CG 3.74Å; F187-F229 HydrophobicContact CE1-CD2 4.12Å; F187-F229 HydrophobicContact CZ-CB 4.38Å; F187-F229 HydrophobicContact CZ-CD2 4.13Å; F187-Q232 HydrophobicContact CB-CB 3.98Å; F187-Q232 HydrophobicContact CB-CG 3.42Å; F187-Q232 VanDerWaalsContact CB-CG 3.42Å; F187-Q232 HydrophobicContact CD1-CB 4.08Å; F187-Q232 HydrophobicContact CD1-CG 4.19Å; F187-Q232 HydrophobicContact CD2-CB 4.35Å; F187-Q232 HydrophobicContact CD2-CG 3.63Å; F187-Q232 HydrophobicContact CE2-CG 4.35Å; F187-Q232 HydrophobicContact CG-CB 3.92Å; F187-Q232 HydrophobicContact CG-CG 3.52Å
188	I	62	Low	58.8	Low	68 Å²	68	51.1 Å²	51.1	35%	0.349	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-42.4	173.7	-67.6	163.9	0	0	0	110.5	I78 S184 R191 S192	I78-I188 HydrophobicContact CG2-CG2 4.19Å; S184-I188 WeakPolarHBondContact O-CB 3.19Å; S184-I188 WeakPolarHBondContact O-CD1 3.26Å; S184-I188 WeakPolarHBondContact O-CG1 3.35Å; S184-I188 PolarHBondContact O-N 3.23Å; I188-R191 PolarHBondContact O-N 3.5Å; I188-S192 VanDerWaalsContact O-CB 3.28Å; I188-S192 WeakPolarHBondContact O-CB 3.33Å; I188-S192 PolarHBondContact O-N 3.05Å; I188-S192 PolarHBondContact O-OG 3.15Å
189	G	60.7	Low	57.6	Low	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-44.3	176.7	0	0	0	0	0	112.4	I185 I186 F187 S192 L193	I185-G189 WeakPolarHBondContact O-CA 3.37Å; I185-G189 PolarHBondContact O-N 3.14Å; I186-G189 PolarHBondContact O-N 2.84Å; F187-G189 VanDerWaalsContact C-N 3.32Å; F187-G189 PolarHBondContact O-N 3.23Å; G189-S192 PolarHBondContact O-N 3.48Å; G189-L193 WeakPolarHBondContact O-CB 3.42Å; G189-L193 VanDerWaalsContact O-CG 3.26Å; G189-L193 WeakPolarHBondContact O-CG 3.42Å; G189-L193 PolarHBondContact O-N 3.38Å
190	M	62.2	Low	56.5	Low	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-45.9	173.3	-73.7	174.2	65.7	0	0	110.8	I90 Y167 F169 L173 I177 I186 F187 S192 L193 F194 F198	I90-M190 HydrophobicContact CD1-CG 4.03Å; I90-M190 HydrophobicContact CG1-CG 4.31Å; I90-M190 HydrophobicContact CG1-SD 4.4Å; I90-M190 HydrophobicContact CG2-CG 4.03Å; Y167-M190 HydrophobicContact CD1-CE 3.49Å; Y167-M190 VanDerWaalsContact CD1-CE 3.49Å; Y167-M190 HydrophobicContact CE1-CE 3.2Å; Y167-M190 HydrophobicContact CE2-CE 4.47Å; Y167-M190 HydrophobicContact CG-CE 4.18Å; F169-M190 HydrophobicContact CE1-CE 3.91Å; F169-M190 HydrophobicContact CZ-CE 3.82Å; L173-M190 HydrophobicContact CD2-CE 4.46Å; L173-M190 HydrophobicContact CD2-SD 4.36Å; I177-M190 HydrophobicContact CD1-SD 4.39Å; I186-M190 HydrophobicContact CG2-CG 4.31Å; I186-M190 HydrophobicContact CG2-SD 3.88Å; I186-M190 WeakPolarHBondContact O-CB 3.29Å; I186-M190 WeakPolarHBondContact O-CG 3.42Å; I186-M190 PolarHBondContact O-N 3.39Å; F187-M190 PolarHBondContact O-N 3.15Å; M190-S192 VanDerWaalsContact C-N 3.34Å; M190-S192 PolarHBondContact O-N 3.32Å; M190-L193 PolarHBondContact O-N 2.85Å; M190-F194 WeakPolarHBondContact O-CD2 3.07Å; M190-F194 PolarHBondContact O-N 2.82Å; M190-F198 HydrophobicContact CB-CE2 3.82Å; M190-F198 HydrophobicContact CB-CZ 4.17Å; M190-F198 WeakPolarHBondContact O-CD2 3.2Å; M190-F198 WeakPolarHBondContact O-CE2 3.11Å
191	R	60.7	Low	55.6	Low	30 Å²	30	41.8 Å²	41.8	11%	0.113	23%	0.228	C	C	.	.	H	α-helix	trans	-59.7	-44	174.6	-178.4	-177.8	170.7	98.7	-29	112.1	F187 I188 L193 F194 L195 G235 V236 S238 D242 V244	F187-R191 WeakPolarHBondContact O-CB 3.35Å; F187-R191 PolarHBondContact O-N 3.18Å; I188-R191 PolarHBondContact O-N 3.5Å; R191-L193 VanDerWaalsContact C-N 3.32Å; R191-L193 PolarHBondContact O-N 2.77Å; R191-F194 CarbonylContact O-C 3.22Å; R191-F194 PolarHBondContact O-N 3.35Å; R191-L195 PolarHBondContact O-N 3.13Å; R191-G235 PolarHBondContact NH2-O 3.35Å; R191-V236 VanDerWaalsContact NH1-CA 3.31Å; R191-V236 PolarHBondContact NH1-O 3.34Å; R191-V236 PolarHBondContact NH2-O 2.92Å; R191-S238 PolarHBondContact NH2-OG 3.25Å; R191-D242 IonicContact CZ-OD1 3.39Å; R191-D242 IonicContact CZ-OD2 3.42Å; R191-D242 VanDerWaalsContact CZ-OD2 3.31Å; R191-D242 IonicContact NE-OD2 2.64Å; R191-D242 IonicContact NH2-OD1 3.48Å; R191-D242 IonicContact NH2-OD2 2.66Å; R191-D242 PolarHBondContact NH2-OD2 3.42Å; R191-V244 VanDerWaalsContact NH1-CG2 3.27Å
192	S	57.9	Low	54.9	Low	17 Å²	17	37 Å²	37	12%	0.119	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-33.1	-179.7	-58.5	0	0	0	0	112.5	I188 G189 M190 F194 L195	I188-S192 VanDerWaalsContact O-CB 3.28Å; I188-S192 WeakPolarHBondContact O-CB 3.33Å; I188-S192 PolarHBondContact O-N 3.05Å; I188-S192 PolarHBondContact O-OG 3.15Å; G189-S192 PolarHBondContact O-N 3.48Å; M190-S192 VanDerWaalsContact C-N 3.34Å; M190-S192 PolarHBondContact O-N 3.32Å; S192-F194 PolarHBondContact O-N 3.39Å; S192-L195 WeakPolarHBondContact O-CD1 3.31Å; S192-L195 WeakPolarHBondContact O-CG 3.39Å
193	L	57.1	Low	54.1	Low	53 Å²	53	31.9 Å²	31.9	28%	0.277	16%	0.164	S	C	.	.	H	α-helix	trans	-66.5	-23.9	176.1	-84.4	171.4	0	0	0	113.3	M79 I90 G189 M190 R191	M79-L193 HydrophobicContact CE-CD1 3.83Å; M79-L193 HydrophobicContact CE-CD2 3.53Å; M79-L193 HydrophobicContact CE-CG 3.88Å; M79-L193 HydrophobicContact SD-CD2 3.43Å; M79-L193 WeakPolarHBondContact SD-CD2 3.33Å; M79-L193 HydrophobicContact SD-CG 4.16Å; I90-L193 HydrophobicContact CG2-CD1 4.43Å; G189-L193 WeakPolarHBondContact O-CB 3.42Å; G189-L193 VanDerWaalsContact O-CG 3.26Å; G189-L193 WeakPolarHBondContact O-CG 3.42Å; G189-L193 PolarHBondContact O-N 3.38Å; M190-L193 PolarHBondContact O-N 2.85Å; R191-L193 VanDerWaalsContact C-N 3.32Å; R191-L193 PolarHBondContact O-N 2.77Å
194	F	55	Low	53.5	Low	34 Å²	34	31.3 Å²	31.3	15%	0.149	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	38.2	-172.8	-44.8	-71	0	0	0	111.9	I94 V165 M190 R191 S192 D196 F197 F198	I94-F194 HydrophobicContact CD1-CE1 4.13Å; I94-F194 HydrophobicContact CD1-CZ 3.55Å; I94-F194 HydrophobicContact CG1-CZ 4.05Å; V165-F194 HydrophobicContact CB-CE1 4.32Å; V165-F194 HydrophobicContact CG1-CD1 4.11Å; V165-F194 HydrophobicContact CG1-CE1 3.59Å; V165-F194 HydrophobicContact CG1-CZ 4.12Å; M190-F194 WeakPolarHBondContact O-CD2 3.07Å; M190-F194 PolarHBondContact O-N 2.82Å; R191-F194 CarbonylContact O-C 3.22Å; R191-F194 PolarHBondContact O-N 3.35Å; S192-F194 PolarHBondContact O-N 3.39Å; F194-D196 PolarHBondContact O-N 3.41Å; F194-F197 CarbonylContact O-C 3.54Å; F194-F197 PolarHBondContact O-N 3.23Å; F194-F198 HydrophobicContact CB-CB 4.31Å; F194-F198 HydrophobicContact CB-CD2 4.02Å; F194-F198 AromaticContact CD2-CD2 3.75Å; F194-F198 HydrophobicContact CD2-CD2 3.75Å; F194-F198 AromaticContact CD2-CE2 3.98Å; F194-F198 HydrophobicContact CD2-CE2 3.98Å; F194-F198 HydrophobicContact CG-CD2 4.34Å; F194-F198 PolarHBondContact O-N 3.16Å
195	L	45.2	Very low	53.2	Low	76 Å²	76	33.7 Å²	33.7	40%	0.398	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-27.1	-175.4	-83	156.7	0	0	0	115.2	R75 R191 S192	R75-L195 HydrophobicContact CG-CD1 3.91Å; R191-L195 PolarHBondContact O-N 3.13Å; S192-L195 WeakPolarHBondContact O-CD1 3.31Å; S192-L195 WeakPolarHBondContact O-CG 3.39Å
196	D	43.6	Very low	53.5	Low	125 Å²	125	36.8 Å²	36.8	67%	0.668	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-28.6	-178.9	-67.9	-18.8	0	0	0	113.1	F194	F194-D196 PolarHBondContact O-N 3.41Å
197	F	42.4	Very low	54	Low	99 Å²	99	36.8 Å²	36.8	43%	0.434	18%	0.184	S	C	.	.			trans	-161	83	177.7	-69.5	-76.6	0	0	0	109	A124 F162 F194 L199	A124-F197 HydrophobicContact CB-CE1 4.38Å; F162-F197 HydrophobicContact CD1-CB 4.17Å; F162-F197 HydrophobicContact CD1-CD1 4.26Å; F162-F197 HydrophobicContact CD1-CG 4.08Å; F162-F197 HydrophobicContact CE1-CB 3.99Å; F162-F197 AromaticContact CE1-CD1 3.45Å; F162-F197 HydrophobicContact CE1-CD1 3.45Å; F162-F197 VanDerWaalsContact CE1-CD1 3.45Å; F162-F197 HydrophobicContact CE1-CE1 4.04Å; F162-F197 AromaticContact CE1-CG 3.71Å; F162-F197 HydrophobicContact CE1-CG 3.71Å; F162-F197 HydrophobicContact CZ-CD1 4.28Å; F194-F197 CarbonylContact O-C 3.54Å; F194-F197 PolarHBondContact O-N 3.23Å; F197-L199 PolarHBondContact O-N 2.97Å
198	F	40.8	Very low	54.5	Low	23 Å²	23	36.7 Å²	36.7	10%	0.101	19%	0.185	C	C	.	.			trans	-78.8	76.6	171	-176.2	-103.4	0	0	0	108.4	M190 F194 A200 V244 L245	M190-F198 HydrophobicContact CB-CE2 3.82Å; M190-F198 HydrophobicContact CB-CZ 4.17Å; M190-F198 WeakPolarHBondContact O-CD2 3.2Å; M190-F198 WeakPolarHBondContact O-CE2 3.11Å; F194-F198 HydrophobicContact CB-CB 4.31Å; F194-F198 HydrophobicContact CB-CD2 4.02Å; F194-F198 AromaticContact CD2-CD2 3.75Å; F194-F198 HydrophobicContact CD2-CD2 3.75Å; F194-F198 AromaticContact CD2-CE2 3.98Å; F194-F198 HydrophobicContact CD2-CE2 3.98Å; F194-F198 HydrophobicContact CG-CD2 4.34Å; F194-F198 PolarHBondContact O-N 3.16Å; F198-A200 VanDerWaalsContact C-N 3.28Å; F198-A200 HydrophobicContact CD1-CB 3.95Å; F198-A200 HydrophobicContact CE1-CB 3.33Å; F198-A200 HydrophobicContact CE2-CB 4.45Å; F198-A200 HydrophobicContact CZ-CB 3.63Å; F198-A200 PolarHBondContact O-N 3.28Å; F198-A200 VanDerWaalsContact O-N 3.1Å; F198-V244 HydrophobicContact CB-CG2 3.82Å; F198-V244 HydrophobicContact CD1-CB 4.06Å; F198-V244 HydrophobicContact CD1-CG1 3.43Å; F198-V244 VanDerWaalsContact CD1-CG1 3.43Å; F198-V244 HydrophobicContact CD1-CG2 3.68Å; F198-V244 HydrophobicContact CE1-CG1 4.03Å; F198-V244 HydrophobicContact CG-CG1 4.48Å; F198-V244 HydrophobicContact CG-CG2 4.21Å; F198-V244 VanDerWaalsContact O-CA 3.23Å; F198-V244 WeakPolarHBondContact O-CA 2.94Å; F198-V244 WeakPolarHBondContact O-CB 3.29Å; F198-V244 VanDerWaalsContact O-CG1 3.27Å; F198-V244 WeakPolarHBondContact O-CG1 3.28Å; F198-L245 PolarHBondContact O-N 3.45Å
199	L	42.2	Very low	54.9	Low	11 Å²	11	36.2 Å²	36.2	6%	0.058	19%	0.187	C	C	.	.			trans	-78.6	87.3	161.7	-175.9	89.1	0	0	0	107.7	M158 F162 F197 R201 L245	M158-L199 HydrophobicContact CB-CD2 4.36Å; M158-L199 HydrophobicContact CE-CD1 3.47Å; M158-L199 VanDerWaalsContact CE-CD1 3.47Å; M158-L199 HydrophobicContact CE-CD2 3.49Å; M158-L199 VanDerWaalsContact CE-CD2 3.49Å; M158-L199 HydrophobicContact CE-CG 4.02Å; M158-L199 HydrophobicContact CG-CD2 3.56Å; M158-L199 HydrophobicContact SD-CD1 3.95Å; M158-L199 HydrophobicContact SD-CD2 3.11Å; M158-L199 WeakPolarHBondContact SD-CD2 3.42Å; M158-L199 HydrophobicContact SD-CG 4.12Å; F162-L199 HydrophobicContact CD2-CD2 4.02Å; F162-L199 HydrophobicContact CE2-CB 4.4Å; F162-L199 HydrophobicContact CE2-CD1 4.17Å; F162-L199 HydrophobicContact CE2-CD2 4.11Å; F162-L199 HydrophobicContact CE2-CG 4.45Å; F197-L199 PolarHBondContact O-N 2.97Å; L199-R201 HydrophobicContact CD2-CB 4.23Å; L199-R201 PolarHBondContact O-N 3.49Å; L199-L245 HydrophobicContact CD1-CB 3.78Å; L199-L245 HydrophobicContact CD1-CD2 3.72Å; L199-L245 HydrophobicContact CD1-CG 3.84Å
200	A	47	Very low	55.4	Low	3 Å²	3	36.9 Å²	36.9	3%	0.025	19%	0.19	C	C	.	.			trans	-67.5	82.5	163.6	0	0	0	0	0	108.7	F169 F198 L202 L245 V246 I247	F169-A200 HydrophobicContact CE2-CB 3.98Å; F198-A200 VanDerWaalsContact C-N 3.28Å; F198-A200 HydrophobicContact CD1-CB 3.95Å; F198-A200 HydrophobicContact CE1-CB 3.33Å; F198-A200 HydrophobicContact CE2-CB 4.45Å; F198-A200 HydrophobicContact CZ-CB 3.63Å; F198-A200 PolarHBondContact O-N 3.28Å; F198-A200 VanDerWaalsContact O-N 3.1Å; A200-L202 VanDerWaalsContact C-N 3.26Å; A200-L202 PolarHBondContact O-N 3.35Å; A200-L245 PolarHBondContact N-O 3.29Å; A200-V246 HydrophobicContact CB-CG2 4.33Å; A200-V246 WeakPolarHBondContact O-CA 3.18Å; A200-I247 PolarHBondContact O-N 3.43Å
201	R	48.7	Very low	56.1	Low	1 Å²	1	37.1 Å²	37.1	0%	0.004	19%	0.192	C	C	.	.			trans	-67.2	92.8	165.3	179.2	57	174.2	141.6	0.5	107.4	K150 V154 Y167 L199 L203 I247	K150-R201 PolarHBondContact O-NH2 2.86Å; V154-R201 VanDerWaalsContact CG1-CD 3.43Å; V154-R201 HydrophobicContact CG1-CG 4.41Å; V154-R201 VanDerWaalsContact CG1-CZ 3.41Å; Y167-R201 CarbonylContact C-O 3.54Å; Y167-R201 CarbonylContact O-C 3.6Å; Y167-R201 WeakPolarHBondContact O-CB 3.15Å; L199-R201 HydrophobicContact CD2-CB 4.23Å; L199-R201 PolarHBondContact O-N 3.49Å; R201-L203 HydrophobicContact CG-CB 4.19Å; R201-L203 HydrophobicContact CG-CD1 3.38Å; R201-L203 HydrophobicContact CG-CG 3.46Å; R201-L203 VanDerWaalsContact CG-CG 3.46Å; R201-L203 VanDerWaalsContact CZ-CG 3.47Å; R201-L203 PolarHBondContact O-N 3.09Å; R201-I247 VanDerWaalsContact NH1-CB 3.29Å; R201-I247 PolarHBondContact NH1-O 3.34Å
202	L	49.3	Very low	56.8	Low	5 Å²	5	40.5 Å²	40.5	3%	0.026	20%	0.204	C	C	.	.			trans	-76.1	66	167.5	-147.7	138.6	0	0	0	109.3	F169 A200 S204 I207 F229 V246 I247	F169-L202 HydrophobicContact CB-CD1 4.02Å; F169-L202 HydrophobicContact CB-CD2 4.37Å; F169-L202 HydrophobicContact CB-CG 3.76Å; F169-L202 HydrophobicContact CD1-CD1 4.03Å; F169-L202 HydrophobicContact CD2-CB 3.74Å; F169-L202 HydrophobicContact CD2-CD1 3.25Å; F169-L202 HydrophobicContact CD2-CG 3.29Å; F169-L202 HydrophobicContact CE1-CD1 4.3Å; F169-L202 HydrophobicContact CE2-CB 4.19Å; F169-L202 HydrophobicContact CE2-CD1 3.55Å; F169-L202 HydrophobicContact CE2-CG 3.98Å; F169-L202 HydrophobicContact CG-CD1 3.5Å; F169-L202 VanDerWaalsContact CG-CD1 3.5Å; F169-L202 HydrophobicContact CG-CG 3.66Å; F169-L202 HydrophobicContact CZ-CD1 4.07Å; A200-L202 VanDerWaalsContact C-N 3.26Å; A200-L202 PolarHBondContact O-N 3.35Å; L202-S204 PolarHBondContact O-N 2.83Å; L202-I207 HydrophobicContact CD2-CB 4.42Å; L202-I207 HydrophobicContact CD2-CG2 3.45Å; L202-I207 VanDerWaalsContact CD2-CG2 3.45Å; L202-F229 HydrophobicContact CD1-CD2 4.02Å; L202-F229 HydrophobicContact CD1-CE2 3.23Å; L202-F229 HydrophobicContact CD1-CZ 3.75Å; L202-V246 HydrophobicContact CB-CG1 4.46Å; L202-I247 CarbonylContact C-O 3.58Å; L202-I247 VanDerWaalsContact C-O 3.22Å; L202-I247 PolarHBondContact N-O 3.44Å
203	L	50.3	Low	57.6	Low	11 Å²	11	45.2 Å²	45.2	6%	0.058	23%	0.225	C	C	.	.			trans	-69.6	69.2	158.1	-82.1	162.3	0	0	0	107.9	T151 R155 S168 R201	T151-L203 HydrophobicContact CG2-CD2 3.6Å; T151-L203 VanDerWaalsContact OG1-CD2 3.29Å; T151-L203 WeakPolarHBondContact OG1-CD2 3.3Å; R155-L203 HydrophobicContact CG-CD1 4.15Å; S168-L203 PolarHBondContact OG-O 2.9Å; R201-L203 HydrophobicContact CG-CB 4.19Å; R201-L203 HydrophobicContact CG-CD1 3.38Å; R201-L203 HydrophobicContact CG-CG 3.46Å; R201-L203 VanDerWaalsContact CG-CG 3.46Å; R201-L203 VanDerWaalsContact CZ-CG 3.47Å; R201-L203 PolarHBondContact O-N 3.09Å
204	S	48.6	Very low	58.2	Low	12 Å²	12	49.8 Å²	49.8	8%	0.084	24%	0.238	C	C	.	.			trans	-88	114.3	139.4	-154.2	0	0	0	0	104.1	L202 E206	L202-S204 PolarHBondContact O-N 2.83Å; S204-E206 PolarHBondContact O-N 3.27Å
205	D	59	Low	59.1	Low	85 Å²	85	50.8 Å²	50.8	46%	0.455	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-54.9	122.9	141.4	-79	-39.7	0	0	0	103.2	T151	T151-D205 PolarHBondContact OG1-OD1 3.1Å; T151-D205 PolarHBondContact OG1-OD2 2.94Å
206	E	66.3	Low	60.1	Low	106 Å²	106	55 Å²	55	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	49.4	-175.6	-46.6	168.6	178.4	0	0	115.9	S204 D208 S209	S204-E206 PolarHBondContact O-N 3.27Å; E206-D208 VanDerWaalsContact C-OD1 3.25Å; E206-D208 WeakPolarHBondContact CA-OD1 3.48Å; E206-D208 PolarHBondContact O-N 3.44Å; E206-D208 VanDerWaalsContact O-N 3.13Å; E206-S209 VanDerWaalsContact O-CB 3.31Å; E206-S209 WeakPolarHBondContact O-CB 3.17Å; E206-S209 PolarHBondContact O-N 3.34Å; E206-S209 PolarHBondContact O-OG 3.46Å
207	I	72.9	Confident	61.5	Low	2 Å²	2	54 Å²	54	1%	0.01	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.8	168.5	62.5	162.7	0	0	0	112.6	L141 L202 S209 I210 L211 A249 L256 L264	L141-I207 HydrophobicContact CD1-CD1 3.44Å; L141-I207 VanDerWaalsContact CD1-CD1 3.44Å; L202-I207 HydrophobicContact CD2-CB 4.42Å; L202-I207 HydrophobicContact CD2-CG2 3.45Å; L202-I207 VanDerWaalsContact CD2-CG2 3.45Å; I207-S209 PolarHBondContact O-N 3.38Å; I207-I210 PolarHBondContact O-N 2.99Å; I207-L211 WeakPolarHBondContact O-CB 3.33Å; I207-L211 PolarHBondContact O-N 2.92Å; I207-A249 PolarHBondContact N-O 3.08Å; I207-L256 HydrophobicContact CD1-CD1 3.88Å; I207-L256 HydrophobicContact CD1-CD2 4.02Å; I207-L256 HydrophobicContact CG1-CD1 4.46Å; I207-L256 HydrophobicContact CG1-CD2 4.02Å; I207-L264 HydrophobicContact CD1-CD1 4.36Å
208	D	73.2	Confident	62.9	Low	10 Å²	10	50.6 Å²	50.6	5%	0.053	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-30.6	172.6	54.9	-54	0	0	0	111.9	E206 I210 R212 T250 D255 L256	E206-D208 VanDerWaalsContact C-OD1 3.25Å; E206-D208 WeakPolarHBondContact CA-OD1 3.48Å; E206-D208 PolarHBondContact O-N 3.44Å; E206-D208 VanDerWaalsContact O-N 3.13Å; D208-I210 PolarHBondContact O-N 3.3Å; D208-I210 VanDerWaalsContact O-N 3.11Å; D208-R212 HydrophobicContact CB-CG 4.42Å; D208-R212 WeakPolarHBondContact O-CB 3.25Å; D208-R212 WeakPolarHBondContact O-CD 3.5Å; D208-R212 WeakPolarHBondContact O-CG 3.3Å; D208-R212 PolarHBondContact O-N 2.86Å; D208-T250 PolarHBondContact OD1-OG1 2.8Å; D208-D255 HydrophobicContact CB-CB 4.16Å; D208-L256 HydrophobicContact CB-CD2 4.16Å
209	S	71	Confident	64.5	Low	58 Å²	58	57 Å²	57	41%	0.406	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-27.1	176	68.7	0	0	0	0	113.6	E206 I207	E206-S209 VanDerWaalsContact O-CB 3.31Å; E206-S209 WeakPolarHBondContact O-CB 3.17Å; E206-S209 PolarHBondContact O-N 3.34Å; E206-S209 PolarHBondContact O-OG 3.46Å; I207-S209 PolarHBondContact O-N 3.38Å
