A0A5K4FB34_SCHMA Loading...

RNA helicase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FB34, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 460 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	40.6	Very low	233 Å²	233	126.8 Å²	126.8	100%	1.148	66%	0.664	S	S	*	*				0	74.8	0	-63.2	-176.3	-127	0	0	106.2
2	S	31.5	Very low	41.1	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	64%	0.639	S	S	*	*				62.6	40.8	60.8	82.1	0	0	0	0	115
3	F	31	Very low	41.4	Very low	159 Å²	159	121.2 Å²	121.2	70%	0.697	64%	0.635	S	S	*	*			trans	-162.4	83.9	167.9	-85.3	-78.8	0	0	0	108.6
4	T	46.1	Very low	41.9	Very low	116 Å²	116	119.6 Å²	119.6	71%	0.712	62%	0.623	S	S	*	*	S	Bend	trans	-155.4	-21.7	170.6	41.4	0	0	0	0	115.3
5	E	37.6	Very low	42.2	Very low	156 Å²	156	115.1 Å²	115.1	73%	0.729	61%	0.605	S	S	*	*	H	α-helix	trans	-82.2	-39.7	-179.6	-75.1	178.4	161.3	0	0	113	E7 N8 W9	E5-E7 PolarHBondContact O-N 3.16Å; E5-N8 PolarHBondContact O-N 3.46Å; E5-W9 PolarHBondContact O-N 3.2Å
6	S	36.3	Very low	42.3	Very low	70 Å²	70	111.1 Å²	111.1	49%	0.49	59%	0.586	S	S	.	*	H	α-helix	trans	-69.2	-32.3	-174.8	57.8	0	0	0	0	114.5	I10	S6-I10 WeakPolarHBondContact O-CG1 3.24Å; S6-I10 PolarHBondContact O-N 2.91Å
7	E	41.3	Very low	42.2	Very low	132 Å²	132	107.2 Å²	107.2	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-73.6	-31.1	179.8	-70.1	-179.1	158.4	0	0	112	E5 I10 A11	E5-E7 PolarHBondContact O-N 3.16Å; E7-I10 PolarHBondContact O-N 2.78Å; E7-A11 PolarHBondContact O-N 3.25Å
8	N	48.8	Very low	42.2	Very low	122 Å²	122	110.8 Å²	110.8	65%	0.652	58%	0.575	S	S	*	*	H	α-helix	trans	-71.1	-33.3	177.2	-133.1	-0.2	0	0	0	111.6	E5 L12	E5-N8 PolarHBondContact O-N 3.46Å; N8-L12 WeakPolarHBondContact O-CB 3.23Å; N8-L12 PolarHBondContact O-N 3.2Å; N8-L12 VanDerWaalsContact O-N 3.12Å
9	W	42	Very low	42.3	Very low	146 Å²	146	108.4 Å²	108.4	55%	0.553	56%	0.562	S	S	*	*	H	α-helix	trans	-69.5	-37.8	175.5	-75.4	113.4	0	0	0	113.3	E5 L12 L13	E5-W9 PolarHBondContact O-N 3.2Å; W9-L12 HydrophobicContact CE3-CD2 4.14Å; W9-L12 HydrophobicContact CZ3-CD2 4.08Å; W9-L12 PolarHBondContact O-N 3.47Å; W9-L13 WeakPolarHBondContact O-CB 3.29Å; W9-L13 VanDerWaalsContact O-CG 3.31Å; W9-L13 WeakPolarHBondContact O-CG 3.34Å; W9-L13 PolarHBondContact O-N 3.38Å
10	I	47.6	Very low	41.9	Very low	100 Å²	100	106.9 Å²	106.9	51%	0.513	56%	0.561	S	S	.	*	H	α-helix	trans	-68.5	-44.2	177.7	-65.5	170.7	0	0	0	110.3	S6 E7 L12 L13 E14	S6-I10 WeakPolarHBondContact O-CG1 3.24Å; S6-I10 PolarHBondContact O-N 2.91Å; E7-I10 PolarHBondContact O-N 2.78Å; I10-L12 VanDerWaalsContact C-N 3.29Å; I10-L12 PolarHBondContact O-N 3.25Å; I10-L13 PolarHBondContact O-N 3.22Å; I10-E14 WeakPolarHBondContact O-CG 3.34Å; I10-E14 PolarHBondContact O-N 3.17Å