210	I	70.7	Confident	66.1	Low	13 Å²	13	62.5 Å²	62.5	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-109.3	-35.7	-176.3	-59.1	125.4	0	0	0	111.6	L174 I207 D208 L225 K226	L174-I210 HydrophobicContact CD1-CD1 3.16Å; L174-I210 HydrophobicContact CD1-CG1 3.71Å; I207-I210 PolarHBondContact O-N 2.99Å; D208-I210 PolarHBondContact O-N 3.3Å; D208-I210 VanDerWaalsContact O-N 3.11Å; I210-L225 HydrophobicContact CG2-CD2 3.57Å; I210-L225 HydrophobicContact CG2-CG 4.11Å; I210-K226 WeakPolarHBondContact O-CE 3.43Å; I210-K226 WeakPolarHBondContact O-CG 3.44Å
211	L	76.5	Confident	67.3	Low	5 Å²	5	65.4 Å²	65.4	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-110.6	24.2	-169	-61.9	-178.8	0	0	0	112.5	I207 K226 F229 L256 D257 V260	I207-L211 WeakPolarHBondContact O-CB 3.33Å; I207-L211 PolarHBondContact O-N 2.92Å; L211-K226 HydrophobicContact CD2-CG 4.17Å; L211-F229 HydrophobicContact CD1-CD1 3.92Å; L211-F229 HydrophobicContact CD1-CE1 3.61Å; L211-F229 HydrophobicContact CD1-CZ 4.31Å; L211-F229 HydrophobicContact CD2-CD1 3.68Å; L211-F229 HydrophobicContact CD2-CE1 4.26Å; L211-F229 HydrophobicContact CD2-CG 4.26Å; L211-F229 HydrophobicContact CG-CD1 4.47Å; L211-L256 HydrophobicContact CB-CD2 4.03Å; L211-D257 PolarHBondContact O-N 2.9Å; L211-V260 HydrophobicContact CB-CG1 4.22Å; L211-V260 HydrophobicContact CB-CG2 3.89Å; L211-V260 HydrophobicContact CD1-CG1 3.73Å; L211-V260 HydrophobicContact CD1-CG2 4.27Å; L211-V260 HydrophobicContact CD2-CG2 4.16Å; L211-V260 HydrophobicContact CG-CG2 4.32Å
212	R	76	Confident	68.4	Low	101 Å²	101	66.8 Å²	66.8	38%	0.381	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-60	160.5	176.7	-110.5	160.1	177	-146.2	-12.8	113.2	D208 K226 D255	D208-R212 HydrophobicContact CB-CG 4.42Å; D208-R212 WeakPolarHBondContact O-CB 3.25Å; D208-R212 WeakPolarHBondContact O-CD 3.5Å; D208-R212 WeakPolarHBondContact O-CG 3.3Å; D208-R212 PolarHBondContact O-N 2.86Å; R212-K226 VanDerWaalsContact O-CE 3.22Å; R212-K226 WeakPolarHBondContact O-CE 3.44Å; R212-K226 PolarHBondContact O-NZ 3.18Å; R212-D255 CarbonylContact C-O 3.43Å; R212-D255 WeakPolarHBondContact CA-O 3.32Å; R212-D255 HydrophobicContact CG-CB 3.9Å; R212-D255 WeakPolarHBondContact CG-O 3.41Å; R212-D255 IonicContact CZ-OD2 2.73Å; R212-D255 IonicContact NE-OD2 3.83Å; R212-D255 PolarHBondContact NE-OD2 2.82Å; R212-D255 IonicContact NH2-OD2 3.94Å; R212-D255 PolarHBondContact NH2-OD2 2.94Å
213	E	74.6	Confident	69.6	Low	116 Å²	116	70.9 Å²	70.9	54%	0.542	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-54.1	146.8	165.9	-71.5	-171.9	163	0	0	111.2	S215 D255	E213-S215 PolarHBondContact O-N 2.75Å; E213-D255 PolarHBondContact N-O 3.4Å
214	R	69.6	Low	70.7	Confident	150 Å²	150	77.9 Å²	77.9	57%	0.566	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-71.1	119.1	-179.5	-65.4	177.8	-178.2	-171	-4.2	109.2
215	S	72.7	Confident	71.9	Confident	54 Å²	54	77.9 Å²	77.9	38%	0.378	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-99.4	152.6	165.2	68.3	0	0	0	0	110.4	E213 S217 E218 R223	E213-S215 PolarHBondContact O-N 2.75Å; S215-S217 PolarHBondContact O-N 3.41Å; S215-S217 PolarHBondContact OG-OG 3.28Å; S215-E218 VanDerWaalsContact O-CB 3.29Å; S215-E218 WeakPolarHBondContact O-CB 3.43Å; S215-E218 PolarHBondContact O-N 2.87Å; S215-E218 PolarHBondContact OG-N 3.28Å; S215-R223 PolarHBondContact O-NH2 2.8Å
216	D	67.1	Low	72.7	Confident	165 Å²	165	74.1 Å²	74.1	88%	0.882	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.5	175.5	-71.4	-30.3	0	0	0	112.4	E218 R223	D216-E218 VanDerWaalsContact C-N 3.34Å; D216-R223 PolarHBondContact O-NH2 2.81Å
217	S	72.8	Confident	73.3	Confident	103 Å²	103	72 Å²	72	72%	0.72	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-0.7	176.7	57.9	0	0	0	0	115.2	S215 H219	S215-S217 PolarHBondContact O-N 3.41Å; S215-S217 PolarHBondContact OG-OG 3.28Å; S217-H219 PolarHBondContact O-N 2.87Å
218	E	71.7	Confident	73.3	Confident	28 Å²	28	73.1 Å²	73.1	13%	0.131	36%	0.362	C	S	.	.			trans	-70.8	128	-175.2	-172.1	178.5	-172.9	0	0	112.3	S215 D216 E220 S222 R223 K226	S215-E218 VanDerWaalsContact O-CB 3.29Å; S215-E218 WeakPolarHBondContact O-CB 3.43Å; S215-E218 PolarHBondContact O-N 2.87Å; S215-E218 PolarHBondContact OG-N 3.28Å; D216-E218 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 3.06Å; E218-S222 WeakPolarHBondContact OE1-CB 3.36Å; E218-S222 PolarHBondContact OE1-OG 2.99Å; E218-R223 HydrophobicContact CB-CG 4.35Å; E218-R223 HydrophobicContact CG-CG 4.04Å; E218-K226 WeakPolarHBondContact OE1-CE 3.28Å; E218-K226 IonicContact OE1-NZ 2.85Å; E218-K226 PolarHBondContact OE1-NZ 2.64Å; E218-K226 IonicContact OE2-NZ 2.73Å; E218-K226 PolarHBondContact OE2-NZ 3.19Å
219	H	75.2	Confident	73.3	Confident	157 Å²	157	73.5 Å²	73.5	73%	0.727	36%	0.363	S	S	*	.			trans	-56.5	136.4	174.3	-67.4	-60	0	0	0	112	S217 V221 S222 R223	S217-H219 PolarHBondContact O-N 2.87Å; H219-V221 PolarHBondContact O-N 3.4Å; H219-S222 WeakPolarHBondContact O-CB 3.34Å; H219-S222 PolarHBondContact O-N 3.48Å; H219-R223 PolarHBondContact O-N 2.73Å
220	E	76	Confident	73.6	Confident	128 Å²	128	71.5 Å²	71.5	60%	0.598	35%	0.347	S	S	*	.	H	α-helix	trans	-51.2	-35.2	179.8	-72.7	-163.9	-178.4	0	0	113.7	E218 S222 R223 R224	E218-E220 PolarHBondContact O-N 3.06Å; E220-S222 VanDerWaalsContact C-N 3.29Å; E220-S222 PolarHBondContact O-N 3.02Å; E220-R223 PolarHBondContact O-N 2.96Å; E220-R224 WeakPolarHBondContact O-CG 3.38Å; E220-R224 PolarHBondContact O-N 3.36Å; E220-R224 IonicContact OE2-CZ 2.93Å; E220-R224 IonicContact OE2-NE 3.78Å; E220-R224 IonicContact OE2-NH2 3.3Å; E220-R224 PolarHBondContact OE2-NH2 3Å
221	V	71.4	Confident	73.9	Confident	63 Å²	63	75.5 Å²	75.5	38%	0.382	37%	0.369	S	S	.	.	H	α-helix	trans	-58.9	-41.7	178.8	179.3	0	0	0	0	111.3	A178 H219 L225	A178-V221 HydrophobicContact CB-CG1 3.46Å; A178-V221 VanDerWaalsContact CB-CG1 3.46Å; H219-V221 PolarHBondContact O-N 3.4Å; V221-L225 WeakPolarHBondContact O-CB 3.27Å; V221-L225 PolarHBondContact O-N 3.08Å
222	S	71.1	Confident	73.6	Confident	30 Å²	30	77 Å²	77	21%	0.21	38%	0.376	C	S	.	.	H	α-helix	trans	-70.2	-42.3	178.6	-175.1	0	0	0	0	111	E218 H219 E220 R224 L225 K226	E218-S222 WeakPolarHBondContact OE1-CB 3.36Å; E218-S222 PolarHBondContact OE1-OG 2.99Å; H219-S222 WeakPolarHBondContact O-CB 3.34Å; H219-S222 PolarHBondContact O-N 3.48Å; E220-S222 VanDerWaalsContact C-N 3.29Å; E220-S222 PolarHBondContact O-N 3.02Å; S222-R224 PolarHBondContact O-N 2.93Å; S222-L225 PolarHBondContact O-N 3.14Å; S222-K226 WeakPolarHBondContact O-CG 3.43Å; S222-K226 PolarHBondContact O-N 2.95Å
223	R	74.7	Confident	73.4	Confident	91 Å²	91	72.7 Å²	72.7	34%	0.343	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-44.1	174.9	-66.8	-176.3	179	177.9	1.5	112.6	S215 D216 E218 H219 E220 K226 T227	S215-R223 PolarHBondContact O-NH2 2.8Å; D216-R223 PolarHBondContact O-NH2 2.81Å; E218-R223 HydrophobicContact CB-CG 4.35Å; E218-R223 HydrophobicContact CG-CG 4.04Å; H219-R223 PolarHBondContact O-N 2.73Å; E220-R223 PolarHBondContact O-N 2.96Å; R223-K226 PolarHBondContact O-N 3.12Å; R223-T227 PolarHBondContact O-N 3.28Å; R223-T227 PolarHBondContact O-OG1 3.4Å; R223-T227 VanDerWaalsContact O-OG1 3.07Å
224	R	74.5	Confident	73.3	Confident	159 Å²	159	70.9 Å²	70.9	60%	0.6	35%	0.353	S	S	*	.	H	α-helix	trans	-63.1	-43.6	176.5	-71.1	179.8	-165.2	-166.6	6.5	111.3	E220 S222 T227 E228	E220-R224 WeakPolarHBondContact O-CG 3.38Å; E220-R224 PolarHBondContact O-N 3.36Å; E220-R224 IonicContact OE2-CZ 2.93Å; E220-R224 IonicContact OE2-NE 3.78Å; E220-R224 IonicContact OE2-NH2 3.3Å; E220-R224 PolarHBondContact OE2-NH2 3Å; S222-R224 PolarHBondContact O-N 2.93Å; R224-T227 PolarHBondContact O-N 2.92Å; R224-E228 WeakPolarHBondContact O-CB 3.44Å; R224-E228 PolarHBondContact O-N 3.4Å
225	L	73.3	Confident	73	Confident	12 Å²	12	65.4 Å²	65.4	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-44	177.3	-177.9	64	0	0	0	112.4	L174 I177 A178 I210 V221 S222 E228 F229	L174-L225 HydrophobicContact CB-CD2 3.86Å; L174-L225 HydrophobicContact CD2-CD1 4.11Å; L174-L225 HydrophobicContact CD2-CD2 4.21Å; I177-L225 HydrophobicContact CB-CD1 4.25Å; I177-L225 HydrophobicContact CG2-CD1 3.87Å; A178-L225 HydrophobicContact CB-CB 3.86Å; A178-L225 HydrophobicContact CB-CD1 4.1Å; A178-L225 HydrophobicContact CB-CD2 4.26Å; A178-L225 HydrophobicContact CB-CG 4.29Å; I210-L225 HydrophobicContact CG2-CD2 3.57Å; I210-L225 HydrophobicContact CG2-CG 4.11Å; V221-L225 WeakPolarHBondContact O-CB 3.27Å; V221-L225 PolarHBondContact O-N 3.08Å; S222-L225 PolarHBondContact O-N 3.14Å; L225-E228 PolarHBondContact O-N 3.47Å; L225-F229 VanDerWaalsContact O-CB 3.26Å; L225-F229 WeakPolarHBondContact O-CB 3.37Å; L225-F229 PolarHBondContact O-N 3.08Å
226	K	75.4	Confident	72.4	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-58.5	-52	175	-74.6	176.8	-175.9	173.8	0	111.2	I210 L211 R212 E218 S222 R223 E228 F229 L230	I210-K226 WeakPolarHBondContact O-CE 3.43Å; I210-K226 WeakPolarHBondContact O-CG 3.44Å; L211-K226 HydrophobicContact CD2-CG 4.17Å; R212-K226 VanDerWaalsContact O-CE 3.22Å; R212-K226 WeakPolarHBondContact O-CE 3.44Å; R212-K226 PolarHBondContact O-NZ 3.18Å; E218-K226 WeakPolarHBondContact OE1-CE 3.28Å; E218-K226 IonicContact OE1-NZ 2.85Å; E218-K226 PolarHBondContact OE1-NZ 2.64Å; E218-K226 IonicContact OE2-NZ 2.73Å; E218-K226 PolarHBondContact OE2-NZ 3.19Å; S222-K226 WeakPolarHBondContact O-CG 3.43Å; S222-K226 PolarHBondContact O-N 2.95Å; R223-K226 PolarHBondContact O-N 3.12Å; K226-E228 VanDerWaalsContact C-N 3.32Å; K226-E228 PolarHBondContact O-N 2.78Å; K226-F229 PolarHBondContact O-N 3.05Å; K226-L230 VanDerWaalsContact O-CG 3.25Å; K226-L230 WeakPolarHBondContact O-CG 3.41Å; K226-L230 PolarHBondContact O-N 3.46Å
227	T	78.1	Confident	71.7	Confident	60 Å²	60	59 Å²	59	37%	0.368	31%	0.305	S	S	.	.	H	α-helix	trans	-58.9	-46.2	180	-60.4	0	0	0	0	110.8	R223 R224 L230 L231	R223-T227 PolarHBondContact O-N 3.28Å; R223-T227 PolarHBondContact O-OG1 3.4Å; R223-T227 VanDerWaalsContact O-OG1 3.07Å; R224-T227 PolarHBondContact O-N 2.92Å; T227-L230 PolarHBondContact O-N 3.31Å; T227-L231 HydrophobicContact CG2-CD1 4.02Å; T227-L231 HydrophobicContact CG2-CG 4.44Å; T227-L231 VanDerWaalsContact O-CG 3.3Å; T227-L231 WeakPolarHBondContact O-CG 3.26Å; T227-L231 PolarHBondContact O-N 2.9Å
228	E	73.3	Confident	71	Confident	27 Å²	27	58.4 Å²	58.4	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-44.9	178.6	-168.7	63.9	-145.4	0	0	111.8	P183 S184 F187 R224 L225 K226 L230 L231 Q232	P183-E228 HydrophobicContact CB-CB 4.41Å; P183-E228 HydrophobicContact CB-CG 3.81Å; P183-E228 HydrophobicContact CG-CB 4.17Å; P183-E228 HydrophobicContact CG-CG 3.73Å; S184-E228 WeakPolarHBondContact CA-OE1 3.42Å; S184-E228 WeakPolarHBondContact CB-OE1 3.26Å; S184-E228 PolarHBondContact N-OE1 3.02Å; F187-E228 HydrophobicContact CD2-CG 3.78Å; F187-E228 HydrophobicContact CE2-CB 4.34Å; F187-E228 HydrophobicContact CE2-CG 3.74Å; R224-E228 WeakPolarHBondContact O-CB 3.44Å; R224-E228 PolarHBondContact O-N 3.4Å; L225-E228 PolarHBondContact O-N 3.47Å; K226-E228 VanDerWaalsContact C-N 3.32Å; K226-E228 PolarHBondContact O-N 2.78Å; E228-L230 VanDerWaalsContact C-N 3.27Å; E228-L230 PolarHBondContact O-N 3.11Å; E228-L231 PolarHBondContact O-N 2.78Å; E228-Q232 HydrophobicContact CG-CG 4.19Å; E228-Q232 WeakPolarHBondContact O-CB 3.47Å; E228-Q232 WeakPolarHBondContact O-CG 3.5Å; E228-Q232 PolarHBondContact O-N 2.74Å; E228-Q232 WeakPolarHBondContact OE1-CG 2.79Å; E228-Q232 PolarHBondContact OE1-NE2 2.99Å
229	F	74	Confident	70.4	Confident	17 Å²	17	63.4 Å²	63.4	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-43.6	177.1	178.1	-99.3	0	0	0	111.7	F187 L202 L211 L225 K226 Q232 F233 V246	F187-F229 HydrophobicContact CE1-CD2 4.12Å; F187-F229 HydrophobicContact CZ-CB 4.38Å; F187-F229 HydrophobicContact CZ-CD2 4.13Å; L202-F229 HydrophobicContact CD1-CD2 4.02Å; L202-F229 HydrophobicContact CD1-CE2 3.23Å; L202-F229 HydrophobicContact CD1-CZ 3.75Å; L211-F229 HydrophobicContact CD1-CD1 3.92Å; L211-F229 HydrophobicContact CD1-CE1 3.61Å; L211-F229 HydrophobicContact CD1-CZ 4.31Å; L211-F229 HydrophobicContact CD2-CD1 3.68Å; L211-F229 HydrophobicContact CD2-CE1 4.26Å; L211-F229 HydrophobicContact CD2-CG 4.26Å; L211-F229 HydrophobicContact CG-CD1 4.47Å; L225-F229 VanDerWaalsContact O-CB 3.26Å; L225-F229 WeakPolarHBondContact O-CB 3.37Å; L225-F229 PolarHBondContact O-N 3.08Å; K226-F229 PolarHBondContact O-N 3.05Å; F229-Q232 PolarHBondContact O-N 3.21Å; F229-F233 HydrophobicContact CE1-CD2 4.44Å; F229-F233 HydrophobicContact CZ-CD2 4.39Å; F229-F233 WeakPolarHBondContact O-CB 3.15Å; F229-F233 PolarHBondContact O-N 2.8Å; F229-V246 HydrophobicContact CZ-CG1 4.12Å
230	L	77.4	Confident	69.4	Low	16 Å²	16	61.4 Å²	61.4	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-68	-41.4	178.4	-66.9	172.4	0	0	0	112.6	K226 T227 E228 Q232 F233 D234 A259 V260 R263	K226-L230 VanDerWaalsContact O-CG 3.25Å; K226-L230 WeakPolarHBondContact O-CG 3.41Å; K226-L230 PolarHBondContact O-N 3.46Å; T227-L230 PolarHBondContact O-N 3.31Å; E228-L230 VanDerWaalsContact C-N 3.27Å; E228-L230 PolarHBondContact O-N 3.11Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 3Å; L230-F233 WeakPolarHBondContact O-CB 3.44Å; L230-F233 PolarHBondContact O-N 3.44Å; L230-D234 PolarHBondContact O-N 3.3Å; L230-A259 HydrophobicContact CD1-CB 4.11Å; L230-V260 HydrophobicContact CD2-CG2 3.82Å; L230-R263 VanDerWaalsContact CD2-CD 3.49Å
231	L	75.7	Confident	68.4	Low	98 Å²	98	59.1 Å²	59.1	51%	0.513	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-41.3	175.1	-74.6	171.2	0	0	0	111.4	T227 E228 D234 G235	T227-L231 HydrophobicContact CG2-CD1 4.02Å; T227-L231 HydrophobicContact CG2-CG 4.44Å; T227-L231 VanDerWaalsContact O-CG 3.3Å; T227-L231 WeakPolarHBondContact O-CG 3.26Å; T227-L231 PolarHBondContact O-N 2.9Å; E228-L231 PolarHBondContact O-N 2.78Å; L231-D234 PolarHBondContact O-N 3.37Å; L231-G235 PolarHBondContact O-N 2.76Å
232	Q	70.1	Confident	67.8	Low	37 Å²	37	57.1 Å²	57.1	17%	0.173	32%	0.319	C	S	.	.	H	α-helix	trans	-73.3	-34.5	180	-64.6	-68.2	-26.9	0	0	111.6	F187 E228 F229 L230 D234 G235 V236	F187-Q232 HydrophobicContact CB-CB 3.98Å; F187-Q232 HydrophobicContact CB-CG 3.42Å; F187-Q232 VanDerWaalsContact CB-CG 3.42Å; F187-Q232 HydrophobicContact CD1-CB 4.08Å; F187-Q232 HydrophobicContact CD1-CG 4.19Å; F187-Q232 HydrophobicContact CD2-CB 4.35Å; F187-Q232 HydrophobicContact CD2-CG 3.63Å; F187-Q232 HydrophobicContact CE2-CG 4.35Å; F187-Q232 HydrophobicContact CG-CB 3.92Å; F187-Q232 HydrophobicContact CG-CG 3.52Å; E228-Q232 HydrophobicContact CG-CG 4.19Å; E228-Q232 WeakPolarHBondContact O-CB 3.47Å; E228-Q232 WeakPolarHBondContact O-CG 3.5Å; E228-Q232 PolarHBondContact O-N 2.74Å; E228-Q232 WeakPolarHBondContact OE1-CG 2.79Å; E228-Q232 PolarHBondContact OE1-NE2 2.99Å; F229-Q232 PolarHBondContact O-N 3.21Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 3Å; Q232-D234 VanDerWaalsContact C-N 3.33Å; Q232-G235 PolarHBondContact O-N 3.13Å; Q232-V236 WeakPolarHBondContact O-CG2 3.5Å; Q232-V236 PolarHBondContact O-N 3.01Å
233	F	72.4	Confident	67.4	Low	10 Å²	10	59.7 Å²	59.7	4%	0.044	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-45.3	170.1	-165.3	-69.9	0	0	0	111.1	Q138 F229 L230 V236 V246 R263 L264	Q138-F233 HydrophobicContact CB-CE1 4.05Å; Q138-F233 HydrophobicContact CB-CZ 4.07Å; F229-F233 HydrophobicContact CE1-CD2 4.44Å; F229-F233 HydrophobicContact CZ-CD2 4.39Å; F229-F233 WeakPolarHBondContact O-CB 3.15Å; F229-F233 PolarHBondContact O-N 2.8Å; L230-F233 WeakPolarHBondContact O-CB 3.44Å; L230-F233 PolarHBondContact O-N 3.44Å; F233-V236 WeakPolarHBondContact O-CB 3.28Å; F233-V236 WeakPolarHBondContact O-CG2 3.19Å; F233-V236 PolarHBondContact O-N 2.69Å; F233-V246 HydrophobicContact CD2-CB 4.13Å; F233-V246 HydrophobicContact CD2-CG1 4.24Å; F233-V246 HydrophobicContact CD2-CG2 3.84Å; F233-V246 HydrophobicContact CE2-CB 3.54Å; F233-V246 HydrophobicContact CE2-CG1 3.87Å; F233-V246 HydrophobicContact CE2-CG2 3.67Å; F233-V246 HydrophobicContact CZ-CB 4.37Å; F233-R263 HydrophobicContact CD1-CB 3.64Å; F233-R263 HydrophobicContact CD1-CG 3.62Å; F233-R263 HydrophobicContact CD2-CB 4.24Å; F233-R263 HydrophobicContact CE1-CB 3.56Å; F233-R263 HydrophobicContact CE1-CG 3.92Å; F233-R263 WeakPolarHBondContact CE1-O 3.31Å; F233-R263 HydrophobicContact CE2-CB 4.1Å; F233-R263 HydrophobicContact CG-CB 4.05Å; F233-R263 HydrophobicContact CG-CG 4.18Å; F233-R263 HydrophobicContact CZ-CB 3.83Å; F233-R263 WeakPolarHBondContact CZ-O 3.37Å; F233-L264 HydrophobicContact CE2-CD2 4.08Å
234	D	72.1	Confident	67.1	Low	77 Å²	77	55.8 Å²	55.8	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-72.1	-37.3	179.4	-64.9	-19.2	0	0	0	112.2	L230 L231 Q232 V236 N237 R263	L230-D234 PolarHBondContact O-N 3.3Å; L231-D234 PolarHBondContact O-N 3.37Å; Q232-D234 VanDerWaalsContact C-N 3.33Å; D234-V236 PolarHBondContact O-N 3Å; D234-V236 VanDerWaalsContact O-N 3.08Å; D234-N237 PolarHBondContact O-N 3.46Å; D234-R263 IonicContact OD1-CZ 2.55Å; D234-R263 IonicContact OD1-NE 2.69Å; D234-R263 PolarHBondContact OD1-NE 3.06Å; D234-R263 IonicContact OD1-NH2 3.82Å; D234-R263 PolarHBondContact OD1-NH2 3.39Å; D234-R263 IonicContact OD2-CZ 3.31Å; D234-R263 IonicContact OD2-NE 3.41Å; D234-R263 PolarHBondContact OD2-NE 2.97Å; D234-R263 IonicContact OD2-NH2 3.89Å; D234-R263 PolarHBondContact OD2-NH2 3.32Å
235	G	65	Low	67.1	Low	35 Å²	35	49 Å²	49	36%	0.361	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-12.1	176	0	0	0	0	0	113.7	R191 L231 Q232 N237 S238	R191-G235 PolarHBondContact NH2-O 3.35Å; L231-G235 PolarHBondContact O-N 2.76Å; Q232-G235 PolarHBondContact O-N 3.13Å; G235-N237 PolarHBondContact O-N 2.88Å; G235-N237 VanDerWaalsContact O-N 3.08Å; G235-S238 PolarHBondContact O-N 3.47Å; G235-S238 PolarHBondContact O-OG 3.42Å
236	V	58.6	Low	67.2	Low	7 Å²	7	48.9 Å²	48.9	4%	0.042	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.7	176.6	158.6	0	0	0	0	113	Q138 R191 Q232 F233 D234 D242 V244	Q138-V236 HydrophobicContact CG-CG1 4.41Å; R191-V236 VanDerWaalsContact NH1-CA 3.31Å; R191-V236 PolarHBondContact NH1-O 3.34Å; R191-V236 PolarHBondContact NH2-O 2.92Å; Q232-V236 WeakPolarHBondContact O-CG2 3.5Å; Q232-V236 PolarHBondContact O-N 3.01Å; F233-V236 WeakPolarHBondContact O-CB 3.28Å; F233-V236 WeakPolarHBondContact O-CG2 3.19Å; F233-V236 PolarHBondContact O-N 2.69Å; D234-V236 PolarHBondContact O-N 3Å; D234-V236 VanDerWaalsContact O-N 3.08Å; V236-D242 VanDerWaalsContact O-CB 3.25Å; V236-D242 WeakPolarHBondContact O-CB 3.47Å; V236-V244 HydrophobicContact CB-CB 4.26Å; V236-V244 HydrophobicContact CB-CG2 4.41Å; V236-V244 HydrophobicContact CG1-CB 3.43Å; V236-V244 VanDerWaalsContact CG1-CB 3.43Å; V236-V244 HydrophobicContact CG1-CG1 4.14Å; V236-V244 HydrophobicContact CG1-CG2 3.77Å; V236-V244 HydrophobicContact CG2-CB 3.82Å; V236-V244 HydrophobicContact CG2-CG1 3.66Å; V236-V244 HydrophobicContact CG2-CG2 4.04Å
237	N	53.5	Low	67.4	Low	77 Å²	77	48.6 Å²	48.6	41%	0.412	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	17.5	-172	-56.1	-47.9	0	0	0	115	Q138 D234 G235 K239	Q138-N237 PolarHBondContact NE2-ND2 3.47Å; Q138-N237 PolarHBondContact NE2-OD1 3.15Å; Q138-N237 PolarHBondContact OE1-ND2 2.97Å; D234-N237 PolarHBondContact O-N 3.46Å; G235-N237 PolarHBondContact O-N 2.88Å; G235-N237 VanDerWaalsContact O-N 3.08Å; N237-K239 PolarHBondContact O-N 3.35Å
238	S	56.9	Low	67.5	Low	92 Å²	92	45.9 Å²	45.9	64%	0.643	27%	0.268	S	S	*	.	S	Bend	trans	-60.1	-21	178.8	59.1	0	0	0	0	113.1	R191 G235	R191-S238 PolarHBondContact NH2-OG 3.25Å; G235-S238 PolarHBondContact O-N 3.47Å; G235-S238 PolarHBondContact O-OG 3.42Å
239	K	59	Low	68.1	Low	133 Å²	133	44.6 Å²	44.6	58%	0.578	26%	0.262	S	S	*	.	S	Bend	trans	-134.7	141.3	176.1	-50	178	179	179.3	0	110.2	N237 S241 D242	N237-K239 PolarHBondContact O-N 3.35Å; K239-S241 PolarHBondContact O-N 2.77Å; K239-S241 VanDerWaalsContact O-N 3.1Å; K239-D242 VanDerWaalsContact CB-OD2 3.29Å; K239-D242 WeakPolarHBondContact CB-OD2 3.47Å; K239-D242 PolarHBondContact O-N 2.86Å
240	A	54.4	Low	68.8	Low	114 Å²	114	43.8 Å²	43.8	94%	0.942	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.2	176.5	0	0	0	0	0	113.7
241	S	55.1	Low	69.4	Low	81 Å²	81	44.5 Å²	44.5	57%	0.566	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-19.2	176.1	56.2	0	0	0	0	113.7	K239 R243	K239-S241 PolarHBondContact O-N 2.77Å; K239-S241 VanDerWaalsContact O-N 3.1Å; S241-R243 PolarHBondContact O-N 3.25Å; S241-R243 VanDerWaalsContact O-N 3.09Å
242	D	58.7	Low	70.1	Confident	21 Å²	21	45.2 Å²	45.2	11%	0.112	26%	0.258	C	S	.	.			trans	-83.2	95.3	-169.4	-69.6	-41.5	0	0	0	111.2	R191 V236 K239 V244	R191-D242 IonicContact CZ-OD1 3.39Å; R191-D242 IonicContact CZ-OD2 3.42Å; R191-D242 VanDerWaalsContact CZ-OD2 3.31Å; R191-D242 IonicContact NE-OD2 2.64Å; R191-D242 IonicContact NH2-OD1 3.48Å; R191-D242 IonicContact NH2-OD2 2.66Å; R191-D242 PolarHBondContact NH2-OD2 3.42Å; V236-D242 VanDerWaalsContact O-CB 3.25Å; V236-D242 WeakPolarHBondContact O-CB 3.47Å; K239-D242 VanDerWaalsContact CB-OD2 3.29Å; K239-D242 WeakPolarHBondContact CB-OD2 3.47Å; K239-D242 PolarHBondContact O-N 2.86Å; D242-V244 PolarHBondContact O-N 2.86Å
243	R	63.1	Low	71.1	Confident	83 Å²	83	43.5 Å²	43.5	31%	0.313	25%	0.25	S	S	.	.			trans	-92.4	73.1	179	-64.5	-178.2	-176.9	-125.5	-6.8	111.3	P123 P127 S241	P123-R243 PolarHBondContact O-NH1 3.48Å; P123-R243 VanDerWaalsContact O-NH1 3.08Å; P127-R243 PolarHBondContact O-NH2 3.18Å; S241-R243 PolarHBondContact O-N 3.25Å; S241-R243 VanDerWaalsContact O-N 3.09Å
244	V	68.3	Low	72	Confident	9 Å²	9	46.1 Å²	46.1	6%	0.055	26%	0.262	C	S	.	.			trans	-95.2	131.5	175	174.8	0	0	0	0	110.6	R191 F198 V236 D242 V246	R191-V244 VanDerWaalsContact NH1-CG2 3.27Å; F198-V244 HydrophobicContact CB-CG2 3.82Å; F198-V244 HydrophobicContact CD1-CB 4.06Å; F198-V244 HydrophobicContact CD1-CG1 3.43Å; F198-V244 VanDerWaalsContact CD1-CG1 3.43Å; F198-V244 HydrophobicContact CD1-CG2 3.68Å; F198-V244 HydrophobicContact CE1-CG1 4.03Å; F198-V244 HydrophobicContact CG-CG1 4.48Å; F198-V244 HydrophobicContact CG-CG2 4.21Å; F198-V244 VanDerWaalsContact O-CA 3.23Å; F198-V244 WeakPolarHBondContact O-CA 2.94Å; F198-V244 WeakPolarHBondContact O-CB 3.29Å; F198-V244 VanDerWaalsContact O-CG1 3.27Å; F198-V244 WeakPolarHBondContact O-CG1 3.28Å; V236-V244 HydrophobicContact CB-CB 4.26Å; V236-V244 HydrophobicContact CB-CG2 4.41Å; V236-V244 HydrophobicContact CG1-CB 3.43Å; V236-V244 VanDerWaalsContact CG1-CB 3.43Å; V236-V244 HydrophobicContact CG1-CG1 4.14Å; V236-V244 HydrophobicContact CG1-CG2 3.77Å; V236-V244 HydrophobicContact CG2-CB 3.82Å; V236-V244 HydrophobicContact CG2-CG1 3.66Å; V236-V244 HydrophobicContact CG2-CG2 4.04Å; D242-V244 PolarHBondContact O-N 2.86Å; V244-V246 HydrophobicContact CG1-CG2 4.14Å
245	L	73.6	Confident	72.8	Confident	17 Å²	17	44.1 Å²	44.1	9%	0.089	25%	0.251	C	S	.	.			trans	-121.1	124.1	168	166.2	69.6	0	0	0	109.2	T119 V120 V137 V140 M158 F198 L199 A200 I247	T119-L245 HydrophobicContact CG2-CD1 4.17Å; T119-L245 HydrophobicContact CG2-CD2 4.08Å; V120-L245 HydrophobicContact CB-CD2 4.44Å; V120-L245 HydrophobicContact CG2-CD2 3.53Å; V137-L245 WeakPolarHBondContact O-CD1 3.35Å; V140-L245 HydrophobicContact CB-CD1 4.49Å; V140-L245 HydrophobicContact CG2-CD1 3.84Å; M158-L245 HydrophobicContact CE-CD2 4.49Å; F198-L245 PolarHBondContact O-N 3.45Å; L199-L245 HydrophobicContact CD1-CB 3.78Å; L199-L245 HydrophobicContact CD1-CD2 3.72Å; L199-L245 HydrophobicContact CD1-CG 3.84Å; A200-L245 PolarHBondContact N-O 3.29Å; L245-I247 HydrophobicContact CD1-CG1 4.18Å; L245-I247 HydrophobicContact CD2-CD1 3.86Å; L245-I247 HydrophobicContact CD2-CG1 3.99Å; L245-I247 HydrophobicContact CG-CD1 4.25Å; L245-I247 HydrophobicContact CG-CG1 3.81Å
246	V	76.4	Confident	73.8	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.055	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.5	172.9	177.6	0	0	0	0	108.5	Q138 G139 V140 A200 L202 F229 F233 V244 L264	Q138-V246 PolarHBondContact O-N 3.22Å; G139-V246 CarbonylContact C-O 3.59Å; G139-V246 WeakPolarHBondContact CA-O 3Å; V140-V246 PolarHBondContact N-O 3.02Å; A200-V246 HydrophobicContact CB-CG2 4.33Å; A200-V246 WeakPolarHBondContact O-CA 3.18Å; L202-V246 HydrophobicContact CB-CG1 4.46Å; F229-V246 HydrophobicContact CZ-CG1 4.12Å; F233-V246 HydrophobicContact CD2-CB 4.13Å; F233-V246 HydrophobicContact CD2-CG1 4.24Å; F233-V246 HydrophobicContact CD2-CG2 3.84Å; F233-V246 HydrophobicContact CE2-CB 3.54Å; F233-V246 HydrophobicContact CE2-CG1 3.87Å; F233-V246 HydrophobicContact CE2-CG2 3.67Å; F233-V246 HydrophobicContact CZ-CB 4.37Å; V244-V246 HydrophobicContact CG1-CG2 4.14Å; V246-L264 HydrophobicContact CG1-CD2 4.41Å
247	I	78.7	Confident	75.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	112.5	172.6	-45.8	-167.7	0	0	0	110	L116 V120 V140 L142 V154 M158 A200 R201 L202 L245	L116-I247 HydrophobicContact CD2-CD1 3.99Å; V120-I247 HydrophobicContact CG2-CD1 4.28Å; V140-I247 HydrophobicContact CB-CG1 4.22Å; V140-I247 HydrophobicContact CB-CG2 4.06Å; V140-I247 HydrophobicContact CG1-CG2 4.13Å; V140-I247 CarbonylContact O-C 3.56Å; V140-I247 VanDerWaalsContact O-CA 3.26Å; V140-I247 WeakPolarHBondContact O-CA 3.19Å; L142-I247 HydrophobicContact CG-CG2 4.28Å; V154-I247 HydrophobicContact CG1-CD1 3.95Å; V154-I247 HydrophobicContact CG2-CG2 4.21Å; M158-I247 HydrophobicContact CE-CD1 3.13Å; M158-I247 HydrophobicContact CE-CG1 4.18Å; A200-I247 PolarHBondContact O-N 3.43Å; R201-I247 VanDerWaalsContact NH1-CB 3.29Å; R201-I247 PolarHBondContact NH1-O 3.34Å; L202-I247 CarbonylContact C-O 3.58Å; L202-I247 VanDerWaalsContact C-O 3.22Å; L202-I247 PolarHBondContact N-O 3.44Å; L245-I247 HydrophobicContact CD1-CG1 4.18Å; L245-I247 HydrophobicContact CD2-CD1 3.86Å; L245-I247 HydrophobicContact CD2-CG1 3.99Å; L245-I247 HydrophobicContact CG-CD1 4.25Å; L245-I247 HydrophobicContact CG-CG1 3.81Å
248	G	81.4	Confident	76.7	Confident	3 Å²	3	45.3 Å²	45.3	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	151.7	173.2	0	0	0	0	0	112.3	V140 L142	V140-G248 PolarHBondContact O-N 3.43Å; L142-G248 PolarHBondContact N-O 3.45Å
249	A	86.2	Confident	78.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.6	172.2	0	0	0	0	0	110.8	L142 K150 I207	L142-A249 HydrophobicContact CB-CB 4.47Å; L142-A249 CarbonylContact O-C 3.48Å; L142-A249 VanDerWaalsContact O-CA 3.25Å; L142-A249 WeakPolarHBondContact O-CA 3.44Å; K150-A249 HydrophobicContact CB-CB 4.47Å; I207-A249 PolarHBondContact N-O 3.08Å
250	T	88.2	Confident	79.3	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	151.5	179.9	-174.2	0	0	0	0	112.1	L141 L142 F143 G144 K150 D208 R252 P253 L256	L141-T250 HydrophobicContact CD1-CG2 3.87Å; L141-T250 HydrophobicContact CG-CG2 4.5Å; L142-T250 PolarHBondContact O-N 3.01Å; F143-T250 WeakPolarHBondContact CA-O 3.48Å; F143-T250 HydrophobicContact CB-CG2 3.62Å; G144-T250 PolarHBondContact N-O 2.91Å; K150-T250 VanDerWaalsContact CE-O 3.29Å; K150-T250 WeakPolarHBondContact CE-O 3.49Å; D208-T250 PolarHBondContact OD1-OG1 2.8Å; T250-R252 VanDerWaalsContact OG1-C 3.28Å; T250-R252 PolarHBondContact OG1-N 3.44Å; T250-R252 PolarHBondContact OG1-O 2.94Å; T250-P253 HydrophobicContact CG2-CB 3.82Å; T250-L256 HydrophobicContact CG2-CD1 4.11Å
251	N	90.4	Very high	81	Confident	30 Å²	30	30.8 Å²	30.8	16%	0.16	16%	0.155	C	C	.	.	S	Bend	trans	-94.9	-15.1	165.3	-62.3	-42.7	0	0	0	111.9	G144 P146 K150 H379	G144-N251 WeakPolarHBondContact O-CA 3.13Å; P146-N251 WeakPolarHBondContact CA-OD1 3.41Å; K150-N251 WeakPolarHBondContact CE-OD1 3.18Å; K150-N251 PolarHBondContact NZ-OD1 2.82Å; N251-H379 PolarHBondContact O-CE1 3.48Å; N251-H379 VanDerWaalsContact O-CE1 3.24Å; N251-H379 PolarHBondContact O-NE2 3.21Å
252	R	89.1	Confident	82.5	Confident	114 Å²	114	35.5 Å²	35.5	43%	0.43	16%	0.16	S	C	.	.			trans	-133.4	77.5	-174.2	-60.1	-178.6	-177.8	168.2	1.3	109.5	T250 F254 D255	T250-R252 VanDerWaalsContact OG1-C 3.28Å; T250-R252 PolarHBondContact OG1-N 3.44Å; T250-R252 PolarHBondContact OG1-O 2.94Å; R252-F254 VanDerWaalsContact C-N 3.28Å; R252-F254 HydrophobicContact CB-CE1 4.48Å; R252-F254 HydrophobicContact CB-CE2 3.89Å; R252-F254 HydrophobicContact CB-CZ 3.85Å; R252-F254 HydrophobicContact CG-CE2 4.23Å; R252-F254 HydrophobicContact CG-CZ 3.94Å; R252-F254 PolarHBondContact O-N 3.26Å; R252-D255 HydrophobicContact CB-CB 4.15Å; R252-D255 WeakPolarHBondContact CD-OD2 3.39Å; R252-D255 PolarHBondContact O-N 3.43Å
253	P	91.5	Very high	83.8	Confident	0 Å²	0	36 Å²	36	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-69	-29.1	-177.3	30.6	-37.3	0	0	0	112.9	F143 T250 D255 L256 L383 F386	F143-P253 HydrophobicContact CB-CB 3.89Å; F143-P253 HydrophobicContact CB-CG 4.04Å; F143-P253 HydrophobicContact CD2-CB 4.21Å; F143-P253 HydrophobicContact CD2-CG 3.72Å; F143-P253 HydrophobicContact CE2-CG 4.47Å; F143-P253 HydrophobicContact CG-CB 4.08Å; F143-P253 HydrophobicContact CG-CG 4.08Å; T250-P253 HydrophobicContact CG2-CB 3.82Å; P253-D255 PolarHBondContact O-N 2.91Å; P253-L256 WeakPolarHBondContact O-CB 3.23Å; P253-L256 PolarHBondContact O-N 3.36Å; P253-L383 VanDerWaalsContact CD-CD2 3.47Å; P253-L383 HydrophobicContact CG-CD2 3.78Å; P253-F386 HydrophobicContact CB-CD1 3.77Å; P253-F386 HydrophobicContact CB-CD2 4.18Å; P253-F386 HydrophobicContact CB-CE1 3.55Å; P253-F386 HydrophobicContact CB-CE2 3.97Å; P253-F386 HydrophobicContact CB-CG 4.09Å; P253-F386 HydrophobicContact CB-CZ 3.67Å; P253-F386 HydrophobicContact CG-CB 4.32Å; P253-F386 HydrophobicContact CG-CD1 3.68Å; P253-F386 HydrophobicContact CG-CD2 4.15Å; P253-F386 HydrophobicContact CG-CE1 4.03Å; P253-F386 HydrophobicContact CG-CE2 4.45Å; P253-F386 HydrophobicContact CG-CG 3.77Å; P253-F386 HydrophobicContact CG-CZ 4.41Å
254	F	90.9	Very high	85	Confident	65 Å²	65	32.3 Å²	32.3	29%	0.285	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-68.5	-10.8	176.1	49	-101.7	0	0	0	114	R252 H379 R382 F386	R252-F254 VanDerWaalsContact C-N 3.28Å; R252-F254 HydrophobicContact CB-CE1 4.48Å; R252-F254 HydrophobicContact CB-CE2 3.89Å; R252-F254 HydrophobicContact CB-CZ 3.85Å; R252-F254 HydrophobicContact CG-CE2 4.23Å; R252-F254 HydrophobicContact CG-CZ 3.94Å; R252-F254 PolarHBondContact O-N 3.26Å; F254-H379 AromaticContact CE1-NE2 3.89Å; F254-H379 AromaticContact CZ-CD2 3.94Å; F254-H379 AromaticContact CZ-NE2 3.77Å; F254-R382 HydrophobicContact CD1-CB 4.49Å; F254-R382 HydrophobicContact CE1-CB 4.31Å; F254-F386 HydrophobicContact CB-CD2 4.35Å
255	D	89	Confident	86	Confident	36 Å²	36	35.5 Å²	35.5	19%	0.193	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-89	-7.3	175.4	-75.6	-3.9	0	0	0	112.2	D208 R212 E213 R252 P253	D208-D255 HydrophobicContact CB-CB 4.16Å; R212-D255 CarbonylContact C-O 3.43Å; R212-D255 WeakPolarHBondContact CA-O 3.32Å; R212-D255 HydrophobicContact CG-CB 3.9Å; R212-D255 WeakPolarHBondContact CG-O 3.41Å; R212-D255 IonicContact CZ-OD2 2.73Å; R212-D255 IonicContact NE-OD2 3.83Å; R212-D255 PolarHBondContact NE-OD2 2.82Å; R212-D255 IonicContact NH2-OD2 3.94Å; R212-D255 PolarHBondContact NH2-OD2 2.94Å; E213-D255 PolarHBondContact N-O 3.4Å; R252-D255 HydrophobicContact CB-CB 4.15Å; R252-D255 WeakPolarHBondContact CD-OD2 3.39Å; R252-D255 PolarHBondContact O-N 3.43Å; P253-D255 PolarHBondContact O-N 2.91Å
256	L	87.5	Confident	86.8	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-82.1	140.6	-172.6	-67	172.7	0	0	0	112.5	L141 I207 D208 L211 T250 P253 L261	L141-L256 HydrophobicContact CD1-CD1 4.14Å; L141-L256 HydrophobicContact CD2-CD1 3.95Å; I207-L256 HydrophobicContact CD1-CD1 3.88Å; I207-L256 HydrophobicContact CD1-CD2 4.02Å; I207-L256 HydrophobicContact CG1-CD1 4.46Å; I207-L256 HydrophobicContact CG1-CD2 4.02Å; D208-L256 HydrophobicContact CB-CD2 4.16Å; L211-L256 HydrophobicContact CB-CD2 4.03Å; T250-L256 HydrophobicContact CG2-CD1 4.11Å; P253-L256 WeakPolarHBondContact O-CB 3.23Å; P253-L256 PolarHBondContact O-N 3.36Å; L256-L261 HydrophobicContact CB-CD2 4.05Å; L256-L261 HydrophobicContact CB-CG 4.13Å; L256-L261 HydrophobicContact CD1-CD2 3.93Å
257	D	85.1	Confident	87.6	Confident	28 Å²	28	37 Å²	37	15%	0.15	17%	0.172	C	C	.	.			trans	-60.7	134.5	173.6	-171.6	-65	0	0	0	111.4	L211 A259 V260 L261	L211-D257 PolarHBondContact O-N 2.9Å; D257-A259 PolarHBondContact O-N 2.87Å; D257-A259 VanDerWaalsContact O-N 3.14Å; D257-A259 WeakPolarHBondContact OD1-CA 3.27Å; D257-A259 WeakPolarHBondContact OD1-CB 3.48Å; D257-A259 PolarHBondContact OD1-N 3.41Å; D257-V260 HydrophobicContact CB-CG2 4.05Å; D257-V260 WeakPolarHBondContact O-CA 3.26Å; D257-V260 VanDerWaalsContact O-CB 3.27Å; D257-V260 WeakPolarHBondContact O-CB 3.25Å; D257-V260 PolarHBondContact O-N 3.45Å; D257-L261 PolarHBondContact O-N 3.06Å
258	E	87.4	Confident	88.3	Confident	114 Å²	114	37.2 Å²	37.2	53%	0.533	17%	0.173	S	C	.	.	H	α-helix	trans	-52.7	-34.6	178	-77.1	-63.4	149.6	0	0	113.2	V260 L261 R262	E258-V260 VanDerWaalsContact C-N 3.25Å; E258-V260 PolarHBondContact O-N 2.89Å; E258-L261 PolarHBondContact O-N 3.26Å; E258-R262 WeakPolarHBondContact O-CB 3.29Å; E258-R262 PolarHBondContact O-N 2.98Å
259	A	86.1	Confident	88.9	Confident	28 Å²	28	39 Å²	39	23%	0.231	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-31.4	176.5	0	0	0	0	0	112.1	L230 D257 R263	L230-A259 HydrophobicContact CD1-CB 4.11Å; D257-A259 PolarHBondContact O-N 2.87Å; D257-A259 VanDerWaalsContact O-N 3.14Å; D257-A259 WeakPolarHBondContact OD1-CA 3.27Å; D257-A259 WeakPolarHBondContact OD1-CB 3.48Å; D257-A259 PolarHBondContact OD1-N 3.41Å; A259-R263 PolarHBondContact O-NH1 3.2Å