11	A	47.7	Very low	41.6	Very low	55 Å²	55	109.8 Å²	109.8	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-61.2	-38.2	176.1	0	0	0	0	0	112.3	E7 S15	E7-A11 PolarHBondContact O-N 3.25Å; A11-S15 PolarHBondContact O-N 2.9Å
12	L	47.2	Very low	41.6	Very low	70 Å²	70	100.8 Å²	100.8	37%	0.366	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-47.2	174.9	-164.8	89.9	0	0	0	111.5	N8 W9 I10 E14 S15 V16	N8-L12 WeakPolarHBondContact O-CB 3.23Å; N8-L12 PolarHBondContact O-N 3.2Å; N8-L12 VanDerWaalsContact O-N 3.12Å; W9-L12 HydrophobicContact CE3-CD2 4.14Å; W9-L12 HydrophobicContact CZ3-CD2 4.08Å; W9-L12 PolarHBondContact O-N 3.47Å; I10-L12 VanDerWaalsContact C-N 3.29Å; I10-L12 PolarHBondContact O-N 3.25Å; L12-E14 VanDerWaalsContact C-N 3.31Å; L12-E14 PolarHBondContact O-N 3.34Å; L12-S15 PolarHBondContact O-N 3.47Å; L12-S15 VanDerWaalsContact O-N 3.14Å; L12-S15 PolarHBondContact O-OG 3.41Å; L12-V16 WeakPolarHBondContact O-CG2 3.09Å; L12-V16 PolarHBondContact O-N 3.01Å
13	L	44.7	Very low	41.9	Very low	111 Å²	111	99.7 Å²	99.7	58%	0.581	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-38.2	177.2	-76.1	166.9	0	0	0	112	W9 I10 V16 S17	W9-L13 WeakPolarHBondContact O-CB 3.29Å; W9-L13 VanDerWaalsContact O-CG 3.31Å; W9-L13 WeakPolarHBondContact O-CG 3.34Å; W9-L13 PolarHBondContact O-N 3.38Å; I10-L13 PolarHBondContact O-N 3.22Å; L13-V16 PolarHBondContact O-N 3.4Å; L13-S17 VanDerWaalsContact O-CB 3.29Å; L13-S17 WeakPolarHBondContact O-CB 3.49Å; L13-S17 PolarHBondContact O-N 3.35Å; L13-S17 PolarHBondContact O-OG 3.11Å
14	E	48.4	Very low	42	Very low	99 Å²	99	95.4 Å²	95.4	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-42.7	172.7	-76.9	-172.3	-177.9	0	0	111.6	I10 L12 S17 R18	I10-E14 WeakPolarHBondContact O-CG 3.34Å; I10-E14 PolarHBondContact O-N 3.17Å; L12-E14 VanDerWaalsContact C-N 3.31Å; L12-E14 PolarHBondContact O-N 3.34Å; E14-S17 PolarHBondContact O-N 3.12Å; E14-S17 PolarHBondContact O-OG 3.17Å; E14-R18 WeakPolarHBondContact O-CG 3.49Å; E14-R18 PolarHBondContact O-N 3.48Å; E14-R18 IonicContact OE2-NH2 2.85Å
15	S	47.3	Very low	41.3	Very low	52 Å²	52	94.1 Å²	94.1	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-41.5	176.7	75.8	0	0	0	0	112.7	A11 L12 R18 I19	A11-S15 PolarHBondContact O-N 2.9Å; L12-S15 PolarHBondContact O-N 3.47Å; L12-S15 VanDerWaalsContact O-N 3.14Å; L12-S15 PolarHBondContact O-OG 3.41Å; S15-R18 PolarHBondContact O-N 2.82Å; S15-I19 WeakPolarHBondContact O-CG1 3.29Å; S15-I19 PolarHBondContact O-N 3.11Å; S15-I19 VanDerWaalsContact O-N 3.14Å