260	V	84.8	Confident	89.2	Confident	3 Å²	3	39 Å²	39	2%	0.018	18%	0.179	C	C	.	.	H	α-helix	trans	-75.5	-45.6	175	178.3	0	0	0	0	109.5	L211 L230 D257 E258 R262 R263 L264	L211-V260 HydrophobicContact CB-CG1 4.22Å; L211-V260 HydrophobicContact CB-CG2 3.89Å; L211-V260 HydrophobicContact CD1-CG1 3.73Å; L211-V260 HydrophobicContact CD1-CG2 4.27Å; L211-V260 HydrophobicContact CD2-CG2 4.16Å; L211-V260 HydrophobicContact CG-CG2 4.32Å; L230-V260 HydrophobicContact CD2-CG2 3.82Å; D257-V260 HydrophobicContact CB-CG2 4.05Å; D257-V260 WeakPolarHBondContact O-CA 3.26Å; D257-V260 VanDerWaalsContact O-CB 3.27Å; D257-V260 WeakPolarHBondContact O-CB 3.25Å; D257-V260 PolarHBondContact O-N 3.45Å; E258-V260 VanDerWaalsContact C-N 3.25Å; E258-V260 PolarHBondContact O-N 2.89Å; V260-R262 PolarHBondContact O-N 3.49Å; V260-R263 PolarHBondContact O-N 3.4Å; V260-L264 HydrophobicContact CG1-CD1 4.01Å; V260-L264 PolarHBondContact O-N 3.3Å; V260-L264 VanDerWaalsContact O-N 3.13Å
261	L	88.7	Confident	89.5	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-58.8	-36.5	177.8	-69.3	179.6	0	0	0	112.2	L141 L256 D257 E258 R263 L264 R267 F386	L141-L261 HydrophobicContact CD2-CD2 3.93Å; L256-L261 HydrophobicContact CB-CD2 4.05Å; L256-L261 HydrophobicContact CB-CG 4.13Å; L256-L261 HydrophobicContact CD1-CD2 3.93Å; D257-L261 PolarHBondContact O-N 3.06Å; E258-L261 PolarHBondContact O-N 3.26Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.05Å; L261-L264 CarbonylContact O-C 3.43Å; L261-L264 PolarHBondContact O-N 2.84Å; L261-R267 PolarHBondContact O-NH2 3.23Å; L261-F386 HydrophobicContact CD1-CE2 4.34Å; L261-F386 HydrophobicContact CD1-CZ 4.34Å; L261-F386 HydrophobicContact CD2-CZ 4.08Å
262	R	88.4	Confident	89.7	Confident	180 Å²	180	41.5 Å²	41.5	68%	0.679	20%	0.195	S	C	*	.	H	α-helix	trans	-62.6	-32.7	174.9	-170.8	177.9	72	-179.2	4.4	113.3	E258 V260	E258-R262 WeakPolarHBondContact O-CB 3.29Å; E258-R262 PolarHBondContact O-N 2.98Å; V260-R262 PolarHBondContact O-N 3.49Å
263	R	86	Confident	90	Very high	30 Å²	30	36.3 Å²	36.3	11%	0.113	18%	0.176	C	C	.	.	H	α-helix	trans	-85	-14.9	179.7	-76.7	167.3	-178.4	90.8	-5.9	112.9	L230 F233 D234 A259 V260 L261 P265	L230-R263 VanDerWaalsContact CD2-CD 3.49Å; F233-R263 HydrophobicContact CD1-CB 3.64Å; F233-R263 HydrophobicContact CD1-CG 3.62Å; F233-R263 HydrophobicContact CD2-CB 4.24Å; F233-R263 HydrophobicContact CE1-CB 3.56Å; F233-R263 HydrophobicContact CE1-CG 3.92Å; F233-R263 WeakPolarHBondContact CE1-O 3.31Å; F233-R263 HydrophobicContact CE2-CB 4.1Å; F233-R263 HydrophobicContact CG-CB 4.05Å; F233-R263 HydrophobicContact CG-CG 4.18Å; F233-R263 HydrophobicContact CZ-CB 3.83Å; F233-R263 WeakPolarHBondContact CZ-O 3.37Å; D234-R263 IonicContact OD1-CZ 2.55Å; D234-R263 IonicContact OD1-NE 2.69Å; D234-R263 PolarHBondContact OD1-NE 3.06Å; D234-R263 IonicContact OD1-NH2 3.82Å; D234-R263 PolarHBondContact OD1-NH2 3.39Å; D234-R263 IonicContact OD2-CZ 3.31Å; D234-R263 IonicContact OD2-NE 3.41Å; D234-R263 PolarHBondContact OD2-NE 2.97Å; D234-R263 IonicContact OD2-NH2 3.89Å; D234-R263 PolarHBondContact OD2-NH2 3.32Å; A259-R263 PolarHBondContact O-NH1 3.2Å; V260-R263 PolarHBondContact O-N 3.4Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.05Å; R263-P265 WeakPolarHBondContact O-CD 3.41Å
264	L	87.4	Confident	90.2	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.031	20%	0.195	C	C	.	.			trans	-108.6	71.7	173.1	-57.8	175	0	0	0	109.5	L141 I207 F233 V246 V260 L261 K266 R267	L141-L264 HydrophobicContact CB-CB 3.98Å; L141-L264 HydrophobicContact CB-CD1 4Å; L141-L264 HydrophobicContact CD1-CD1 4Å; L141-L264 HydrophobicContact CG-CD1 4.45Å; I207-L264 HydrophobicContact CD1-CD1 4.36Å; F233-L264 HydrophobicContact CE2-CD2 4.08Å; V246-L264 HydrophobicContact CG1-CD2 4.41Å; V260-L264 HydrophobicContact CG1-CD1 4.01Å; V260-L264 PolarHBondContact O-N 3.3Å; V260-L264 VanDerWaalsContact O-N 3.13Å; L261-L264 CarbonylContact O-C 3.43Å; L261-L264 PolarHBondContact O-N 2.84Å; L264-K266 PolarHBondContact O-N 2.88Å; L264-R267 WeakPolarHBondContact O-CG 3.38Å; L264-R267 PolarHBondContact O-NE 3.47Å; L264-R267 VanDerWaalsContact O-NE 3.17Å
265	P	89.1	Confident	90.4	Very high	76 Å²	76	40.5 Å²	40.5	49%	0.494	20%	0.198	S	C	.	.			trans	-64.4	-31.3	-174.7	26.9	-36.5	0	0	0	112.1	V137 G139 R263	V137-P265 HydrophobicContact CB-CG 4.32Å; V137-P265 HydrophobicContact CG1-CG 4.43Å; G139-P265 WeakPolarHBondContact O-CD 3.34Å; R263-P265 WeakPolarHBondContact O-CD 3.41Å
266	K	90.4	Very high	90.7	Very high	19 Å²	19	46.3 Å²	46.3	8%	0.083	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	102.9	-175.9	-163.1	166.7	-174.4	175	0	110.6	S115 T119 V137 G139 V140 L141 L264 L268	S115-K266 PolarHBondContact O-NZ 3.31Å; S115-K266 WeakPolarHBondContact OG-CE 3.3Å; S115-K266 PolarHBondContact OG-NZ 3.04Å; T119-K266 VanDerWaalsContact OG1-CD 3.29Å; T119-K266 WeakPolarHBondContact OG1-CD 3.44Å; T119-K266 PolarHBondContact OG1-NZ 3.22Å; V137-K266 HydrophobicContact CG2-CB 4.08Å; V137-K266 HydrophobicContact CG2-CD 3.95Å; G139-K266 PolarHBondContact O-N 2.81Å; V140-K266 CarbonylContact C-O 3.48Å; V140-K266 VanDerWaalsContact CA-O 3.27Å; V140-K266 WeakPolarHBondContact CA-O 3.04Å; V140-K266 HydrophobicContact CG2-CB 4.02Å; V140-K266 HydrophobicContact CG2-CD 4.2Å; V140-K266 HydrophobicContact CG2-CG 4.36Å; L141-K266 PolarHBondContact N-O 3.07Å; L264-K266 PolarHBondContact O-N 2.88Å; K266-L268 HydrophobicContact CG-CD2 4.48Å
267	R	93	Very high	91	Very high	40 Å²	40	47.7 Å²	47.7	15%	0.151	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	107.9	-171.9	-59.8	152.4	-173.6	174.1	-0.4	110.4	L141 F143 L261 L264 H390 H392	L141-R267 HydrophobicContact CB-CB 4.47Å; L141-R267 HydrophobicContact CB-CG 4.09Å; L141-R267 HydrophobicContact CD2-CG 4.23Å; L141-R267 CarbonylContact O-C 3.54Å; L141-R267 WeakPolarHBondContact O-CA 3.41Å; F143-R267 HydrophobicContact CD1-CB 4.43Å; F143-R267 HydrophobicContact CE1-CB 3.96Å; L261-R267 PolarHBondContact O-NH2 3.23Å; L264-R267 WeakPolarHBondContact O-CG 3.38Å; L264-R267 PolarHBondContact O-NE 3.47Å; L264-R267 VanDerWaalsContact O-NE 3.17Å; R267-H390 WeakPolarHBondContact CD-O 3.29Å; R267-H390 PolarHBondContact NH1-O 3.2Å; R267-H392 WeakPolarHBondContact O-CB 3.42Å; R267-H392 PolarHBondContact O-N 3.44Å
268	L	92.9	Very high	91.6	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	118.8	-175.1	-53.8	174.1	0	0	0	110.1	A112 S115 L116 V140 L141 L142 F143 K266 H392	A112-L268 HydrophobicContact CB-CB 4.48Å; A112-L268 HydrophobicContact CB-CD1 4.38Å; S115-L268 WeakPolarHBondContact OG-CD2 3.35Å; L116-L268 HydrophobicContact CD2-CD1 4.38Å; L116-L268 HydrophobicContact CG-CD1 4.12Å; V140-L268 HydrophobicContact CG1-CD1 4Å; V140-L268 HydrophobicContact CG1-CG 4.41Å; L141-L268 PolarHBondContact O-N 3.11Å; L142-L268 HydrophobicContact CD2-CB 3.71Å; L142-L268 HydrophobicContact CD2-CD1 3.75Å; L142-L268 HydrophobicContact CD2-CG 4.19Å; F143-L268 WeakPolarHBondContact CD1-O 3.44Å; F143-L268 PolarHBondContact N-O 2.75Å; K266-L268 HydrophobicContact CG-CD2 4.48Å; L268-H392 HydrophobicContact CD2-CB 4.4Å
269	Y	94.4	Very high	92	Very high	41 Å²	41	42.5 Å²	42.5	16%	0.161	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129	172.2	-179.3	-134.2	0	0	0	110.7	F143 P271 L383 E384 N387	F143-Y269 AromaticContact CD2-CD2 3.83Å; F143-Y269 HydrophobicContact CD2-CD2 3.83Å; F143-Y269 AromaticContact CE2-CD2 3.52Å; F143-Y269 HydrophobicContact CE2-CD2 3.52Å; F143-Y269 HydrophobicContact CE2-CE2 4.43Å; F143-Y269 AromaticContact CE2-CG 3.99Å; F143-Y269 HydrophobicContact CE2-CG 3.99Å; F143-Y269 HydrophobicContact CZ-CD2 4.21Å; F143-Y269 HydrophobicContact CZ-CG 4.24Å; F143-Y269 CarbonylContact O-C 3.56Å; F143-Y269 WeakPolarHBondContact O-CA 2.76Å; Y269-P271 HydrophobicContact CD1-CB 4.3Å; Y269-P271 HydrophobicContact CE1-CB 3.74Å; Y269-P271 WeakPolarHBondContact O-CD 3.5Å; Y269-L383 HydrophobicContact CE2-CB 3.9Å; Y269-E384 HydrophobicContact CE1-CG 4.38Å; Y269-N387 VanDerWaalsContact CB-OD1 3.23Å; Y269-N387 WeakPolarHBondContact CB-OD1 3.19Å; Y269-N387 HydrophobicContact CD1-CB 4.32Å; Y269-N387 HydrophobicContact CG-CB 4.21Å
270	I	93.3	Very high	92.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.214	C	C	.	.			trans	-109.8	97.6	175	-57.8	-55.1	0	0	0	106.7	N109 A112 F143 G144 P145 N148 K150 L153	N109-I270 HydrophobicContact CB-CD1 4.47Å; N109-I270 WeakPolarHBondContact OD1-CG2 3.45Å; A112-I270 HydrophobicContact CB-CD1 3.37Å; F143-I270 PolarHBondContact O-N 3.45Å; G144-I270 WeakPolarHBondContact CA-O 3.42Å; P145-I270 WeakPolarHBondContact CD-O 3.35Å; N148-I270 HydrophobicContact CB-CG2 4.01Å; N148-I270 WeakPolarHBondContact O-CG2 3.27Å; K150-I270 HydrophobicContact CG-CB 3.96Å; K150-I270 HydrophobicContact CG-CG1 3.9Å; K150-I270 HydrophobicContact CG-CG2 4.09Å; L153-I270 HydrophobicContact CD2-CD1 3.81Å
271	P	93.9	Very high	92.9	Very high	49 Å²	49	47 Å²	47	32%	0.318	22%	0.22	S	C	.	.			trans	-73.7	179.6	-174.6	31.2	-36.1	0	0	0	112.6	Y269	Y269-P271 HydrophobicContact CD1-CB 4.3Å; Y269-P271 HydrophobicContact CE1-CB 3.74Å; Y269-P271 WeakPolarHBondContact O-CD 3.5Å
272	L	94.7	Very high	93.2	Very high	33 Å²	33	47 Å²	47	17%	0.173	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-66.9	152	161.2	-74.1	179.2	0	0	0	110.5	P145 V375 I380	P145-L272 HydrophobicContact CB-CD2 4.21Å; P145-L272 HydrophobicContact CG-CD2 3.91Å; P145-L272 HydrophobicContact CG-CG 3.88Å; L272-V375 HydrophobicContact CD2-CG2 4.36Å; L272-I380 HydrophobicContact CD1-CD1 3.43Å; L272-I380 VanDerWaalsContact CD1-CD1 3.43Å; L272-I380 HydrophobicContact CD1-CG1 4.24Å; L272-I380 HydrophobicContact CG-CD1 4.44Å
273	P	95.3	Very high	93.5	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.032	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-68.7	137.7	-177.4	27.2	-35.4	0	0	0	113.1	N148 E277 R278 F308 F310	N148-P273 WeakPolarHBondContact OD1-CD 3.4Å; P273-E277 WeakPolarHBondContact CA-OE2 3.44Å; P273-E277 HydrophobicContact CB-CB 3.8Å; P273-R278 HydrophobicContact CB-CG 3.95Å; P273-R278 HydrophobicContact CG-CG 3.81Å; P273-R278 PolarHBondContact O-NH1 3.24Å; P273-F308 WeakPolarHBondContact CD-O 3.28Å; P273-F308 VanDerWaalsContact CG-O 3.25Å; P273-F308 WeakPolarHBondContact CG-O 3.38Å; P273-F310 HydrophobicContact CB-CD1 4.02Å; P273-F310 HydrophobicContact CB-CE1 3.42Å; P273-F310 VanDerWaalsContact CB-CE1 3.42Å; P273-F310 HydrophobicContact CB-CZ 3.71Å; P273-F310 HydrophobicContact CG-CD1 3.98Å; P273-F310 HydrophobicContact CG-CE1 3.92Å; P273-F310 HydrophobicContact CG-CZ 4.43Å
274	D	94.8	Very high	93.8	Very high	76 Å²	76	42.6 Å²	42.6	41%	0.406	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-69.4	172.8	170.8	77.4	26.7	0	0	0	111.8	Q276 E277 R278	D274-Q276 VanDerWaalsContact C-N 3.28Å; D274-Q276 PolarHBondContact O-N 3.19Å; D274-Q276 WeakPolarHBondContact OD1-CA 3.17Å; D274-Q276 WeakPolarHBondContact OD1-CB 3.11Å; D274-Q276 PolarHBondContact OD1-N 2.91Å; D274-E277 PolarHBondContact N-OE2 2.89Å; D274-E277 PolarHBondContact O-N 2.93Å; D274-E277 WeakPolarHBondContact OD1-CB 3.36Å; D274-E277 WeakPolarHBondContact OD1-CG 3.28Å; D274-E277 PolarHBondContact OD1-N 3.41Å; D274-R278 VanDerWaalsContact O-CG 3.26Å; D274-R278 WeakPolarHBondContact O-CG 3.28Å; D274-R278 PolarHBondContact O-N 3.45Å
275	K	95.5	Very high	94.1	Very high	78 Å²	78	44.7 Å²	44.7	34%	0.339	22%	0.215	S	C	.	.	H	α-helix	trans	-55.4	-42.7	-179.6	-180	-178.8	178.5	162.9	0	112.7	R278 V279 D303	K275-R278 PolarHBondContact O-N 3.32Å; K275-V279 WeakPolarHBondContact O-CG2 3.28Å; K275-V279 PolarHBondContact O-N 2.78Å; K275-D303 WeakPolarHBondContact CD-OD1 3.33Å; K275-D303 WeakPolarHBondContact CE-OD1 3.19Å; K275-D303 WeakPolarHBondContact CE-OD2 3.34Å; K275-D303 IonicContact NZ-OD1 2.71Å; K275-D303 PolarHBondContact NZ-OD1 3.36Å; K275-D303 IonicContact NZ-OD2 3.47Å; K275-D303 PolarHBondContact NZ-OD2 3.12Å
276	Q	95.1	Very high	94.3	Very high	157 Å²	157	41.2 Å²	41.2	73%	0.734	19%	0.193	S	C	*	.	H	α-helix	trans	-69.8	-40.3	-176.7	-60.8	-174.1	-4.1	0	0	110.9	D274 V279 K280	D274-Q276 VanDerWaalsContact C-N 3.28Å; D274-Q276 PolarHBondContact O-N 3.19Å; D274-Q276 WeakPolarHBondContact OD1-CA 3.17Å; D274-Q276 WeakPolarHBondContact OD1-CB 3.11Å; D274-Q276 PolarHBondContact OD1-N 2.91Å; Q276-V279 PolarHBondContact O-N 3.32Å; Q276-K280 WeakPolarHBondContact O-CB 3.31Å; Q276-K280 PolarHBondContact O-N 2.82Å
277	E	95.3	Very high	94.3	Very high	32 Å²	32	48.6 Å²	48.6	15%	0.15	22%	0.22	C	C	.	.	H	α-helix	trans	-63.9	-42.2	173.9	-69.1	175.4	154.5	0	0	111.3	V107 G108 N109 P273 D274 K280 M281 F310	V107-E277 HydrophobicContact CG1-CB 3.91Å; V107-E277 HydrophobicContact CG1-CG 4.22Å; V107-E277 WeakPolarHBondContact CG1-O 3.3Å; G108-E277 WeakPolarHBondContact CA-OE1 3.34Å; N109-E277 PolarHBondContact N-OE1 2.96Å; P273-E277 WeakPolarHBondContact CA-OE2 3.44Å; P273-E277 HydrophobicContact CB-CB 3.8Å; D274-E277 PolarHBondContact N-OE2 2.89Å; D274-E277 PolarHBondContact O-N 2.93Å; D274-E277 WeakPolarHBondContact OD1-CB 3.36Å; D274-E277 WeakPolarHBondContact OD1-CG 3.28Å; D274-E277 PolarHBondContact OD1-N 3.41Å; E277-K280 PolarHBondContact O-N 3.3Å; E277-M281 WeakPolarHBondContact O-CB 3.45Å; E277-M281 PolarHBondContact O-N 3.44Å; E277-F310 HydrophobicContact CB-CE1 4.32Å; E277-F310 HydrophobicContact CB-CZ 4.33Å
278	R	96.1	Very high	93.9	Very high	21 Å²	21	55.4 Å²	55.4	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-47.9	173.9	-67.2	-167.3	-61.4	-91.4	11.5	111.5	P273 D274 K275 M281 L282 G302 A305 L313	P273-R278 HydrophobicContact CB-CG 3.95Å; P273-R278 HydrophobicContact CG-CG 3.81Å; P273-R278 PolarHBondContact O-NH1 3.24Å; D274-R278 VanDerWaalsContact O-CG 3.26Å; D274-R278 WeakPolarHBondContact O-CG 3.28Å; D274-R278 PolarHBondContact O-N 3.45Å; K275-R278 PolarHBondContact O-N 3.32Å; R278-M281 PolarHBondContact O-N 3.48Å; R278-L282 WeakPolarHBondContact O-CG 3.42Å; R278-L282 PolarHBondContact O-N 3.32Å; R278-G302 VanDerWaalsContact CZ-O 3.29Å; R278-G302 PolarHBondContact NE-O 2.72Å; R278-G302 PolarHBondContact NH2-O 3.06Å; R278-A305 WeakPolarHBondContact CD-O 3.19Å; R278-A305 PolarHBondContact NE-O 3.34Å; R278-L313 HydrophobicContact CB-CD1 4Å; R278-L313 HydrophobicContact CG-CD1 3.98Å
279	V	95.9	Very high	93.8	Very high	11 Å²	11	60 Å²	60	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-46.1	176.8	167.8	0	0	0	0	111.4	K275 Q276 M281 L282 R283 F298	K275-V279 WeakPolarHBondContact O-CG2 3.28Å; K275-V279 PolarHBondContact O-N 2.78Å; Q276-V279 PolarHBondContact O-N 3.32Å; V279-M281 VanDerWaalsContact C-N 3.34Å; V279-M281 PolarHBondContact O-N 2.79Å; V279-L282 PolarHBondContact O-N 3.31Å; V279-R283 WeakPolarHBondContact O-CG 3.36Å; V279-R283 PolarHBondContact O-N 3.25Å; V279-F298 HydrophobicContact CG1-CB 4.05Å
280	K	95.1	Very high	93.6	Very high	97 Å²	97	65 Å²	65	42%	0.422	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-42.4	178.8	-177	170.2	172.6	-179.4	0	111.5	V107 Q276 E277 R283 M284	V107-K280 HydrophobicContact CG1-CB 4.03Å; V107-K280 HydrophobicContact CG1-CD 4.08Å; V107-K280 HydrophobicContact CG1-CG 4.07Å; V107-K280 HydrophobicContact CG2-CG 4.16Å; Q276-K280 WeakPolarHBondContact O-CB 3.31Å; Q276-K280 PolarHBondContact O-N 2.82Å; E277-K280 PolarHBondContact O-N 3.3Å; K280-R283 PolarHBondContact O-N 3.34Å; K280-M284 HydrophobicContact CG-SD 4.23Å; K280-M284 WeakPolarHBondContact O-CG 3.24Å; K280-M284 PolarHBondContact O-N 2.81Å
281	M	94.9	Very high	93.6	Very high	30 Å²	30	68.2 Å²	68.2	15%	0.148	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-45.1	175.9	-175.6	62.8	-177.6	0	0	111.8	V107 E277 R278 V279 R283 M284 L285 F310 L313	V107-M281 HydrophobicContact CG2-CB 4.38Å; V107-M281 HydrophobicContact CG2-SD 4.14Å; E277-M281 WeakPolarHBondContact O-CB 3.45Å; E277-M281 PolarHBondContact O-N 3.44Å; R278-M281 PolarHBondContact O-N 3.48Å; V279-M281 VanDerWaalsContact C-N 3.34Å; V279-M281 PolarHBondContact O-N 2.79Å; M281-R283 PolarHBondContact O-N 3.1Å; M281-M284 PolarHBondContact O-N 3.46Å; M281-L285 HydrophobicContact CE-CD1 3.97Å; M281-L285 HydrophobicContact CE-CD2 3.92Å; M281-L285 HydrophobicContact CE-CG 3.91Å; M281-L285 HydrophobicContact CG-CD1 4.13Å; M281-L285 HydrophobicContact CG-CG 4.48Å; M281-L285 WeakPolarHBondContact O-CG 3.39Å; M281-L285 PolarHBondContact O-N 2.67Å; M281-F310 HydrophobicContact CB-CD1 3.95Å; M281-F310 HydrophobicContact CB-CE1 4.06Å; M281-F310 HydrophobicContact CE-CB 4.48Å; M281-F310 HydrophobicContact CG-CD1 3.78Å; M281-F310 HydrophobicContact CG-CE1 4.36Å; M281-F310 HydrophobicContact SD-CD1 4.29Å; M281-L313 HydrophobicContact CB-CD1 3.99Å; M281-L313 HydrophobicContact CG-CB 4.46Å; M281-L313 HydrophobicContact CG-CD1 4.03Å
282	L	95.1	Very high	93.6	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-45.1	176.5	-72.7	167.7	0	0	0	111.8	R278 V279 M284 L285 L286 F298 I301 L313 F364	R278-L282 WeakPolarHBondContact O-CG 3.42Å; R278-L282 PolarHBondContact O-N 3.32Å; V279-L282 PolarHBondContact O-N 3.31Å; L282-M284 VanDerWaalsContact C-N 3.32Å; L282-M284 PolarHBondContact O-N 2.89Å; L282-L285 PolarHBondContact O-N 3.28Å; L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 WeakPolarHBondContact O-CG 3.45Å; L282-L286 PolarHBondContact O-N 3.49Å; L282-F298 HydrophobicContact CB-CD1 4.11Å; L282-F298 HydrophobicContact CB-CE1 4.13Å; L282-I301 HydrophobicContact CD1-CB 4.2Å; L282-I301 HydrophobicContact CD1-CG2 3.57Å; L282-L313 HydrophobicContact CD2-CD2 4.43Å; L282-L313 HydrophobicContact CG-CD2 4.48Å; L282-F364 HydrophobicContact CD2-CE1 3.97Å
283	R	94.6	Very high	93.5	Very high	88 Å²	88	68.4 Å²	68.4	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-43.8	174.9	-71.8	-178.9	-167.1	-102.7	3.5	111.6	V279 K280 M281 L286 R287 D295 F298	V279-R283 WeakPolarHBondContact O-CG 3.36Å; V279-R283 PolarHBondContact O-N 3.25Å; K280-R283 PolarHBondContact O-N 3.34Å; M281-R283 PolarHBondContact O-N 3.1Å; R283-L286 PolarHBondContact O-N 2.86Å; R283-R287 WeakPolarHBondContact O-CG 3.31Å; R283-R287 PolarHBondContact O-N 2.76Å; R283-R287 VanDerWaalsContact O-N 3.14Å; R283-D295 IonicContact CZ-OD1 2.68Å; R283-D295 IonicContact NH1-OD1 3.17Å; R283-D295 PolarHBondContact NH1-OD1 2.85Å; R283-D295 IonicContact NH2-OD1 3.96Å; R283-D295 PolarHBondContact NH2-OD1 3.19Å; R283-F298 HydrophobicContact CB-CE1 4.43Å; R283-F298 HydrophobicContact CG-CD1 3.85Å; R283-F298 HydrophobicContact CG-CD2 4.23Å; R283-F298 HydrophobicContact CG-CE1 3.66Å; R283-F298 HydrophobicContact CG-CE2 4.06Å; R283-F298 HydrophobicContact CG-CG 4.14Å; R283-F298 HydrophobicContact CG-CZ 3.78Å
284	M	92.8	Very high	93.4	Very high	30 Å²	30	70.2 Å²	70.2	15%	0.148	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-44.6	178.4	-76.9	175.5	57.2	0	0	112.7	D105 V107 K280 M281 L282 L286 R287	D105-M284 HydrophobicContact CB-CE 4.47Å; D105-M284 WeakPolarHBondContact O-CE 3.18Å; V107-M284 HydrophobicContact CG2-CE 3.97Å; V107-M284 HydrophobicContact CG2-SD 3.29Å; V107-M284 WeakPolarHBondContact CG2-SD 3.44Å; K280-M284 HydrophobicContact CG-SD 4.23Å; K280-M284 WeakPolarHBondContact O-CG 3.24Å; K280-M284 PolarHBondContact O-N 2.81Å; M281-M284 PolarHBondContact O-N 3.46Å; L282-M284 VanDerWaalsContact C-N 3.32Å; L282-M284 PolarHBondContact O-N 2.89Å; M284-L286 PolarHBondContact O-N 2.86Å; M284-R287 PolarHBondContact O-N 2.73Å
285	L	93	Very high	93.4	Very high	50 Å²	50	71.4 Å²	71.4	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-33.6	176.5	-72.6	170.4	0	0	0	112.3	M281 L282 K314 A317	M281-L285 HydrophobicContact CE-CD1 3.97Å; M281-L285 HydrophobicContact CE-CD2 3.92Å; M281-L285 HydrophobicContact CE-CG 3.91Å; M281-L285 HydrophobicContact CG-CD1 4.13Å; M281-L285 HydrophobicContact CG-CG 4.48Å; M281-L285 WeakPolarHBondContact O-CG 3.39Å; M281-L285 PolarHBondContact O-N 2.67Å; L282-L285 PolarHBondContact O-N 3.28Å; L285-K314 HydrophobicContact CD1-CB 4.38Å; L285-K314 HydrophobicContact CD2-CG 4.22Å; L285-A317 HydrophobicContact CB-CB 4.32Å; L285-A317 HydrophobicContact CD1-CB 3.9Å
286	L	93.7	Very high	93.3	Very high	4 Å²	4	75.9 Å²	75.9	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-89.7	-3.3	-177.8	-66.7	-176	0	0	0	114.9	L282 R283 M284 Q288 Q289 L293 F298 L359 F364	L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 WeakPolarHBondContact O-CG 3.45Å; L282-L286 PolarHBondContact O-N 3.49Å; R283-L286 PolarHBondContact O-N 2.86Å; M284-L286 PolarHBondContact O-N 2.86Å; L286-Q288 PolarHBondContact O-N 3.05Å; L286-Q289 HydrophobicContact CD2-CB 4.06Å; L286-Q289 HydrophobicContact CD2-CG 4.19Å; L286-Q289 PolarHBondContact O-N 3.09Å; L286-L293 HydrophobicContact CD1-CD1 3.46Å; L286-L293 VanDerWaalsContact CD1-CD1 3.46Å; L286-F298 HydrophobicContact CD1-CE1 3.88Å; L286-F298 HydrophobicContact CD1-CZ 4.01Å; L286-L359 HydrophobicContact CD2-CD1 3.74Å; L286-F364 HydrophobicContact CD1-CE2 4.07Å; L286-F364 HydrophobicContact CD1-CZ 3.8Å; L286-F364 HydrophobicContact CD2-CZ 4.11Å; L286-F364 HydrophobicContact CG-CZ 4.35Å
287	R	90.3	Very high	93.3	Very high	173 Å²	173	69 Å²	69	65%	0.653	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.5	179.9	-77.7	178.7	179.9	171	-0.9	114.2	R283 M284	R283-R287 WeakPolarHBondContact O-CG 3.31Å; R283-R287 PolarHBondContact O-N 2.76Å; R283-R287 VanDerWaalsContact O-N 3.14Å; M284-R287 PolarHBondContact O-N 2.73Å
288	Q	85.8	Confident	93.4	Very high	183 Å²	183	67.7 Å²	67.7	86%	0.855	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	9.3	-179.3	-63.6	-178.3	-4.7	0	0	113.1	L286	L286-Q288 PolarHBondContact O-N 3.05Å
289	Q	89.9	Confident	93.4	Very high	100 Å²	100	69.9 Å²	69.9	47%	0.467	34%	0.34	S	S	.	.	S	Bend	trans	-115.6	143	-176.8	-59.7	-57.6	-39.1	0	0	110.5	L286 H291 L359	L286-Q289 HydrophobicContact CD2-CB 4.06Å; L286-Q289 HydrophobicContact CD2-CG 4.19Å; L286-Q289 PolarHBondContact O-N 3.09Å; Q289-H291 PolarHBondContact O-CD2 2.79Å; Q289-H291 PolarHBondContact O-N 2.91Å; Q289-L359 HydrophobicContact CB-CD1 4.33Å
290	K	90.5	Very high	93.4	Very high	148 Å²	148	73 Å²	73	64%	0.643	35%	0.353	S	S	*	.			trans	-73.1	118.1	171	-66.4	-177.5	-179.3	179.1	0	108.8	P358 L359	K290-P358 HydrophobicContact CB-CB 4.37Å; K290-P358 WeakPolarHBondContact O-CA 3.02Å; K290-L359 PolarHBondContact O-N 3.48Å
291	H	93.8	Very high	93.4	Very high	66 Å²	66	68.5 Å²	68.5	31%	0.306	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-140.7	153.1	177.1	69.5	81.1	0	0	0	112.2	Q289 L293 F298 L359	Q289-H291 PolarHBondContact O-CD2 2.79Å; Q289-H291 PolarHBondContact O-N 2.91Å; H291-L293 HydrophobicContact CB-CD1 4.41Å; H291-L293 HydrophobicContact CB-CG 4.41Å; H291-L293 PolarHBondContact ND1-N 2.78Å; H291-F298 AromaticContact CE1-CE2 3.97Å; H291-F298 AromaticContact CE1-CZ 3.88Å; H291-L359 CarbonylContact C-O 3.57Å; H291-L359 WeakPolarHBondContact CA-O 3.45Å; H291-L359 HydrophobicContact CB-CB 3.93Å
292	A	92.7	Very high	93.4	Very high	72 Å²	72	67.1 Å²	67.1	60%	0.595	33%	0.327	S	S	*	.			trans	-107	16.4	175.1	0	0	0	0	0	112.3	G294 L359	A292-G294 PolarHBondContact O-N 3.16Å; A292-L359 PolarHBondContact N-O 2.83Å
293	L	93	Very high	93.4	Very high	15 Å²	15	70.7 Å²	70.7	8%	0.079	35%	0.346	C	S	.	.			trans	-72.9	122.5	178.7	-61.8	167.7	0	0	0	111.8	L286 H291 A297 F298 I301 A361 F364	L286-L293 HydrophobicContact CD1-CD1 3.46Å; L286-L293 VanDerWaalsContact CD1-CD1 3.46Å; H291-L293 HydrophobicContact CB-CD1 4.41Å; H291-L293 HydrophobicContact CB-CG 4.41Å; H291-L293 PolarHBondContact ND1-N 2.78Å; L293-A297 HydrophobicContact CB-CB 4.39Å; L293-A297 HydrophobicContact CD2-CB 3.73Å; L293-F298 HydrophobicContact CB-CD2 4.19Å; L293-F298 HydrophobicContact CB-CE2 3.74Å; L293-F298 HydrophobicContact CB-CZ 4.01Å; L293-F298 HydrophobicContact CD1-CE1 4.21Å; L293-F298 HydrophobicContact CD1-CZ 4.12Å; L293-I301 HydrophobicContact CD1-CD1 4.34Å; L293-I301 HydrophobicContact CD2-CD1 4.03Å; L293-A361 HydrophobicContact CD2-CB 3.98Å; L293-A361 VanDerWaalsContact CD2-N 3.31Å; L293-F364 HydrophobicContact CD1-CD2 4.07Å; L293-F364 HydrophobicContact CD1-CE2 3.72Å; L293-F364 HydrophobicContact CD1-CZ 4.45Å
294	G	93.3	Very high	93.4	Very high	42 Å²	42	69.9 Å²	69.9	43%	0.433	35%	0.354	S	S	.	.			trans	-91.6	177.5	166.4	0	0	0	0	0	112.8	A292 Y296 A297 F298	A292-G294 PolarHBondContact O-N 3.16Å; G294-Y296 VanDerWaalsContact C-N 3.29Å; G294-Y296 PolarHBondContact O-N 3.17Å; G294-A297 PolarHBondContact O-N 2.86Å; G294-A297 VanDerWaalsContact O-N 3.08Å; G294-F298 WeakPolarHBondContact O-CD2 3.08Å; G294-F298 PolarHBondContact O-N 3.49Å; G294-F298 VanDerWaalsContact O-N 3.09Å
295	D	94.5	Very high	93.5	Very high	101 Å²	101	68.5 Å²	68.5	54%	0.54	35%	0.347	S	S	.	.	H	α-helix	trans	-58.1	-39.2	-176.1	-66.1	-26.8	0	0	0	113.5	R283 A297 F298 N299	R283-D295 IonicContact CZ-OD1 2.68Å; R283-D295 IonicContact NH1-OD1 3.17Å; R283-D295 PolarHBondContact NH1-OD1 2.85Å; R283-D295 IonicContact NH2-OD1 3.96Å; R283-D295 PolarHBondContact NH2-OD1 3.19Å; D295-A297 PolarHBondContact O-N 2.89Å; D295-F298 PolarHBondContact O-N 3.39Å; D295-N299 PolarHBondContact O-N 3.48Å; D295-N299 PolarHBondContact O-ND2 2.94Å
296	Y	95	Very high	93.6	Very high	172 Å²	172	73.3 Å²	73.3	68%	0.675	37%	0.368	S	S	*	.	H	α-helix	trans	-59.7	-45.5	175.9	-178.4	-102.2	0	0	0	112	G294 N299 Q300	G294-Y296 VanDerWaalsContact C-N 3.29Å; G294-Y296 PolarHBondContact O-N 3.17Å; Y296-N299 PolarHBondContact O-N 3.34Å; Y296-Q300 HydrophobicContact CD1-CG 4.33Å; Y296-Q300 HydrophobicContact CE1-CG 3.97Å; Y296-Q300 WeakPolarHBondContact O-CG 3.46Å; Y296-Q300 PolarHBondContact O-N 2.8Å; Y296-Q300 PolarHBondContact OH-NE2 3.34Å
297	A	94.6	Very high	93.6	Very high	13 Å²	13	74.4 Å²	74.4	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-41.4	179.1	0	0	0	0	0	111.6	L293 G294 D295 N299 Q300 I301 A361	L293-A297 HydrophobicContact CB-CB 4.39Å; L293-A297 HydrophobicContact CD2-CB 3.73Å; G294-A297 PolarHBondContact O-N 2.86Å; G294-A297 VanDerWaalsContact O-N 3.08Å; D295-A297 PolarHBondContact O-N 2.89Å; A297-N299 VanDerWaalsContact C-N 3.33Å; A297-N299 PolarHBondContact O-N 3.02Å; A297-Q300 PolarHBondContact O-N 3.28Å; A297-I301 WeakPolarHBondContact O-CD1 3.25Å; A297-I301 VanDerWaalsContact O-CG1 3.23Å; A297-I301 WeakPolarHBondContact O-CG1 3.29Å; A297-I301 PolarHBondContact O-N 2.76Å; A297-A361 HydrophobicContact CB-CB 4.08Å
298	F	96.3	Very high	93.9	Very high	5 Å²	5	66.6 Å²	66.6	2%	0.022	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-45.1	173.9	-83.2	-68.5	0	0	0	112.1	V279 L282 R283 L286 H291 L293 G294 D295 I301 G302	V279-F298 HydrophobicContact CG1-CB 4.05Å; L282-F298 HydrophobicContact CB-CD1 4.11Å; L282-F298 HydrophobicContact CB-CE1 4.13Å; R283-F298 HydrophobicContact CB-CE1 4.43Å; R283-F298 HydrophobicContact CG-CD1 3.85Å; R283-F298 HydrophobicContact CG-CD2 4.23Å; R283-F298 HydrophobicContact CG-CE1 3.66Å; R283-F298 HydrophobicContact CG-CE2 4.06Å; R283-F298 HydrophobicContact CG-CG 4.14Å; R283-F298 HydrophobicContact CG-CZ 3.78Å; L286-F298 HydrophobicContact CD1-CE1 3.88Å; L286-F298 HydrophobicContact CD1-CZ 4.01Å; H291-F298 AromaticContact CE1-CE2 3.97Å; H291-F298 AromaticContact CE1-CZ 3.88Å; L293-F298 HydrophobicContact CB-CD2 4.19Å; L293-F298 HydrophobicContact CB-CE2 3.74Å; L293-F298 HydrophobicContact CB-CZ 4.01Å; L293-F298 HydrophobicContact CD1-CE1 4.21Å; L293-F298 HydrophobicContact CD1-CZ 4.12Å; G294-F298 WeakPolarHBondContact O-CD2 3.08Å; G294-F298 PolarHBondContact O-N 3.49Å; G294-F298 VanDerWaalsContact O-N 3.09Å; D295-F298 PolarHBondContact O-N 3.39Å; F298-I301 PolarHBondContact O-N 3.13Å; F298-G302 PolarHBondContact O-N 3.04Å
299	N	96.3	Very high	94.3	Very high	67 Å²	67	57.9 Å²	57.9	36%	0.358	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-43	178.8	-74.4	-34.8	0	0	0	112.1	D295 Y296 A297 G302 D303	D295-N299 PolarHBondContact O-N 3.48Å; D295-N299 PolarHBondContact O-ND2 2.94Å; Y296-N299 PolarHBondContact O-N 3.34Å; A297-N299 VanDerWaalsContact C-N 3.33Å; A297-N299 PolarHBondContact O-N 3.02Å; N299-G302 PolarHBondContact O-N 3.42Å; N299-D303 PolarHBondContact O-N 3.35Å
300	Q	95.4	Very high	94.6	Very high	75 Å²	75	54 Å²	54	35%	0.35	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-46.1	174.9	-75.5	-168.7	-27.1	0	0	112.3	Y296 A297 G302 D303 C304	Y296-Q300 HydrophobicContact CD1-CG 4.33Å; Y296-Q300 HydrophobicContact CE1-CG 3.97Å; Y296-Q300 WeakPolarHBondContact O-CG 3.46Å; Y296-Q300 PolarHBondContact O-N 2.8Å; Y296-Q300 PolarHBondContact OH-NE2 3.34Å; A297-Q300 PolarHBondContact O-N 3.28Å; Q300-G302 VanDerWaalsContact C-N 3.27Å; Q300-G302 PolarHBondContact O-N 2.83Å; Q300-D303 PolarHBondContact O-N 3.33Å; Q300-C304 PolarHBondContact O-N 3.21Å; Q300-C304 PolarHBondContact O-SG 2.83Å; Q300-C304 VanDerWaalsContact O-SG 3.38Å
301	I	95.1	Very high	94.7	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-39.2	177.1	-61.7	160.6	0	0	0	110	L282 L293 A297 F298 D303 C304 A305 L316 F364	L282-I301 HydrophobicContact CD1-CB 4.2Å; L282-I301 HydrophobicContact CD1-CG2 3.57Å; L293-I301 HydrophobicContact CD1-CD1 4.34Å; L293-I301 HydrophobicContact CD2-CD1 4.03Å; A297-I301 WeakPolarHBondContact O-CD1 3.25Å; A297-I301 VanDerWaalsContact O-CG1 3.23Å; A297-I301 WeakPolarHBondContact O-CG1 3.29Å; A297-I301 PolarHBondContact O-N 2.76Å; F298-I301 PolarHBondContact O-N 3.13Å; I301-D303 VanDerWaalsContact C-N 3.31Å; I301-D303 PolarHBondContact O-N 3.49Å; I301-C304 PolarHBondContact O-N 3.07Å; I301-A305 VanDerWaalsContact O-CB 3.26Å; I301-A305 WeakPolarHBondContact O-CB 3.37Å; I301-A305 PolarHBondContact O-N 3.24Å; I301-L316 HydrophobicContact CG2-CD2 4.3Å; I301-F364 HydrophobicContact CD1-CB 3.63Å; I301-F364 HydrophobicContact CD1-CD1 4.1Å; I301-F364 HydrophobicContact CD1-CD2 3.97Å; I301-F364 HydrophobicContact CD1-CG 3.62Å; I301-F364 HydrophobicContact CG1-CB 3.86Å; I301-F364 HydrophobicContact CG1-CG 4.3Å; I301-F364 HydrophobicContact CG2-CB 4.33Å; I301-F364 HydrophobicContact CG2-CD1 3.97Å; I301-F364 HydrophobicContact CG2-CG 4.41Å
302	G	95.4	Very high	94.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-36.6	175	0	0	0	0	0	113.4	R278 F298 N299 Q300	R278-G302 VanDerWaalsContact CZ-O 3.29Å; R278-G302 PolarHBondContact NE-O 2.72Å; R278-G302 PolarHBondContact NH2-O 3.06Å; F298-G302 PolarHBondContact O-N 3.04Å; N299-G302 PolarHBondContact O-N 3.42Å; Q300-G302 VanDerWaalsContact C-N 3.27Å; Q300-G302 PolarHBondContact O-N 2.83Å
303	D	95.4	Very high	95	Very high	76 Å²	76	43.9 Å²	43.9	41%	0.406	24%	0.242	S	C	.	.	H	α-helix	trans	-68.8	-48	173.4	-72.1	-37.7	0	0	0	111.4	K275 N299 Q300 I301 A305 E306	K275-D303 WeakPolarHBondContact CD-OD1 3.33Å; K275-D303 WeakPolarHBondContact CE-OD1 3.19Å; K275-D303 WeakPolarHBondContact CE-OD2 3.34Å; K275-D303 IonicContact NZ-OD1 2.71Å; K275-D303 PolarHBondContact NZ-OD1 3.36Å; K275-D303 IonicContact NZ-OD2 3.47Å; K275-D303 PolarHBondContact NZ-OD2 3.12Å; N299-D303 PolarHBondContact O-N 3.35Å; Q300-D303 PolarHBondContact O-N 3.33Å; I301-D303 VanDerWaalsContact C-N 3.31Å; I301-D303 PolarHBondContact O-N 3.49Å; D303-A305 PolarHBondContact O-N 2.64Å; D303-E306 PolarHBondContact O-N 2.75Å
304	C	94.6	Very high	95.1	Very high	72 Å²	72	48.3 Å²	48.3	49%	0.486	26%	0.26	S	S	.	.	H	α-helix	trans	-67.9	-21.8	179.9	-62.1	0	0	0	0	114.1	Q300 I301 E306 L368	Q300-C304 PolarHBondContact O-N 3.21Å; Q300-C304 PolarHBondContact O-SG 2.83Å; Q300-C304 VanDerWaalsContact O-SG 3.38Å; I301-C304 PolarHBondContact O-N 3.07Å; C304-E306 VanDerWaalsContact C-N 3.28Å; C304-E306 PolarHBondContact O-N 3.47Å; C304-L368 HydrophobicContact CB-CD1 3.53Å; C304-L368 HydrophobicContact CB-CD2 4.49Å
305	A	94.8	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	23.4	178	0	0	0	0	0	113.2	R278 I301 D303 G307 F308 L313 L316	R278-A305 WeakPolarHBondContact CD-O 3.19Å; R278-A305 PolarHBondContact NE-O 3.34Å; I301-A305 VanDerWaalsContact O-CB 3.26Å; I301-A305 WeakPolarHBondContact O-CB 3.37Å; I301-A305 PolarHBondContact O-N 3.24Å; D303-A305 PolarHBondContact O-N 2.64Å; A305-G307 PolarHBondContact O-N 2.93Å; A305-F308 HydrophobicContact CB-CB 4.36Å; A305-F308 HydrophobicContact CB-CD1 4.27Å; A305-F308 HydrophobicContact CB-CD2 4.3Å; A305-F308 HydrophobicContact CB-CG 4.06Å; A305-F308 VanDerWaalsContact O-CB 3.28Å; A305-F308 WeakPolarHBondContact O-CB 3.45Å; A305-F308 WeakPolarHBondContact O-CD1 3.3Å; A305-F308 PolarHBondContact O-N 3.35Å; A305-L313 HydrophobicContact CB-CD2 3.78Å; A305-L316 HydrophobicContact CB-CD2 4.43Å
306	E	94.6	Very high	95.4	Very high	151 Å²	151	45.4 Å²	45.4	71%	0.706	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	135.9	173.2	-172.2	172.5	-163.6	0	0	111.6	D303 C304 F308	D303-E306 PolarHBondContact O-N 2.75Å; C304-E306 VanDerWaalsContact C-N 3.28Å; C304-E306 PolarHBondContact O-N 3.47Å; E306-F308 VanDerWaalsContact C-N 3.3Å; E306-F308 PolarHBondContact O-N 3.13Å
307	G	94.2	Very high	95.4	Very high	27 Å²	27	37.7 Å²	37.7	28%	0.278	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-4.6	-176.3	0	0	0	0	0	115.6	A305	A305-G307 PolarHBondContact O-N 2.93Å
308	F	96.4	Very high	95.5	Very high	9 Å²	9	43.4 Å²	43.4	4%	0.039	23%	0.231	C	C	.	.			trans	-75.5	136.3	178.9	-78.3	46.5	0	0	0	111.1	P273 A305 E306 D312 L313 L316 L368 C371 P373	P273-F308 WeakPolarHBondContact CD-O 3.28Å; P273-F308 VanDerWaalsContact CG-O 3.25Å; P273-F308 WeakPolarHBondContact CG-O 3.38Å; A305-F308 HydrophobicContact CB-CB 4.36Å; A305-F308 HydrophobicContact CB-CD1 4.27Å; A305-F308 HydrophobicContact CB-CD2 4.3Å; A305-F308 HydrophobicContact CB-CG 4.06Å; A305-F308 VanDerWaalsContact O-CB 3.28Å; A305-F308 WeakPolarHBondContact O-CB 3.45Å; A305-F308 WeakPolarHBondContact O-CD1 3.3Å; A305-F308 PolarHBondContact O-N 3.35Å; E306-F308 VanDerWaalsContact C-N 3.3Å; E306-F308 PolarHBondContact O-N 3.13Å; F308-D312 HydrophobicContact CB-CB 3.9Å; F308-D312 HydrophobicContact CD2-CB 3.59Å; F308-D312 HydrophobicContact CE2-CB 4.38Å; F308-D312 HydrophobicContact CG-CB 3.95Å; F308-L313 HydrophobicContact CB-CD2 4.03Å; F308-L313 HydrophobicContact CB-CG 4.21Å; F308-L313 HydrophobicContact CD2-CD2 4.25Å; F308-L313 HydrophobicContact CG-CD2 4.5Å; F308-L316 HydrophobicContact CD2-CD2 4.5Å; F308-L316 HydrophobicContact CE2-CB 4.36Å; F308-L316 HydrophobicContact CE2-CD2 4.25Å; F308-L368 HydrophobicContact CE2-CD2 4.23Å; F308-L368 HydrophobicContact CZ-CD2 3.89Å; F308-C371 HydrophobicContact CE2-CB 4.1Å; F308-C371 HydrophobicContact CZ-CB 4.33Å; F308-P373 HydrophobicContact CD1-CB 4.39Å; F308-P373 HydrophobicContact CD1-CG 3.8Å; F308-P373 HydrophobicContact CE1-CG 3.68Å