16	V	43.1	Very low	40.9	Very low	50 Å²	50	93.3 Å²	93.3	30%	0.303	52%	0.52	S	S	.	.	H	α-helix	trans	-68.6	-37.5	176.2	174.2	0	0	0	0	111.2	L12 L13 R18 I19 S20	L12-V16 WeakPolarHBondContact O-CG2 3.09Å; L12-V16 PolarHBondContact O-N 3.01Å; L13-V16 PolarHBondContact O-N 3.4Å; V16-R18 VanDerWaalsContact C-N 3.29Å; V16-R18 PolarHBondContact O-N 2.79Å; V16-I19 PolarHBondContact O-N 3.43Å; V16-S20 PolarHBondContact O-N 2.97Å
17	S	40	Very low	40.7	Very low	46 Å²	46	97.9 Å²	97.9	32%	0.322	54%	0.538	S	S	.	.	H	α-helix	trans	-68.6	-26.2	175	80.9	0	0	0	0	113.4	L13 E14 S20 K21	L13-S17 VanDerWaalsContact O-CB 3.29Å; L13-S17 WeakPolarHBondContact O-CB 3.49Å; L13-S17 PolarHBondContact O-N 3.35Å; L13-S17 PolarHBondContact O-OG 3.11Å; E14-S17 PolarHBondContact O-N 3.12Å; E14-S17 PolarHBondContact O-OG 3.17Å; S17-S20 PolarHBondContact O-OG 3.33Å; S17-K21 WeakPolarHBondContact O-CB 3.2Å; S17-K21 WeakPolarHBondContact O-CG 3.29Å; S17-K21 PolarHBondContact O-N 3.06Å
18	R	43.7	Very low	40.2	Very low	171 Å²	171	99 Å²	99	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-72.4	-42.2	171.9	-73.6	178.5	-154.2	-176.1	7.7	110.4	E14 S15 V16 S20 K21 S22	E14-R18 WeakPolarHBondContact O-CG 3.49Å; E14-R18 PolarHBondContact O-N 3.48Å; E14-R18 IonicContact OE2-NH2 2.85Å; S15-R18 PolarHBondContact O-N 2.82Å; V16-R18 VanDerWaalsContact C-N 3.29Å; V16-R18 PolarHBondContact O-N 2.79Å; R18-S20 VanDerWaalsContact C-N 3.33Å; R18-S20 PolarHBondContact O-N 2.57Å; R18-K21 PolarHBondContact O-N 3.09Å; R18-S22 WeakPolarHBondContact O-CB 3.31Å; R18-S22 PolarHBondContact O-N 3.22Å; R18-S22 PolarHBondContact O-OG 3.13Å
19	I	42.6	Very low	39.3	Very low	65 Å²	65	100.8 Å²	100.8	33%	0.333	55%	0.553	S	S	.	*	H	α-helix	trans	-60.1	-42.7	174.9	-64.7	165.4	0	0	0	110.8	S15 V16 S22 S23 W304	S15-I19 WeakPolarHBondContact O-CG1 3.29Å; S15-I19 PolarHBondContact O-N 3.11Å; S15-I19 VanDerWaalsContact O-N 3.14Å; V16-I19 PolarHBondContact O-N 3.43Å; I19-S22 WeakPolarHBondContact CA-OG 3.19Å; I19-S22 PolarHBondContact O-OG 3.16Å; I19-S23 PolarHBondContact O-N 3.03Å; I19-S23 PolarHBondContact O-OG 3.08Å; I19-W304 HydrophobicContact CG2-CH2 3.97Å; I19-W304 HydrophobicContact CG2-CZ3 3.9Å