309	S	95.6	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.			trans	-74.6	165.6	165.3	69.4	0	0	0	0	111.5	N148 S311 D312 L313	N148-S309 VanDerWaalsContact OD1-CA 3.29Å; N148-S309 WeakPolarHBondContact OD1-CA 3.35Å; N148-S309 VanDerWaalsContact OD1-CB 3.31Å; N148-S309 WeakPolarHBondContact OD1-CB 3.41Å; S309-S311 PolarHBondContact O-N 3.34Å; S309-S311 VanDerWaalsContact O-N 3.16Å; S309-S311 PolarHBondContact OG-N 3.25Å; S309-D312 WeakPolarHBondContact CB-OD2 3.43Å; S309-D312 PolarHBondContact N-OD2 3.03Å; S309-D312 PolarHBondContact O-N 3.48Å; S309-D312 PolarHBondContact OG-N 3.31Å; S309-D312 VanDerWaalsContact OG-N 3.14Å; S309-D312 PolarHBondContact OG-OD2 3.24Å; S309-L313 PolarHBondContact O-N 2.82Å
310	F	94.9	Very high	95.4	Very high	18 Å²	18	41.6 Å²	41.6	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-28.4	172.3	-67.2	-47.5	0	0	0	112.9	V107 G147 N148 P273 E277 M281 L313 K314	V107-F310 HydrophobicContact CB-CE1 4.12Å; V107-F310 HydrophobicContact CB-CZ 3.92Å; V107-F310 HydrophobicContact CG1-CE1 4Å; V107-F310 HydrophobicContact CG1-CZ 3.95Å; G147-F310 WeakPolarHBondContact O-CB 3.38Å; N148-F310 HydrophobicContact CB-CD2 4.44Å; N148-F310 PolarHBondContact OD1-N 3.19Å; P273-F310 HydrophobicContact CB-CD1 4.02Å; P273-F310 HydrophobicContact CB-CE1 3.42Å; P273-F310 VanDerWaalsContact CB-CE1 3.42Å; P273-F310 HydrophobicContact CB-CZ 3.71Å; P273-F310 HydrophobicContact CG-CD1 3.98Å; P273-F310 HydrophobicContact CG-CE1 3.92Å; P273-F310 HydrophobicContact CG-CZ 4.43Å; E277-F310 HydrophobicContact CB-CE1 4.32Å; E277-F310 HydrophobicContact CB-CZ 4.33Å; M281-F310 HydrophobicContact CB-CD1 3.95Å; M281-F310 HydrophobicContact CB-CE1 4.06Å; M281-F310 HydrophobicContact CE-CB 4.48Å; M281-F310 HydrophobicContact CG-CD1 3.78Å; M281-F310 HydrophobicContact CG-CE1 4.36Å; M281-F310 HydrophobicContact SD-CD1 4.29Å; F310-L313 HydrophobicContact CD1-CD1 4.2Å; F310-K314 PolarHBondContact O-N 2.92Å; F310-K314 VanDerWaalsContact O-N 3.13Å
311	S	93.5	Very high	95.4	Very high	57 Å²	57	39.9 Å²	39.9	40%	0.399	22%	0.22	S	C	.	.	H	α-helix	trans	-71.4	-39.3	174.6	-63.6	0	0	0	0	111.9	G147 S309 K314 V315	G147-S311 WeakPolarHBondContact CA-OG 3.42Å; G147-S311 PolarHBondContact O-N 2.9Å; G147-S311 PolarHBondContact O-OG 2.55Å; G147-S311 VanDerWaalsContact O-OG 3.13Å; S309-S311 PolarHBondContact O-N 3.34Å; S309-S311 VanDerWaalsContact O-N 3.16Å; S309-S311 PolarHBondContact OG-N 3.25Å; S311-K314 WeakPolarHBondContact O-CB 3.45Å; S311-K314 PolarHBondContact O-N 3.24Å; S311-V315 WeakPolarHBondContact O-CG2 3.46Å; S311-V315 PolarHBondContact O-N 2.88Å
312	D	96.6	Very high	95.2	Very high	18 Å²	18	43.7 Å²	43.7	10%	0.096	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-40.7	174.9	-56.1	-37.7	0	0	0	111	F308 S309 K314 V315 L316 S374	F308-D312 HydrophobicContact CB-CB 3.9Å; F308-D312 HydrophobicContact CD2-CB 3.59Å; F308-D312 HydrophobicContact CE2-CB 4.38Å; F308-D312 HydrophobicContact CG-CB 3.95Å; S309-D312 WeakPolarHBondContact CB-OD2 3.43Å; S309-D312 PolarHBondContact N-OD2 3.03Å; S309-D312 PolarHBondContact O-N 3.48Å; S309-D312 PolarHBondContact OG-N 3.31Å; S309-D312 VanDerWaalsContact OG-N 3.14Å; S309-D312 PolarHBondContact OG-OD2 3.24Å; D312-K314 VanDerWaalsContact C-N 3.28Å; D312-K314 PolarHBondContact O-N 2.75Å; D312-V315 CarbonylContact O-C 3.59Å; D312-V315 PolarHBondContact O-N 2.89Å; D312-V315 VanDerWaalsContact O-N 3.15Å; D312-L316 WeakPolarHBondContact O-CB 3.27Å; D312-L316 PolarHBondContact O-N 3.46Å; D312-S374 VanDerWaalsContact CG-OG 3.24Å; D312-S374 WeakPolarHBondContact OD1-CB 3.46Å; D312-S374 PolarHBondContact OD1-OG 2.94Å; D312-S374 PolarHBondContact OD2-N 2.71Å; D312-S374 PolarHBondContact OD2-OG 3.33Å
313	L	96.4	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-36.1	174	-67.5	177.9	0	0	0	112.6	R278 M281 L282 A305 F308 S309 F310 L316 A317	R278-L313 HydrophobicContact CB-CD1 4Å; R278-L313 HydrophobicContact CG-CD1 3.98Å; M281-L313 HydrophobicContact CB-CD1 3.99Å; M281-L313 HydrophobicContact CG-CB 4.46Å; M281-L313 HydrophobicContact CG-CD1 4.03Å; L282-L313 HydrophobicContact CD2-CD2 4.43Å; L282-L313 HydrophobicContact CG-CD2 4.48Å; A305-L313 HydrophobicContact CB-CD2 3.78Å; F308-L313 HydrophobicContact CB-CD2 4.03Å; F308-L313 HydrophobicContact CB-CG 4.21Å; F308-L313 HydrophobicContact CD2-CD2 4.25Å; F308-L313 HydrophobicContact CG-CD2 4.5Å; S309-L313 PolarHBondContact O-N 2.82Å; F310-L313 HydrophobicContact CD1-CD1 4.2Å; L313-L316 HydrophobicContact CD2-CD2 4.37Å; L313-L316 PolarHBondContact O-N 3.1Å; L313-A317 WeakPolarHBondContact O-CB 3.48Å; L313-A317 PolarHBondContact O-N 3.46Å
314	K	95.1	Very high	95	Very high	108 Å²	108	41.6 Å²	41.6	47%	0.47	23%	0.227	S	C	.	.	H	α-helix	trans	-67	-39.4	174.5	-174.4	176.6	-177.5	175.2	0	111.5	L285 F310 S311 D312 K318	L285-K314 HydrophobicContact CD1-CB 4.38Å; L285-K314 HydrophobicContact CD2-CG 4.22Å; F310-K314 PolarHBondContact O-N 2.92Å; F310-K314 VanDerWaalsContact O-N 3.13Å; S311-K314 WeakPolarHBondContact O-CB 3.45Å; S311-K314 PolarHBondContact O-N 3.24Å; D312-K314 VanDerWaalsContact C-N 3.28Å; D312-K314 PolarHBondContact O-N 2.75Å; K314-K318 VanDerWaalsContact O-CG 3.31Å; K314-K318 WeakPolarHBondContact O-CG 3.21Å; K314-K318 PolarHBondContact O-N 3.28Å; K314-K318 VanDerWaalsContact O-N 3.08Å
315	V	96.1	Very high	94.7	Very high	82 Å²	82	40.7 Å²	40.7	50%	0.497	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-45.3	173.4	174.6	0	0	0	0	110.2	S311 D312 A317 K318 E319	S311-V315 WeakPolarHBondContact O-CG2 3.46Å; S311-V315 PolarHBondContact O-N 2.88Å; D312-V315 CarbonylContact O-C 3.59Å; D312-V315 PolarHBondContact O-N 2.89Å; D312-V315 VanDerWaalsContact O-N 3.15Å; V315-A317 PolarHBondContact O-N 3.09Å; V315-K318 WeakPolarHBondContact O-CB 3.39Å; V315-K318 PolarHBondContact O-N 3.06Å; V315-K318 VanDerWaalsContact O-N 3.17Å; V315-E319 WeakPolarHBondContact O-CB 3.23Å; V315-E319 PolarHBondContact O-N 3.01Å
316	L	96.7	Very high	94.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.9	-47.4	176.6	177.4	66.3	0	0	0	111.8	I301 A305 F308 D312 L313 K318 E319 A320 F364 A367 L368 C371	I301-L316 HydrophobicContact CG2-CD2 4.3Å; A305-L316 HydrophobicContact CB-CD2 4.43Å; F308-L316 HydrophobicContact CD2-CD2 4.5Å; F308-L316 HydrophobicContact CE2-CB 4.36Å; F308-L316 HydrophobicContact CE2-CD2 4.25Å; D312-L316 WeakPolarHBondContact O-CB 3.27Å; D312-L316 PolarHBondContact O-N 3.46Å; L313-L316 HydrophobicContact CD2-CD2 4.37Å; L313-L316 PolarHBondContact O-N 3.1Å; L316-K318 VanDerWaalsContact C-N 3.35Å; L316-K318 PolarHBondContact O-N 3.08Å; L316-E319 PolarHBondContact O-N 3.04Å; L316-A320 WeakPolarHBondContact O-CB 3.36Å; L316-A320 PolarHBondContact O-N 3.36Å; L316-F364 HydrophobicContact CD2-CD1 4.36Å; L316-F364 HydrophobicContact CG-CD1 4.16Å; L316-A367 HydrophobicContact CD1-CB 3.61Å; L316-L368 HydrophobicContact CD1-CB 4.49Å; L316-L368 HydrophobicContact CD1-CD2 3.89Å; L316-L368 HydrophobicContact CD1-CG 3.79Å; L316-L368 HydrophobicContact CD2-CD2 3.88Å; L316-L368 HydrophobicContact CD2-CG 4.29Å; L316-C371 HydrophobicContact CD1-CB 4.23Å
317	A	96.2	Very high	94.1	Very high	9 Å²	9	39.6 Å²	39.6	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-38.1	178	0	0	0	0	0	112.4	L285 L313 V315 A321 F364	L285-A317 HydrophobicContact CB-CB 4.32Å; L285-A317 HydrophobicContact CD1-CB 3.9Å; L313-A317 WeakPolarHBondContact O-CB 3.48Å; L313-A317 PolarHBondContact O-N 3.46Å; V315-A317 PolarHBondContact O-N 3.09Å; A317-A321 VanDerWaalsContact O-CB 3.31Å; A317-A321 WeakPolarHBondContact O-CB 3.08Å; A317-A321 PolarHBondContact O-N 3.29Å; A317-F364 HydrophobicContact CB-CE1 4.39Å
318	K	95.5	Very high	93.7	Very high	133 Å²	133	39.8 Å²	39.8	58%	0.578	21%	0.214	S	C	*	.	H	α-helix	trans	-64.2	-42.2	173.5	-77.5	177.3	173	-168.5	0	111.8	K314 V315 L316 A321 M322	K314-K318 VanDerWaalsContact O-CG 3.31Å; K314-K318 WeakPolarHBondContact O-CG 3.21Å; K314-K318 PolarHBondContact O-N 3.28Å; K314-K318 VanDerWaalsContact O-N 3.08Å; V315-K318 WeakPolarHBondContact O-CB 3.39Å; V315-K318 PolarHBondContact O-N 3.06Å; V315-K318 VanDerWaalsContact O-N 3.17Å; L316-K318 VanDerWaalsContact C-N 3.35Å; L316-K318 PolarHBondContact O-N 3.08Å; K318-A321 WeakPolarHBondContact O-CB 3.31Å; K318-A321 PolarHBondContact O-N 3.34Å; K318-M322 WeakPolarHBondContact O-CG 3.47Å; K318-M322 PolarHBondContact O-N 2.78Å
319	E	95.7	Very high	93	Very high	34 Å²	34	41.1 Å²	41.1	16%	0.159	22%	0.223	C	C	.	.	H	α-helix	trans	-67.2	-43.3	-179.3	-176.4	57.3	-157.9	0	0	111.1	V315 L316 A321 M322 R326 A367 Q370	V315-E319 WeakPolarHBondContact O-CB 3.23Å; V315-E319 PolarHBondContact O-N 3.01Å; L316-E319 PolarHBondContact O-N 3.04Å; E319-A321 VanDerWaalsContact C-N 3.3Å; E319-A321 PolarHBondContact O-N 2.78Å; E319-M322 WeakPolarHBondContact O-CB 3.05Å; E319-M322 PolarHBondContact O-N 2.95Å; E319-M322 VanDerWaalsContact O-N 3.16Å; E319-R326 PolarHBondContact O-NH1 3.4Å; E319-R326 IonicContact OE1-CZ 3.84Å; E319-R326 IonicContact OE1-NH1 3.94Å; E319-R326 PolarHBondContact OE1-NH1 3.25Å; E319-R326 IonicContact OE1-NH2 2.67Å; E319-R326 PolarHBondContact OE1-NH2 3.13Å; E319-R326 IonicContact OE2-CZ 3.75Å; E319-R326 IonicContact OE2-NH1 2.72Å; E319-R326 IonicContact OE2-NH2 2.85Å; E319-R326 PolarHBondContact OE2-NH2 3.1Å; E319-A367 HydrophobicContact CB-CB 3.94Å; E319-A367 HydrophobicContact CG-CB 3.7Å; E319-Q370 PolarHBondContact OE1-OE1 3.45Å
320	A	95.9	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-37.8	171.4	0	0	0	0	0	112	L316 M322 E323 L359 D363 F364 A367	L316-A320 WeakPolarHBondContact O-CB 3.36Å; L316-A320 PolarHBondContact O-N 3.36Å; A320-M322 PolarHBondContact O-N 3.04Å; A320-E323 WeakPolarHBondContact O-CB 3.3Å; A320-E323 PolarHBondContact O-N 3.36Å; A320-E323 VanDerWaalsContact O-N 3.12Å; A320-L359 WeakPolarHBondContact O-CD2 2.94Å; A320-D363 HydrophobicContact CB-CB 4.34Å; A320-F364 HydrophobicContact CB-CD1 3.88Å; A320-F364 HydrophobicContact CB-CD2 3.8Å; A320-F364 HydrophobicContact CB-CE1 3.86Å; A320-F364 HydrophobicContact CB-CE2 3.76Å; A320-F364 HydrophobicContact CB-CG 3.85Å; A320-F364 HydrophobicContact CB-CZ 3.79Å; A320-A367 HydrophobicContact CB-CB 4.06Å
321	A	94.4	Very high	91.9	Very high	40 Å²	40	46.2 Å²	46.2	33%	0.331	26%	0.256	S	S	.	.	H	α-helix	trans	-64	-20.8	177.4	0	0	0	0	0	113.8	A317 K318 E319 L359	A317-A321 VanDerWaalsContact O-CB 3.31Å; A317-A321 WeakPolarHBondContact O-CB 3.08Å; A317-A321 PolarHBondContact O-N 3.29Å; K318-A321 WeakPolarHBondContact O-CB 3.31Å; K318-A321 PolarHBondContact O-N 3.34Å; E319-A321 VanDerWaalsContact C-N 3.3Å; E319-A321 PolarHBondContact O-N 2.78Å; A321-L359 HydrophobicContact CB-CD1 4.5Å
322	M	92.4	Very high	91.2	Very high	84 Å²	84	45.6 Å²	45.6	41%	0.414	25%	0.246	S	C	.	.	H	α-helix	trans	-81	-19.7	175.8	-67.3	-61.5	-66.1	0	0	113.1	K318 E319 A320 L325 R326	K318-M322 WeakPolarHBondContact O-CG 3.47Å; K318-M322 PolarHBondContact O-N 2.78Å; E319-M322 WeakPolarHBondContact O-CB 3.05Å; E319-M322 PolarHBondContact O-N 2.95Å; E319-M322 VanDerWaalsContact O-N 3.16Å; A320-M322 PolarHBondContact O-N 3.04Å; M322-L325 HydrophobicContact CE-CD2 3.88Å; M322-L325 WeakPolarHBondContact O-CB 3.14Å; M322-L325 PolarHBondContact O-N 2.84Å; M322-L325 VanDerWaalsContact O-N 3.13Å; M322-L325 HydrophobicContact SD-CD2 4.48Å; M322-R326 WeakPolarHBondContact O-CG 3.4Å; M322-R326 PolarHBondContact O-N 3.15Å
323	E	93.2	Very high	90.2	Very high	26 Å²	26	45.6 Å²	45.6	12%	0.121	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-44.7	-175.7	-70.5	-71.6	116.2	0	0	113.9	A320 L325 R326 G327 D363 N366	A320-E323 WeakPolarHBondContact O-CB 3.3Å; A320-E323 PolarHBondContact O-N 3.36Å; A320-E323 VanDerWaalsContact O-N 3.12Å; E323-L325 VanDerWaalsContact C-N 3.28Å; E323-L325 PolarHBondContact O-N 3.02Å; E323-R326 PolarHBondContact O-N 3.1Å; E323-R326 IonicContact OE1-CZ 2.74Å; E323-R326 IonicContact OE1-NH1 3.05Å; E323-R326 PolarHBondContact OE1-NH1 2.94Å; E323-G327 PolarHBondContact O-N 3.26Å; E323-D363 HydrophobicContact CB-CB 3.85Å; E323-D363 VanDerWaalsContact CB-OD1 3.28Å; E323-D363 WeakPolarHBondContact CB-OD1 3.39Å; E323-D363 HydrophobicContact CG-CB 3.96Å; E323-N366 PolarHBondContact OE2-ND2 3.17Å; E323-N366 VanDerWaalsContact OE2-ND2 3.08Å
324	P	91.5	Very high	89.5	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.039	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-40.1	174	-26.7	36.4	0	0	0	112.9	G327 I328 L356 R357 L359	P324-G327 PolarHBondContact O-N 3.35Å; P324-I328 WeakPolarHBondContact O-CG1 3.41Å; P324-I328 PolarHBondContact O-N 3.25Å; P324-I328 VanDerWaalsContact O-N 3.17Å; P324-L356 HydrophobicContact CB-CD2 4.15Å; P324-R357 HydrophobicContact CB-CG 3.92Å; P324-R357 HydrophobicContact CG-CG 4.25Å; P324-L359 HydrophobicContact CG-CD2 3.61Å
325	L	89.6	Confident	88.8	Confident	53 Å²	53	54.3 Å²	54.3	28%	0.277	28%	0.284	S	S	.	.	H	α-helix	trans	-68.6	-42.9	179.2	-179.1	60.4	0	0	0	111.3	M322 E323 G327 I328 V329 I351 L356	M322-L325 HydrophobicContact CE-CD2 3.88Å; M322-L325 WeakPolarHBondContact O-CB 3.14Å; M322-L325 PolarHBondContact O-N 2.84Å; M322-L325 VanDerWaalsContact O-N 3.13Å; M322-L325 HydrophobicContact SD-CD2 4.48Å; E323-L325 VanDerWaalsContact C-N 3.28Å; E323-L325 PolarHBondContact O-N 3.02Å; L325-G327 VanDerWaalsContact C-N 3.26Å; L325-G327 PolarHBondContact O-N 3.06Å; L325-I328 PolarHBondContact O-N 2.54Å; L325-V329 HydrophobicContact CD1-CG2 4.43Å; L325-V329 WeakPolarHBondContact O-CB 3.26Å; L325-V329 WeakPolarHBondContact O-CG2 2.82Å; L325-V329 PolarHBondContact O-N 2.8Å; L325-I351 HydrophobicContact CD1-CD1 4.09Å; L325-I351 HydrophobicContact CD1-CG2 4.42Å; L325-L356 HydrophobicContact CB-CD2 4.24Å
326	R	88.6	Confident	87.7	Confident	84 Å²	84	53.9 Å²	53.9	32%	0.317	28%	0.283	S	S	.	.	H	α-helix	trans	-57.6	-40.3	174	-70.8	173.8	-174.1	144.2	0.3	111.6	E319 M322 E323 V329 L330	E319-R326 PolarHBondContact O-NH1 3.4Å; E319-R326 IonicContact OE1-CZ 3.84Å; E319-R326 IonicContact OE1-NH1 3.94Å; E319-R326 PolarHBondContact OE1-NH1 3.25Å; E319-R326 IonicContact OE1-NH2 2.67Å; E319-R326 PolarHBondContact OE1-NH2 3.13Å; E319-R326 IonicContact OE2-CZ 3.75Å; E319-R326 IonicContact OE2-NH1 2.72Å; E319-R326 IonicContact OE2-NH2 2.85Å; E319-R326 PolarHBondContact OE2-NH2 3.1Å; M322-R326 WeakPolarHBondContact O-CG 3.4Å; M322-R326 PolarHBondContact O-N 3.15Å; E323-R326 PolarHBondContact O-N 3.1Å; E323-R326 IonicContact OE1-CZ 2.74Å; E323-R326 IonicContact OE1-NH1 3.05Å; E323-R326 PolarHBondContact OE1-NH1 2.94Å; R326-V329 PolarHBondContact O-N 3.29Å; R326-L330 VanDerWaalsContact O-CB 3.32Å; R326-L330 WeakPolarHBondContact O-CB 3.05Å; R326-L330 PolarHBondContact O-N 2.85Å
327	G	86.9	Confident	86.6	Confident	43 Å²	43	62.1 Å²	62.1	44%	0.443	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-43.7	175.3	0	0	0	0	0	113.5	E323 P324 L325 G331	E323-G327 PolarHBondContact O-N 3.26Å; P324-G327 PolarHBondContact O-N 3.35Å; L325-G327 VanDerWaalsContact C-N 3.26Å; L325-G327 PolarHBondContact O-N 3.06Å; G327-G331 PolarHBondContact O-N 3.24Å
328	I	85.8	Confident	85.2	Confident	32 Å²	32	63.9 Å²	63.9	16%	0.164	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-47.4	176.7	-66.4	173.2	0	0	0	110.7	P324 L325 G331 F332 I351 Q355 L356	P324-I328 WeakPolarHBondContact O-CG1 3.41Å; P324-I328 PolarHBondContact O-N 3.25Å; P324-I328 VanDerWaalsContact O-N 3.17Å; L325-I328 PolarHBondContact O-N 2.54Å; I328-G331 PolarHBondContact O-N 2.92Å; I328-F332 HydrophobicContact CG2-CD2 3.74Å; I328-F332 HydrophobicContact CG2-CE2 3.58Å; I328-F332 VanDerWaalsContact O-CD2 3.27Å; I328-F332 WeakPolarHBondContact O-CD2 2.96Å; I328-F332 PolarHBondContact O-N 2.87Å; I328-I351 HydrophobicContact CD1-CG2 4.21Å; I328-I351 HydrophobicContact CG2-CD1 3.77Å; I328-I351 HydrophobicContact CG2-CG1 4.06Å; I328-I351 HydrophobicContact CG2-CG2 4.38Å; I328-Q355 HydrophobicContact CD1-CB 4.25Å; I328-L356 HydrophobicContact CD1-CD2 3.74Å
329	V	83.5	Confident	83.7	Confident	37 Å²	37	65.8 Å²	65.8	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-55.3	-51.6	176.8	153.7	0	0	0	0	110.8	L325 R326 G331 F332 L333 L343 L348	L325-V329 HydrophobicContact CD1-CG2 4.43Å; L325-V329 WeakPolarHBondContact O-CB 3.26Å; L325-V329 WeakPolarHBondContact O-CG2 2.82Å; L325-V329 PolarHBondContact O-N 2.8Å; R326-V329 PolarHBondContact O-N 3.29Å; V329-G331 VanDerWaalsContact C-N 3.32Å; V329-G331 PolarHBondContact O-N 3.32Å; V329-F332 WeakPolarHBondContact O-CB 3.11Å; V329-F332 PolarHBondContact O-N 3.17Å; V329-F332 VanDerWaalsContact O-N 3.13Å; V329-L333 HydrophobicContact CG1-CD1 4.32Å; V329-L333 PolarHBondContact O-N 3.42Å; V329-L343 HydrophobicContact CB-CD1 3.99Å; V329-L343 HydrophobicContact CG1-CD1 3.32Å; V329-L343 HydrophobicContact CG2-CD1 4.14Å; V329-L343 HydrophobicContact CG2-CD2 4.1Å; V329-L348 HydrophobicContact CG2-CD2 4.25Å
330	L	83.6	Confident	82.3	Confident	101 Å²	101	67.1 Å²	67.1	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-41.8	178.1	-176.1	62.1	0	0	0	111.7	R326 F332 L333 I334	R326-L330 VanDerWaalsContact O-CB 3.32Å; R326-L330 WeakPolarHBondContact O-CB 3.05Å; R326-L330 PolarHBondContact O-N 2.85Å; L330-F332 VanDerWaalsContact C-N 3.31Å; L330-F332 PolarHBondContact O-N 3.11Å; L330-L333 PolarHBondContact O-N 2.89Å; L330-I334 HydrophobicContact CD1-CD1 4.33Å; L330-I334 HydrophobicContact CG-CD1 4Å; L330-I334 VanDerWaalsContact O-CG1 3.32Å; L330-I334 WeakPolarHBondContact O-CG1 3.35Å; L330-I334 PolarHBondContact O-N 3.25Å
331	G	83.2	Confident	80.7	Confident	23 Å²	23	74.8 Å²	74.8	24%	0.237	40%	0.401	C	S	.	.	H	α-helix	trans	-61.9	-34.7	175.5	0	0	0	0	0	113.7	G327 I328 V329 R335	G327-G331 PolarHBondContact O-N 3.24Å; I328-G331 PolarHBondContact O-N 2.92Å; V329-G331 VanDerWaalsContact C-N 3.32Å; V329-G331 PolarHBondContact O-N 3.32Å; G331-R335 WeakPolarHBondContact O-CG 3.36Å; G331-R335 PolarHBondContact O-N 3.44Å; G331-R335 PolarHBondContact O-NE 3.34Å
332	F	78.5	Confident	79.3	Confident	45 Å²	45	80.1 Å²	80.1	20%	0.197	42%	0.419	C	S	.	.	H	α-helix	trans	-67.8	-46.9	172	-85.8	-70.7	0	0	0	112.1	I328 V329 L330 I334 R335 C336 L343 I351	I328-F332 HydrophobicContact CG2-CD2 3.74Å; I328-F332 HydrophobicContact CG2-CE2 3.58Å; I328-F332 VanDerWaalsContact O-CD2 3.27Å; I328-F332 WeakPolarHBondContact O-CD2 2.96Å; I328-F332 PolarHBondContact O-N 2.87Å; V329-F332 WeakPolarHBondContact O-CB 3.11Å; V329-F332 PolarHBondContact O-N 3.17Å; V329-F332 VanDerWaalsContact O-N 3.13Å; L330-F332 VanDerWaalsContact C-N 3.31Å; L330-F332 PolarHBondContact O-N 3.11Å; F332-I334 VanDerWaalsContact C-N 3.31Å; F332-I334 PolarHBondContact O-N 3.18Å; F332-R335 PolarHBondContact O-N 2.69Å; F332-C336 WeakPolarHBondContact O-CB 3.19Å; F332-C336 PolarHBondContact O-N 3.3Å; F332-C336 PolarHBondContact O-SG 3.43Å; F332-L343 HydrophobicContact CB-CD2 4.43Å; F332-I351 HydrophobicContact CE2-CD1 4.4Å; F332-I351 HydrophobicContact CE2-CG1 4.1Å
333	L	76.2	Confident	77.9	Confident	17 Å²	17	77.4 Å²	77.4	9%	0.089	41%	0.406	C	S	.	.	H	α-helix	trans	-58.4	-43.7	179.2	-68.7	172.2	0	0	0	111.7	V329 L330 C336 Q337 C338 S340 L341 L343	V329-L333 HydrophobicContact CG1-CD1 4.32Å; V329-L333 PolarHBondContact O-N 3.42Å; L330-L333 PolarHBondContact O-N 2.89Å; L333-C336 PolarHBondContact O-N 2.89Å; L333-Q337 PolarHBondContact O-N 3.45Å; L333-Q337 VanDerWaalsContact O-N 3.11Å; L333-C338 HydrophobicContact CB-CB 4.39Å; L333-C338 HydrophobicContact CD2-CB 3.52Å; L333-C338 PolarHBondContact O-N 3.27Å; L333-C338 VanDerWaalsContact O-N 3.08Å; L333-S340 WeakPolarHBondContact CD2-O 3.41Å; L333-L341 HydrophobicContact CD1-CG 4.45Å; L333-L343 HydrophobicContact CD1-CD1 3.95Å; L333-L343 HydrophobicContact CD2-CD1 3.75Å; L333-L343 HydrophobicContact CD2-CG 4.36Å; L333-L343 HydrophobicContact CG-CD1 3.63Å
334	I	81.3	Confident	76.4	Confident	120 Å²	120	79.4 Å²	79.4	62%	0.615	42%	0.421	S	S	*	.	H	α-helix	trans	-62.5	-46.3	177	-66.6	167.3	0	0	0	111	L330 F332 C336 Q337	L330-I334 HydrophobicContact CD1-CD1 4.33Å; L330-I334 HydrophobicContact CG-CD1 4Å; L330-I334 VanDerWaalsContact O-CG1 3.32Å; L330-I334 WeakPolarHBondContact O-CG1 3.35Å; L330-I334 PolarHBondContact O-N 3.25Å; F332-I334 VanDerWaalsContact C-N 3.31Å; F332-I334 PolarHBondContact O-N 3.18Å; I334-C336 VanDerWaalsContact C-N 3.33Å; I334-C336 PolarHBondContact O-N 3.32Å; I334-Q337 PolarHBondContact O-N 3.05Å
335	R	80.5	Confident	75.4	Confident	172 Å²	172	84 Å²	84	65%	0.649	45%	0.449	S	S	*	.	H	α-helix	trans	-65.1	-35.4	179.4	-77.2	-172.5	-64.3	-116.9	-0	113.1	G331 F332 Q337	G331-R335 WeakPolarHBondContact O-CG 3.36Å; G331-R335 PolarHBondContact O-N 3.44Å; G331-R335 PolarHBondContact O-NE 3.34Å; F332-R335 PolarHBondContact O-N 2.69Å; R335-Q337 VanDerWaalsContact C-N 3.33Å
336	C	73.5	Confident	74.5	Confident	73 Å²	73	86.1 Å²	86.1	49%	0.493	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.6	-178.7	-67.1	0	0	0	0	113.6	F332 L333 I334 C338	F332-C336 WeakPolarHBondContact O-CB 3.19Å; F332-C336 PolarHBondContact O-N 3.3Å; F332-C336 PolarHBondContact O-SG 3.43Å; L333-C336 PolarHBondContact O-N 2.89Å; I334-C336 VanDerWaalsContact C-N 3.33Å; I334-C336 PolarHBondContact O-N 3.32Å; C336-C338 WeakPolarHBondContact CB-SG 3.44Å; C336-C338 PolarHBondContact O-N 3.46Å
337	Q	73.8	Confident	73.5	Confident	173 Å²	173	83.1 Å²	83.1	81%	0.808	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	33.8	-173.3	-58.9	-178.9	-3	0	0	112.7	L333 I334 R335 I339	L333-Q337 PolarHBondContact O-N 3.45Å; L333-Q337 VanDerWaalsContact O-N 3.11Å; I334-Q337 PolarHBondContact O-N 3.05Å; R335-Q337 VanDerWaalsContact C-N 3.33Å; Q337-I339 PolarHBondContact O-N 3.33Å
338	C	65.2	Low	72.8	Confident	45 Å²	45	85 Å²	85	30%	0.304	45%	0.452	S	S	.	.			trans	-71.1	120.6	178.2	-65.6	0	0	0	0	109.2	L333 C336	L333-C338 HydrophobicContact CB-CB 4.39Å; L333-C338 HydrophobicContact CD2-CB 3.52Å; L333-C338 PolarHBondContact O-N 3.27Å; L333-C338 VanDerWaalsContact O-N 3.08Å; C336-C338 WeakPolarHBondContact CB-SG 3.44Å; C336-C338 PolarHBondContact O-N 3.46Å
339	I	64.3	Low	72.5	Confident	174 Å²	174	89.2 Å²	89.2	89%	0.892	47%	0.469	S	S	*	.	S	Bend	trans	-78.2	-30.6	175.4	-58.9	169.6	0	0	0	110.3	Q337	Q337-I339 PolarHBondContact O-N 3.33Å
340	S	66.1	Low	72.2	Confident	62 Å²	62	94.5 Å²	94.5	43%	0.434	49%	0.489	S	S	.	.	S	Bend	trans	-87.9	146.6	175.5	52.8	0	0	0	0	111.5	L333 E342	L333-S340 WeakPolarHBondContact CD2-O 3.41Å; S340-E342 PolarHBondContact O-N 3.06Å; S340-E342 VanDerWaalsContact O-N 3.11Å
341	L	63.2	Low	72	Confident	161 Å²	161	91.2 Å²	91.2	84%	0.843	47%	0.472	S	S	*	.	S	Bend	trans	-70.5	5.8	171.1	-103.6	88.9	0	0	0	113.5	L333 L343	L333-L341 HydrophobicContact CD1-CG 4.45Å; L341-L343 PolarHBondContact O-N 3.49Å
342	E	64.3	Low	72	Confident	152 Å²	152	96.5 Å²	96.5	71%	0.71	49%	0.488	S	S	*	.			trans	-82.7	101.8	-179.6	-66	-179.4	170.3	0	0	109	S340 P344	S340-E342 PolarHBondContact O-N 3.06Å; S340-E342 VanDerWaalsContact O-N 3.11Å; E342-P344 WeakPolarHBondContact O-CD 3.27Å
343	L	62.6	Low	72.3	Confident	27 Å²	27	100 Å²	100	14%	0.141	51%	0.513	C	S	.	.			trans	-67.4	131	166	-106.1	89.4	0	0	0	109	V329 F332 L333 L341 V345 C347 L348	V329-L343 HydrophobicContact CB-CD1 3.99Å; V329-L343 HydrophobicContact CG1-CD1 3.32Å; V329-L343 HydrophobicContact CG2-CD1 4.14Å; V329-L343 HydrophobicContact CG2-CD2 4.1Å; F332-L343 HydrophobicContact CB-CD2 4.43Å; L333-L343 HydrophobicContact CD1-CD1 3.95Å; L333-L343 HydrophobicContact CD2-CD1 3.75Å; L333-L343 HydrophobicContact CD2-CG 4.36Å; L333-L343 HydrophobicContact CG-CD1 3.63Å; L341-L343 PolarHBondContact O-N 3.49Å; L343-V345 PolarHBondContact O-N 3.08Å; L343-C347 HydrophobicContact CD2-CB 3.91Å; L343-L348 HydrophobicContact CB-CG 4.48Å; L343-L348 HydrophobicContact CD2-CD2 3.87Å; L343-L348 HydrophobicContact CD2-CG 4.2Å
344	P	63.1	Low	72.7	Confident	68 Å²	68	106.7 Å²	106.7	44%	0.442	54%	0.544	S	S	.	.			trans	-53.3	129.6	163.1	-22.9	33	0	0	0	109.3	E342 D346 C347	E342-P344 WeakPolarHBondContact O-CD 3.27Å; P344-D346 PolarHBondContact O-N 3.28Å; P344-C347 VanDerWaalsContact O-CB 3.29Å; P344-C347 WeakPolarHBondContact O-CB 3.43Å; P344-C347 PolarHBondContact O-N 3.32Å
345	V	69.8	Low	72.8	Confident	102 Å²	102	106.2 Å²	106.2	62%	0.618	54%	0.539	S	S	*	.	H	α-helix	trans	-54.9	-30.5	-176.2	-177.8	0	0	0	0	111.5	L343 C347 L348 K349	L343-V345 PolarHBondContact O-N 3.08Å; V345-C347 VanDerWaalsContact C-N 3.27Å; V345-C347 PolarHBondContact O-N 3.47Å; V345-L348 WeakPolarHBondContact O-CB 3.39Å; V345-L348 PolarHBondContact O-N 3.08Å; V345-L348 VanDerWaalsContact O-N 3.15Å; V345-K349 PolarHBondContact O-N 3.38Å
346	D	70.4	Confident	73.1	Confident	97 Å²	97	100.8 Å²	100.8	52%	0.519	52%	0.522	S	S	.	.	H	α-helix	trans	-66.5	-26.3	177.1	-62.1	-36.8	0	0	0	113.8	P344 K349 K350	P344-D346 PolarHBondContact O-N 3.28Å; D346-K349 IonicContact OD1-NZ 3.71Å; D346-K349 PolarHBondContact OD1-NZ 3.13Å; D346-K350 WeakPolarHBondContact O-CG 3.21Å
347	C	68.5	Low	74	Confident	22 Å²	22	102.3 Å²	102.3	15%	0.149	52%	0.517	C	S	.	.	H	α-helix	trans	-70	-37	173.1	-67.6	0	0	0	0	111.2	L343 P344 V345 K350	L343-C347 HydrophobicContact CD2-CB 3.91Å; P344-C347 VanDerWaalsContact O-CB 3.29Å; P344-C347 WeakPolarHBondContact O-CB 3.43Å; P344-C347 PolarHBondContact O-N 3.32Å; V345-C347 VanDerWaalsContact C-N 3.27Å; V345-C347 PolarHBondContact O-N 3.47Å; C347-K350 PolarHBondContact O-N 3.01Å
348	L	72.1	Confident	75	Confident	81 Å²	81	96.9 Å²	96.9	42%	0.424	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-38.6	177.4	-67.1	173.1	0	0	0	111.9	V329 L343 V345 K350 I351	V329-L348 HydrophobicContact CG2-CD2 4.25Å; L343-L348 HydrophobicContact CB-CG 4.48Å; L343-L348 HydrophobicContact CD2-CD2 3.87Å; L343-L348 HydrophobicContact CD2-CG 4.2Å; V345-L348 WeakPolarHBondContact O-CB 3.39Å; V345-L348 PolarHBondContact O-N 3.08Å; V345-L348 VanDerWaalsContact O-N 3.15Å; L348-K350 PolarHBondContact O-N 3.15Å; L348-I351 HydrophobicContact CD2-CD1 4.04Å; L348-I351 PolarHBondContact O-N 3.29Å; L348-I351 VanDerWaalsContact O-N 3.12Å
349	K	78.5	Confident	76.4	Confident	122 Å²	122	95 Å²	95	53%	0.53	49%	0.485	S	S	.	.	H	α-helix	trans	-61.6	-24.7	176.5	-68	176.4	-173.5	160.4	0	113.2	V345 D346	V345-K349 PolarHBondContact O-N 3.38Å; D346-K349 IonicContact OD1-NZ 3.71Å; D346-K349 PolarHBondContact OD1-NZ 3.13Å
350	K	77.5	Confident	77.9	Confident	148 Å²	148	88.7 Å²	88.7	64%	0.643	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-15.2	179.1	-67.9	174.4	-175.4	176.8	0	113.2	D346 C347 L348 K352	D346-K350 WeakPolarHBondContact O-CG 3.21Å; C347-K350 PolarHBondContact O-N 3.01Å; L348-K350 PolarHBondContact O-N 3.15Å; K350-K352 PolarHBondContact O-N 2.86Å
351	I	79.6	Confident	79.2	Confident	32 Å²	32	87.2 Å²	87.2	16%	0.164	45%	0.445	C	S	.	.			trans	-75.9	114.4	-178.1	-58.2	174.3	0	0	0	109.1	L325 I328 F332 L348	L325-I351 HydrophobicContact CD1-CD1 4.09Å; L325-I351 HydrophobicContact CD1-CG2 4.42Å; I328-I351 HydrophobicContact CD1-CG2 4.21Å; I328-I351 HydrophobicContact CG2-CD1 3.77Å; I328-I351 HydrophobicContact CG2-CG1 4.06Å; I328-I351 HydrophobicContact CG2-CG2 4.38Å; F332-I351 HydrophobicContact CE2-CD1 4.4Å; F332-I351 HydrophobicContact CE2-CG1 4.1Å; L348-I351 HydrophobicContact CD2-CD1 4.04Å; L348-I351 PolarHBondContact O-N 3.29Å; L348-I351 VanDerWaalsContact O-N 3.12Å
352	K	83.4	Confident	80.7	Confident	134 Å²	134	82.6 Å²	82.6	58%	0.583	43%	0.426	S	S	*	.			trans	-90.8	147.5	173.7	-65.9	-174.7	178.7	-176.9	0	110.3	K350 E354 Q355	K350-K352 PolarHBondContact O-N 2.86Å; K352-E354 PolarHBondContact O-N 2.83Å; K352-E354 VanDerWaalsContact O-N 3.12Å; K352-Q355 HydrophobicContact CB-CG 4.37Å; K352-Q355 WeakPolarHBondContact O-CB 2.88Å; K352-Q355 PolarHBondContact O-N 2.82Å
353	V	83.6	Confident	82.2	Confident	118 Å²	118	75.4 Å²	75.4	72%	0.715	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-56	-31.7	177.1	-179.9	0	0	0	0	111.9	Q355 L356	V353-Q355 PolarHBondContact O-N 3.17Å; V353-L356 HydrophobicContact CG1-CD1 4.37Å; V353-L356 WeakPolarHBondContact O-CB 3.34Å; V353-L356 PolarHBondContact O-N 2.85Å; V353-L356 VanDerWaalsContact O-N 3.17Å
354	E	84.7	Confident	83.8	Confident	158 Å²	158	74.1 Å²	74.1	74%	0.738	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-63.5	-24.6	177.1	-67	162.6	-169.2	0	0	113.9	K352 L356	K352-E354 PolarHBondContact O-N 2.83Å; K352-E354 VanDerWaalsContact O-N 3.12Å; E354-L356 VanDerWaalsContact C-N 3.27Å; E354-L356 PolarHBondContact O-N 2.89Å
355	Q	83.2	Confident	85.2	Confident	109 Å²	109	74.6 Å²	74.6	51%	0.509	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-79.2	-11.9	178.7	-62.1	174.9	-48	0	0	112.4	I328 K352 V353 R357	I328-Q355 HydrophobicContact CD1-CB 4.25Å; K352-Q355 HydrophobicContact CB-CG 4.37Å; K352-Q355 WeakPolarHBondContact O-CB 2.88Å; K352-Q355 PolarHBondContact O-N 2.82Å; V353-Q355 PolarHBondContact O-N 3.17Å; Q355-R357 PolarHBondContact O-N 3.3Å
356	L	88.6	Confident	86.4	Confident	58 Å²	58	72.4 Å²	72.4	30%	0.304	37%	0.369	S	S	.	.	S	Bend	trans	-73.5	117.5	177.3	-62.8	169.7	0	0	0	109.7	P324 L325 I328 V353 E354	P324-L356 HydrophobicContact CB-CD2 4.15Å; L325-L356 HydrophobicContact CB-CD2 4.24Å; I328-L356 HydrophobicContact CD1-CD2 3.74Å; V353-L356 HydrophobicContact CG1-CD1 4.37Å; V353-L356 WeakPolarHBondContact O-CB 3.34Å; V353-L356 PolarHBondContact O-N 2.85Å; V353-L356 VanDerWaalsContact O-N 3.17Å; E354-L356 VanDerWaalsContact C-N 3.27Å; E354-L356 PolarHBondContact O-N 2.89Å
357	R	92.3	Very high	87.6	Confident	105 Å²	105	67.8 Å²	67.8	40%	0.396	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-62	151.4	171.2	66.4	168.4	177.9	77.5	-2.2	110.7	P324 Q355 D363	P324-R357 HydrophobicContact CB-CG 3.92Å; P324-R357 HydrophobicContact CG-CG 4.25Å; Q355-R357 PolarHBondContact O-N 3.3Å; R357-D363 IonicContact CZ-OD1 3.88Å; R357-D363 IonicContact CZ-OD2 3.36Å; R357-D363 IonicContact NH1-OD1 3.73Å; R357-D363 PolarHBondContact NH1-OD1 3.44Å; R357-D363 IonicContact NH1-OD2 3.2Å; R357-D363 PolarHBondContact NH1-OD2 3.15Å; R357-D363 IonicContact NH2-OD1 3.68Å; R357-D363 PolarHBondContact NH2-OD1 3.35Å; R357-D363 IonicContact NH2-OD2 2.65Å
358	P	94	Very high	88.8	Confident	59 Å²	59	67.8 Å²	67.8	38%	0.383	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-60.6	151.4	174	26.3	-34.8	0	0	0	111.5	K290	K290-P358 HydrophobicContact CB-CB 4.37Å; K290-P358 WeakPolarHBondContact O-CA 3.02Å
359	L	95.4	Very high	89.8	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.037	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-66.9	138	174.1	-61.7	173.9	0	0	0	111.3	L286 Q289 K290 H291 A292 A320 A321 P324	L286-L359 HydrophobicContact CD2-CD1 3.74Å; Q289-L359 HydrophobicContact CB-CD1 4.33Å; K290-L359 PolarHBondContact O-N 3.48Å; H291-L359 CarbonylContact C-O 3.57Å; H291-L359 WeakPolarHBondContact CA-O 3.45Å; H291-L359 HydrophobicContact CB-CB 3.93Å; A292-L359 PolarHBondContact N-O 2.83Å; A320-L359 WeakPolarHBondContact O-CD2 2.94Å; A321-L359 HydrophobicContact CB-CD1 4.5Å; P324-L359 HydrophobicContact CG-CD2 3.61Å
360	T	94.9	Very high	90.4	Very high	40 Å²	40	70.7 Å²	70.7	25%	0.245	35%	0.354	C	S	.	.			trans	-121.5	167.2	-177	67.5	0	0	0	0	110.5	S362 D363	T360-S362 PolarHBondContact O-N 2.87Å; T360-S362 PolarHBondContact OG1-OG 3.48Å; T360-D363 PolarHBondContact N-OD2 3.03Å; T360-D363 WeakPolarHBondContact O-CB 3.42Å; T360-D363 PolarHBondContact O-N 3.42Å; T360-D363 PolarHBondContact OG1-OD2 2.89Å
361	A	94.3	Very high	91.1	Very high	31 Å²	31	64.4 Å²	64.4	26%	0.256	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-33.9	176.1	0	0	0	0	0	112.1	L293 A297 D363 F364 L365	L293-A361 HydrophobicContact CD2-CB 3.98Å; L293-A361 VanDerWaalsContact CD2-N 3.31Å; A297-A361 HydrophobicContact CB-CB 4.08Å; A361-D363 VanDerWaalsContact C-N 3.27Å; A361-D363 PolarHBondContact O-N 2.82Å; A361-F364 PolarHBondContact O-N 3.26Å; A361-L365 WeakPolarHBondContact O-CG 3.32Å; A361-L365 PolarHBondContact O-N 2.99Å
362	S	94	Very high	91.8	Very high	64 Å²	64	72 Å²	72	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-33.3	178.9	70.9	0	0	0	0	113.2	T360 F364 L365 N366	T360-S362 PolarHBondContact O-N 2.87Å; T360-S362 PolarHBondContact OG1-OG 3.48Å; S362-F364 VanDerWaalsContact C-N 3.34Å; S362-F364 PolarHBondContact O-N 3.39Å; S362-L365 PolarHBondContact O-N 3.17Å; S362-N366 PolarHBondContact O-N 3.35Å
363	D	95.9	Very high	92.2	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-65.5	-41.4	178.2	-58.4	-44.2	0	0	0	111.1	A320 E323 R357 T360 A361 N366 A367	A320-D363 HydrophobicContact CB-CB 4.34Å; E323-D363 HydrophobicContact CB-CB 3.85Å; E323-D363 VanDerWaalsContact CB-OD1 3.28Å; E323-D363 WeakPolarHBondContact CB-OD1 3.39Å; E323-D363 HydrophobicContact CG-CB 3.96Å; R357-D363 IonicContact CZ-OD1 3.88Å; R357-D363 IonicContact CZ-OD2 3.36Å; R357-D363 IonicContact NH1-OD1 3.73Å; R357-D363 PolarHBondContact NH1-OD1 3.44Å; R357-D363 IonicContact NH1-OD2 3.2Å; R357-D363 PolarHBondContact NH1-OD2 3.15Å; R357-D363 IonicContact NH2-OD1 3.68Å; R357-D363 PolarHBondContact NH2-OD1 3.35Å; R357-D363 IonicContact NH2-OD2 2.65Å; T360-D363 PolarHBondContact N-OD2 3.03Å; T360-D363 WeakPolarHBondContact O-CB 3.42Å; T360-D363 PolarHBondContact O-N 3.42Å; T360-D363 PolarHBondContact OG1-OD2 2.89Å; A361-D363 VanDerWaalsContact C-N 3.27Å; A361-D363 PolarHBondContact O-N 2.82Å; D363-N366 PolarHBondContact O-N 2.86Å; D363-A367 WeakPolarHBondContact O-CB 3.39Å; D363-A367 PolarHBondContact O-N 3.3Å
364	F	96	Very high	92.7	Very high	1 Å²	1	66.4 Å²	66.4	0%	0.004	34%	0.337	C	S	.	.	H	α-helix	trans	-69.6	-39.3	175.6	-80.1	-92.3	0	0	0	112.2	L282 L286 L293 I301 L316 A317 A320 A361 S362 N366 A367 L368	L282-F364 HydrophobicContact CD2-CE1 3.97Å; L286-F364 HydrophobicContact CD1-CE2 4.07Å; L286-F364 HydrophobicContact CD1-CZ 3.8Å; L286-F364 HydrophobicContact CD2-CZ 4.11Å; L286-F364 HydrophobicContact CG-CZ 4.35Å; L293-F364 HydrophobicContact CD1-CD2 4.07Å; L293-F364 HydrophobicContact CD1-CE2 3.72Å; L293-F364 HydrophobicContact CD1-CZ 4.45Å; I301-F364 HydrophobicContact CD1-CB 3.63Å; I301-F364 HydrophobicContact CD1-CD1 4.1Å; I301-F364 HydrophobicContact CD1-CD2 3.97Å; I301-F364 HydrophobicContact CD1-CG 3.62Å; I301-F364 HydrophobicContact CG1-CB 3.86Å; I301-F364 HydrophobicContact CG1-CG 4.3Å; I301-F364 HydrophobicContact CG2-CB 4.33Å; I301-F364 HydrophobicContact CG2-CD1 3.97Å; I301-F364 HydrophobicContact CG2-CG 4.41Å; L316-F364 HydrophobicContact CD2-CD1 4.36Å; L316-F364 HydrophobicContact CG-CD1 4.16Å; A317-F364 HydrophobicContact CB-CE1 4.39Å; A320-F364 HydrophobicContact CB-CD1 3.88Å; A320-F364 HydrophobicContact CB-CD2 3.8Å; A320-F364 HydrophobicContact CB-CE1 3.86Å; A320-F364 HydrophobicContact CB-CE2 3.76Å; A320-F364 HydrophobicContact CB-CG 3.85Å; A320-F364 HydrophobicContact CB-CZ 3.79Å; A361-F364 PolarHBondContact O-N 3.26Å; S362-F364 VanDerWaalsContact C-N 3.34Å; S362-F364 PolarHBondContact O-N 3.39Å; F364-N366 VanDerWaalsContact C-N 3.31Å; F364-N366 PolarHBondContact O-N 2.93Å; F364-A367 PolarHBondContact O-N 3.34Å; F364-L368 WeakPolarHBondContact O-CB 3.35Å; F364-L368 VanDerWaalsContact O-CG 3.27Å; F364-L368 WeakPolarHBondContact O-CG 3.12Å; F364-L368 PolarHBondContact O-N 3.44Å
365	L	93.5	Very high	93	Very high	78 Å²	78	59.6 Å²	59.6	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-35.6	175.1	-67.9	175.8	0	0	0	112.1	A361 S362 L368 K369	A361-L365 WeakPolarHBondContact O-CG 3.32Å; A361-L365 PolarHBondContact O-N 2.99Å; S362-L365 PolarHBondContact O-N 3.17Å; L365-L368 HydrophobicContact CD2-CD1 4.23Å; L365-K369 PolarHBondContact O-N 3.41Å
366	N	93.9	Very high	93.5	Very high	55 Å²	55	62.1 Å²	62.1	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-68.7	-44.1	172.4	-75.2	-16.2	0	0	0	111.7	E323 S362 D363 F364 L368 K369	E323-N366 PolarHBondContact OE2-ND2 3.17Å; E323-N366 VanDerWaalsContact OE2-ND2 3.08Å; S362-N366 PolarHBondContact O-N 3.35Å; D363-N366 PolarHBondContact O-N 2.86Å; F364-N366 VanDerWaalsContact C-N 3.31Å; F364-N366 PolarHBondContact O-N 2.93Å; N366-L368 VanDerWaalsContact C-N 3.31Å; N366-L368 PolarHBondContact O-N 2.92Å; N366-K369 WeakPolarHBondContact O-CB 3.49Å; N366-K369 PolarHBondContact O-N 3.48Å; N366-K369 VanDerWaalsContact O-N 3.13Å; N366-K369 PolarHBondContact OD1-NZ 3.07Å; N366-K369 VanDerWaalsContact OD1-NZ 3.1Å
367	A	95.7	Very high	93.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-38.9	176.2	0	0	0	0	0	112.1	L316 E319 A320 D363 F364 K369 Q370 C371	L316-A367 HydrophobicContact CD1-CB 3.61Å; E319-A367 HydrophobicContact CB-CB 3.94Å; E319-A367 HydrophobicContact CG-CB 3.7Å; A320-A367 HydrophobicContact CB-CB 4.06Å; D363-A367 WeakPolarHBondContact O-CB 3.39Å; D363-A367 PolarHBondContact O-N 3.3Å; F364-A367 PolarHBondContact O-N 3.34Å; A367-K369 PolarHBondContact O-N 3.44Å; A367-Q370 PolarHBondContact O-N 3.05Å; A367-C371 WeakPolarHBondContact O-CB 3.36Å; A367-C371 PolarHBondContact O-N 2.91Å; A367-C371 PolarHBondContact O-SG 2.85Å
368	L	94.7	Very high	93.8	Very high	23 Å²	23	64.1 Å²	64.1	12%	0.12	34%	0.338	C	S	.	.	H	α-helix	trans	-62.1	-23.9	175.7	-78.8	164.8	0	0	0	113.7	C304 F308 L316 F364 L365 N366 Q370	C304-L368 HydrophobicContact CB-CD1 3.53Å; C304-L368 HydrophobicContact CB-CD2 4.49Å; F308-L368 HydrophobicContact CE2-CD2 4.23Å; F308-L368 HydrophobicContact CZ-CD2 3.89Å; L316-L368 HydrophobicContact CD1-CB 4.49Å; L316-L368 HydrophobicContact CD1-CD2 3.89Å; L316-L368 HydrophobicContact CD1-CG 3.79Å; L316-L368 HydrophobicContact CD2-CD2 3.88Å; L316-L368 HydrophobicContact CD2-CG 4.29Å; F364-L368 WeakPolarHBondContact O-CB 3.35Å; F364-L368 VanDerWaalsContact O-CG 3.27Å; F364-L368 WeakPolarHBondContact O-CG 3.12Å; F364-L368 PolarHBondContact O-N 3.44Å; L365-L368 HydrophobicContact CD2-CD1 4.23Å; N366-L368 VanDerWaalsContact C-N 3.31Å; N366-L368 PolarHBondContact O-N 2.92Å; L368-Q370 VanDerWaalsContact C-N 3.29Å
369	K	93	Very high	93.8	Very high	140 Å²	140	63.3 Å²	63.3	61%	0.609	33%	0.329	S	S	*	.	H	α-helix	trans	-70.4	-29.2	173.6	-64.4	167.7	-172.6	164.2	0	111.9	L365 N366 A367	L365-K369 PolarHBondContact O-N 3.41Å; N366-K369 WeakPolarHBondContact O-CB 3.49Å; N366-K369 PolarHBondContact O-N 3.48Å; N366-K369 VanDerWaalsContact O-N 3.13Å; N366-K369 PolarHBondContact OD1-NZ 3.07Å; N366-K369 VanDerWaalsContact OD1-NZ 3.1Å; A367-K369 PolarHBondContact O-N 3.44Å
370	Q	90.6	Very high	93.7	Very high	123 Å²	123	64.2 Å²	64.2	58%	0.575	33%	0.333	S	S	*	.	H	α-helix	trans	-97	-35.3	-176.9	-56.8	-171.7	30.7	0	0	112.2	E319 A367 L368	E319-Q370 PolarHBondContact OE1-OE1 3.45Å; A367-Q370 PolarHBondContact O-N 3.05Å; L368-Q370 VanDerWaalsContact C-N 3.29Å
371	C	92.9	Very high	93.7	Very high	17 Å²	17	67.6 Å²	67.6	12%	0.115	34%	0.344	C	S	.	.			trans	-82.9	128	178.9	-61.7	0	0	0	0	111.3	F308 L316 A367	F308-C371 HydrophobicContact CE2-CB 4.1Å; F308-C371 HydrophobicContact CZ-CB 4.33Å; L316-C371 HydrophobicContact CD1-CB 4.23Å; A367-C371 WeakPolarHBondContact O-CB 3.36Å; A367-C371 PolarHBondContact O-N 2.91Å; A367-C371 PolarHBondContact O-SG 2.85Å
372	R	92.4	Very high	93.8	Very high	191 Å²	191	73.1 Å²	73.1	72%	0.721	36%	0.359	S	S	*	.			trans	-116.9	151.6	172.3	-61.2	-64.8	-176.1	-175.5	-0.9	109.9	S374	R372-S374 PolarHBondContact O-N 3.43Å
373	P	93.3	Very high	93.8	Very high	60 Å²	60	70 Å²	70	39%	0.39	34%	0.337	S	S	.	.			trans	-55.8	136	173.1	-22.2	30.7	0	0	0	111.4	F308	F308-P373 HydrophobicContact CD1-CB 4.39Å; F308-P373 HydrophobicContact CD1-CG 3.8Å; F308-P373 HydrophobicContact CE1-CG 3.68Å
374	S	92.7	Very high	93.7	Very high	75 Å²	75	74.3 Å²	74.3	52%	0.524	36%	0.357	S	S	.	.	S	Bend	trans	-83.7	-18.3	179.5	57	0	0	0	0	113.2	D312 R372	D312-S374 VanDerWaalsContact CG-OG 3.24Å; D312-S374 WeakPolarHBondContact OD1-CB 3.46Å; D312-S374 PolarHBondContact OD1-OG 2.94Å; D312-S374 PolarHBondContact OD2-N 2.71Å; D312-S374 PolarHBondContact OD2-OG 3.33Å; R372-S374 PolarHBondContact O-N 3.43Å
375	V	91.6	Very high	93.7	Very high	14 Å²	14	80.1 Å²	80.1	9%	0.085	39%	0.385	C	S	.	.	S	Bend	trans	-98.4	125.7	-175.2	-172.5	0	0	0	0	110.5	P145 P146 L272 I380	P145-V375 HydrophobicContact CB-CB 4.49Å; P145-V375 HydrophobicContact CB-CG1 3.79Å; P145-V375 HydrophobicContact CB-CG2 3.92Å; P146-V375 HydrophobicContact CG-CG2 4.2Å; L272-V375 HydrophobicContact CD2-CG2 4.36Å; V375-I380 HydrophobicContact CG1-CD1 4.03Å; V375-I380 HydrophobicContact CG1-CG1 3.66Å
376	K	93.3	Very high	93.7	Very high	162 Å²	162	77.1 Å²	77.1	70%	0.704	37%	0.368	S	S	*	.			trans	-72.8	140.8	175.7	-62.8	-176	179.3	-176.3	0	111.4	D378 H379 I380	K376-D378 VanDerWaalsContact C-N 3.31Å; K376-D378 PolarHBondContact O-N 2.97Å; K376-H379 HydrophobicContact CB-CB 4.42Å; K376-H379 WeakPolarHBondContact O-CB 3.42Å; K376-H379 PolarHBondContact O-N 2.63Å; K376-H379 VanDerWaalsContact O-N 3.08Å; K376-I380 PolarHBondContact O-N 2.66Å
377	V	93.2	Very high	93.8	Very high	96 Å²	96	75.7 Å²	75.7	58%	0.582	36%	0.36	S	S	*	.	H	α-helix	trans	-57.4	-42.3	178.1	-178	0	0	0	0	112	H379 I380 K381	V377-H379 PolarHBondContact O-N 3.3Å; V377-I380 WeakPolarHBondContact O-CB 3.42Å; V377-I380 PolarHBondContact O-N 3.39Å; V377-I380 VanDerWaalsContact O-N 3.09Å; V377-K381 PolarHBondContact O-N 2.91Å
378	D	94.4	Very high	93.7	Very high	109 Å²	109	81.9 Å²	81.9	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-62.4	-32.7	178.8	-58.2	-30	0	0	0	112.9	K376 R382	K376-D378 VanDerWaalsContact C-N 3.31Å; K376-D378 PolarHBondContact O-N 2.97Å; D378-R382 WeakPolarHBondContact O-CG 2.97Å; D378-R382 PolarHBondContact O-N 3.04Å; D378-R382 VanDerWaalsContact O-N 3.15Å
379	H	93.4	Very high	93.6	Very high	42 Å²	42	84.1 Å²	84.1	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-70.7	-36.1	176.8	-173.6	-124	0	0	0	111.4	N251 F254 K376 V377 R382 L383	N251-H379 PolarHBondContact O-CE1 3.48Å; N251-H379 VanDerWaalsContact O-CE1 3.24Å; N251-H379 PolarHBondContact O-NE2 3.21Å; F254-H379 AromaticContact CE1-NE2 3.89Å; F254-H379 AromaticContact CZ-CD2 3.94Å; F254-H379 AromaticContact CZ-NE2 3.77Å; K376-H379 HydrophobicContact CB-CB 4.42Å; K376-H379 WeakPolarHBondContact O-CB 3.42Å; K376-H379 PolarHBondContact O-N 2.63Å; K376-H379 VanDerWaalsContact O-N 3.08Å; V377-H379 PolarHBondContact O-N 3.3Å; H379-R382 PolarHBondContact O-N 2.81Å; H379-L383 VanDerWaalsContact O-CG 3.3Å; H379-L383 WeakPolarHBondContact O-CG 3.25Å; H379-L383 PolarHBondContact O-N 3.21Å; H379-L383 VanDerWaalsContact O-N 3.1Å
380	I	93.8	Very high	93.5	Very high	26 Å²	26	80.9 Å²	80.9	13%	0.133	40%	0.403	C	S	.	.	H	α-helix	trans	-63.8	-46.9	175.3	-59.1	164.6	0	0	0	109.8	L272 V375 K376 V377 R382 L383 E384	L272-I380 HydrophobicContact CD1-CD1 3.43Å; L272-I380 VanDerWaalsContact CD1-CD1 3.43Å; L272-I380 HydrophobicContact CD1-CG1 4.24Å; L272-I380 HydrophobicContact CG-CD1 4.44Å; V375-I380 HydrophobicContact CG1-CD1 4.03Å; V375-I380 HydrophobicContact CG1-CG1 3.66Å; K376-I380 PolarHBondContact O-N 2.66Å; V377-I380 WeakPolarHBondContact O-CB 3.42Å; V377-I380 PolarHBondContact O-N 3.39Å; V377-I380 VanDerWaalsContact O-N 3.09Å; I380-R382 VanDerWaalsContact C-N 3.34Å; I380-R382 PolarHBondContact O-N 3.48Å; I380-L383 WeakPolarHBondContact O-CB 3.29Å; I380-L383 PolarHBondContact O-N 2.73Å; I380-E384 HydrophobicContact CG2-CG 4.48Å; I380-E384 WeakPolarHBondContact O-CG 3.22Å; I380-E384 PolarHBondContact O-N 2.75Å
381	K	95.2	Very high	93.3	Very high	111 Å²	111	76 Å²	76	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-55.8	-46.5	176.6	-69.5	179.5	177.9	177.7	0	112.2	V377 L383 E384 E385	V377-K381 PolarHBondContact O-N 2.91Å; K381-L383 VanDerWaalsContact C-N 3.29Å; K381-L383 PolarHBondContact O-N 3.41Å; K381-E384 PolarHBondContact O-N 2.93Å; K381-E384 VanDerWaalsContact O-N 3.17Å; K381-E385 WeakPolarHBondContact O-CG 3.1Å; K381-E385 PolarHBondContact O-N 3.27Å
382	R	95.5	Very high	92.6	Very high	147 Å²	147	79 Å²	79	56%	0.555	40%	0.397	S	S	*	.	H	α-helix	trans	-61.2	-36.3	175.9	-72.1	-176.3	-176.4	-166.3	0.2	113.2	F254 D378 H379 I380 F386	F254-R382 HydrophobicContact CD1-CB 4.49Å; F254-R382 HydrophobicContact CE1-CB 4.31Å; D378-R382 WeakPolarHBondContact O-CG 2.97Å; D378-R382 PolarHBondContact O-N 3.04Å; D378-R382 VanDerWaalsContact O-N 3.15Å; H379-R382 PolarHBondContact O-N 2.81Å; I380-R382 VanDerWaalsContact C-N 3.34Å; I380-R382 PolarHBondContact O-N 3.48Å; R382-F386 WeakPolarHBondContact O-CB 3.16Å; R382-F386 PolarHBondContact O-N 2.86Å
383	L	94.7	Very high	91.2	Very high	0 Å²	0	75 Å²	75	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-68.4	-38.6	176.2	-71.1	165.4	0	0	0	111.6	F143 P145 P253 Y269 H379 I380 K381 N387	F143-L383 HydrophobicContact CD2-CD2 4.2Å; P145-L383 HydrophobicContact CB-CD1 4.26Å; P145-L383 HydrophobicContact CG-CD1 4.21Å; P253-L383 VanDerWaalsContact CD-CD2 3.47Å; P253-L383 HydrophobicContact CG-CD2 3.78Å; Y269-L383 HydrophobicContact CE2-CB 3.9Å; H379-L383 VanDerWaalsContact O-CG 3.3Å; H379-L383 WeakPolarHBondContact O-CG 3.25Å; H379-L383 PolarHBondContact O-N 3.21Å; H379-L383 VanDerWaalsContact O-N 3.1Å; I380-L383 WeakPolarHBondContact O-CB 3.29Å; I380-L383 PolarHBondContact O-N 2.73Å; K381-L383 VanDerWaalsContact C-N 3.29Å; K381-L383 PolarHBondContact O-N 3.41Å; L383-N387 WeakPolarHBondContact O-CB 3.3Å; L383-N387 PolarHBondContact O-N 2.85Å
384	E	94.4	Very high	89	Confident	91 Å²	91	78.9 Å²	78.9	43%	0.425	42%	0.421	S	S	.	.	H	α-helix	trans	-67.9	-43.7	175.6	-70	172.6	173.5	0	0	111.7	Y269 I380 K381 F386 N387 N388	Y269-E384 HydrophobicContact CE1-CG 4.38Å; I380-E384 HydrophobicContact CG2-CG 4.48Å; I380-E384 WeakPolarHBondContact O-CG 3.22Å; I380-E384 PolarHBondContact O-N 2.75Å; K381-E384 PolarHBondContact O-N 2.93Å; K381-E384 VanDerWaalsContact O-N 3.17Å; E384-F386 PolarHBondContact O-N 3.14Å; E384-N387 WeakPolarHBondContact O-CB 3.49Å; E384-N387 PolarHBondContact O-N 3.4Å; E384-N387 VanDerWaalsContact O-N 3.15Å; E384-N388 PolarHBondContact O-N 3.47Å; E384-N388 PolarHBondContact O-ND2 3.06Å
385	E	95.4	Very high	88.8	Confident	123 Å²	123	79.1 Å²	79.1	58%	0.575	42%	0.416	S	S	*	.	H	α-helix	trans	-57.2	-47.7	172.3	-72.9	166.6	-175.1	0	0	111.2	K381 N387 N388 A389	K381-E385 WeakPolarHBondContact O-CG 3.1Å; K381-E385 PolarHBondContact O-N 3.27Å; E385-N387 VanDerWaalsContact C-N 3.33Å; E385-N387 PolarHBondContact O-N 2.87Å; E385-N388 PolarHBondContact O-N 3.06Å; E385-A389 PolarHBondContact O-N 3.34Å
386	F	94.5	Very high	88.7	Confident	15 Å²	15	82.5 Å²	82.5	7%	0.066	43%	0.433	C	S	.	.	H	α-helix	trans	-60.8	-41.9	174.7	-176.3	-84.1	0	0	0	111.7	F143 P253 F254 L261 R382 E384 N388 A389 H390	F143-F386 HydrophobicContact CD1-CE1 4.44Å; F143-F386 HydrophobicContact CD2-CD1 4.1Å; F143-F386 HydrophobicContact CE1-CD1 4.34Å; F143-F386 HydrophobicContact CE1-CE1 4.22Å; F143-F386 AromaticContact CE2-CD1 3.67Å; F143-F386 HydrophobicContact CE2-CD1 3.67Å; F143-F386 HydrophobicContact CE2-CE1 4.31Å; F143-F386 AromaticContact CZ-CD1 3.8Å; F143-F386 HydrophobicContact CZ-CD1 3.8Å; F143-F386 HydrophobicContact CZ-CE1 4.14Å; P253-F386 HydrophobicContact CB-CD1 3.77Å; P253-F386 HydrophobicContact CB-CD2 4.18Å; P253-F386 HydrophobicContact CB-CE1 3.55Å; P253-F386 HydrophobicContact CB-CE2 3.97Å; P253-F386 HydrophobicContact CB-CG 4.09Å; P253-F386 HydrophobicContact CB-CZ 3.67Å; P253-F386 HydrophobicContact CG-CB 4.32Å; P253-F386 HydrophobicContact CG-CD1 3.68Å; P253-F386 HydrophobicContact CG-CD2 4.15Å; P253-F386 HydrophobicContact CG-CE1 4.03Å; P253-F386 HydrophobicContact CG-CE2 4.45Å; P253-F386 HydrophobicContact CG-CG 3.77Å; P253-F386 HydrophobicContact CG-CZ 4.41Å; F254-F386 HydrophobicContact CB-CD2 4.35Å; L261-F386 HydrophobicContact CD1-CE2 4.34Å; L261-F386 HydrophobicContact CD1-CZ 4.34Å; L261-F386 HydrophobicContact CD2-CZ 4.08Å; R382-F386 WeakPolarHBondContact O-CB 3.16Å; R382-F386 PolarHBondContact O-N 2.86Å; E384-F386 PolarHBondContact O-N 3.14Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 3.07Å; F386-A389 PolarHBondContact O-N 3.02Å; F386-H390 HydrophobicContact CD1-CB 4.31Å; F386-H390 AromaticContact CD2-CD2 3.67Å; F386-H390 HydrophobicContact CE1-CB 3.87Å; F386-H390 HydrophobicContact CE2-CB 4.24Å; F386-H390 AromaticContact CE2-CD2 3.55Å; F386-H390 HydrophobicContact CZ-CB 3.82Å; F386-H390 WeakPolarHBondContact O-CB 3.1Å; F386-H390 PolarHBondContact O-N 3.25Å
387	N	94.8	Very high	88.4	Confident	24 Å²	24	78.1 Å²	78.1	13%	0.128	42%	0.418	C	S	.	.	H	α-helix	trans	-63.9	-38.7	177.5	-176.2	63.5	0	0	0	112.2	F143 Y269 L383 E384 E385 G391	F143-N387 HydrophobicContact CE2-CB 3.97Å; F143-N387 HydrophobicContact CZ-CB 3.81Å; Y269-N387 VanDerWaalsContact CB-OD1 3.23Å; Y269-N387 WeakPolarHBondContact CB-OD1 3.19Å; Y269-N387 HydrophobicContact CD1-CB 4.32Å; Y269-N387 HydrophobicContact CG-CB 4.21Å; L383-N387 WeakPolarHBondContact O-CB 3.3Å; L383-N387 PolarHBondContact O-N 2.85Å; E384-N387 WeakPolarHBondContact O-CB 3.49Å; E384-N387 PolarHBondContact O-N 3.4Å; E384-N387 VanDerWaalsContact O-N 3.15Å; E385-N387 VanDerWaalsContact C-N 3.33Å; E385-N387 PolarHBondContact O-N 2.87Å; N387-G391 WeakPolarHBondContact O-CA 3.49Å; N387-G391 PolarHBondContact O-N 3.19Å
388	N	94.1	Very high	88.1	Confident	130 Å²	130	77.1 Å²	77.1	70%	0.695	41%	0.408	S	S	*	.	H	α-helix	trans	-69	-35.5	177.8	-66.4	-22.1	0	0	0	112	E384 E385 F386	E384-N388 PolarHBondContact O-N 3.47Å; E384-N388 PolarHBondContact O-ND2 3.06Å; E385-N388 PolarHBondContact O-N 3.06Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 3.07Å
389	A	92.8	Very high	87.7	Confident	71 Å²	71	75.1 Å²	75.1	59%	0.587	40%	0.398	S	S	*	.	H	α-helix	trans	-81.4	-36.6	-179.9	0	0	0	0	0	113.7	E385 F386	E385-A389 PolarHBondContact O-N 3.34Å; F386-A389 PolarHBondContact O-N 3.02Å
390	H	91.6	Very high	87.4	Confident	72 Å²	72	77.3 Å²	77.3	33%	0.333	41%	0.411	S	S	.	.	H	α-helix	trans	-133.2	-12.2	-166.3	-61.2	-60.2	0	0	0	114.4	R267 F386	R267-H390 WeakPolarHBondContact CD-O 3.29Å; R267-H390 PolarHBondContact NH1-O 3.2Å; F386-H390 HydrophobicContact CD1-CB 4.31Å; F386-H390 AromaticContact CD2-CD2 3.67Å; F386-H390 HydrophobicContact CE1-CB 3.87Å; F386-H390 HydrophobicContact CE2-CB 4.24Å; F386-H390 AromaticContact CE2-CD2 3.55Å; F386-H390 HydrophobicContact CZ-CB 3.82Å; F386-H390 WeakPolarHBondContact O-CB 3.1Å; F386-H390 PolarHBondContact O-N 3.25Å
391	G	85.8	Confident	86.9	Confident	19 Å²	19	80.9 Å²	80.9	20%	0.196	43%	0.431	C	S	.	.	S	Bend	trans	-74.5	159.6	-174.7	0	0	0	0	0	112.9	N387 T393	N387-G391 WeakPolarHBondContact O-CA 3.49Å; N387-G391 PolarHBondContact O-N 3.19Å; G391-T393 PolarHBondContact O-N 2.99Å
392	H	78.2	Confident	86.3	Confident	81 Å²	81	78.6 Å²	78.6	38%	0.375	43%	0.427	S	S	.	.			trans	-87.4	100.4	168.5	-167.7	-9.1	0	0	0	108.4	R267 L268	R267-H392 WeakPolarHBondContact O-CB 3.42Å; R267-H392 PolarHBondContact O-N 3.44Å; L268-H392 HydrophobicContact CD2-CB 4.4Å
393	T	62.2	Low	85.5	Confident	108 Å²	108	72.9 Å²	72.9	66%	0.663	42%	0.416	S	S	*	.			trans	-73.3	128.9	160	32	0	0	0	0	108.1	G391	G391-T393 PolarHBondContact O-N 2.99Å
394	C	47.6	Very low	84.7	Confident	141 Å²	141	79.5 Å²	79.5	95%	0.953	45%	0.454	S	S	*	.			trans	-89.1	0	167.7	-73.2	0	0	0	0	110	V111	V111-C394 HydrophobicContact CG1-CB 3.92Å

Retrieved 394 of 394 residues in 594 ms (Link to these results)

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