20	S	35.1	Very low	39.1	Very low	78 Å²	78	102.3 Å²	102.3	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-73.3	-25	179.5	74.1	0	0	0	0	114.5	V16 S17 R18 S23	V16-S20 PolarHBondContact O-N 2.97Å; S17-S20 PolarHBondContact O-OG 3.33Å; R18-S20 VanDerWaalsContact C-N 3.33Å; R18-S20 PolarHBondContact O-N 2.57Å; S20-S23 VanDerWaalsContact C-OG 3.25Å; S20-S23 WeakPolarHBondContact CA-OG 3.17Å; S20-S23 PolarHBondContact O-OG 3.14Å
21	K	36.1	Very low	38.9	Very low	169 Å²	169	101.4 Å²	101.4	74%	0.735	57%	0.569	S	S	*	*	H	α-helix	trans	-86.8	-25.3	175	-75.2	179.2	178.9	177.9	0	113.2	S17 R18	S17-K21 WeakPolarHBondContact O-CB 3.2Å; S17-K21 WeakPolarHBondContact O-CG 3.29Å; S17-K21 PolarHBondContact O-N 3.06Å; R18-K21 PolarHBondContact O-N 3.09Å
22	S	36	Very low	38.9	Very low	44 Å²	44	106.6 Å²	106.6	31%	0.308	59%	0.589	S	S	.	*	H	α-helix	trans	-78.9	-24.1	175.5	53.8	0	0	0	0	113.1	R18 I19 G24 A25 E26	R18-S22 WeakPolarHBondContact O-CB 3.31Å; R18-S22 PolarHBondContact O-N 3.22Å; R18-S22 PolarHBondContact O-OG 3.13Å; I19-S22 WeakPolarHBondContact CA-OG 3.19Å; I19-S22 PolarHBondContact O-OG 3.16Å; S22-G24 PolarHBondContact O-N 3.33Å; S22-A25 PolarHBondContact O-N 2.66Å; S22-E26 PolarHBondContact O-N 3.25Å
23	S	37.3	Very low	39.3	Very low	82 Å²	82	104.2 Å²	104.2	57%	0.573	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-6.8	179.4	26.1	0	0	0	0	115.6	I19 S20	I19-S23 PolarHBondContact O-N 3.03Å; I19-S23 PolarHBondContact O-OG 3.08Å; S20-S23 VanDerWaalsContact C-OG 3.25Å; S20-S23 WeakPolarHBondContact CA-OG 3.17Å; S20-S23 PolarHBondContact O-OG 3.14Å
24	G	32.8	Very low	40.1	Very low	70 Å²	70	107.3 Å²	107.3	72%	0.722	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-5.1	175.8	0	0	0	0	0	116.2	S22	S22-G24 PolarHBondContact O-N 3.33Å
25	A	31.7	Very low	40.9	Very low	89 Å²	89	106.5 Å²	106.5	74%	0.736	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148	-1.5	-170.9	0	0	0	0	0	116.7	S22	S22-A25 PolarHBondContact O-N 2.66Å
26	E	28.4	Very low	42	Very low	139 Å²	139	104.5 Å²	104.5	65%	0.65	57%	0.573	S	S	*	*			trans	-140.4	74.7	177.5	-72.2	-179.5	164	0	0	110.7	S22 D28	S22-E26 PolarHBondContact O-N 3.25Å; E26-D28 PolarHBondContact O-N 3.04Å
27	L	32.4	Very low	43.7	Very low	165 Å²	165	105.5 Å²	105.5	86%	0.864	58%	0.579	S	S	*	*			trans	-82.7	15.4	172.4	-81.1	157.8	0	0	0	113.1
28	D	31.3	Very low	45.5	Very low	157 Å²	157	107.6 Å²	107.6	84%	0.84	58%	0.58	S	S	*	*			trans	-113.9	21.4	-169.5	-84.6	-13	0	0	0	114.7	E26 E30	E26-D28 PolarHBondContact O-N 3.04Å; D28-E30 PolarHBondContact O-N 3.44Å
29	Q	30.7	Very low	47.3	Very low	159 Å²	159	99.8 Å²	99.8	74%	0.743	55%	0.552	S	S	*	*			trans	-88.2	94.8	158.2	-76.3	-172.1	4.4	0	0	108.5	S31	Q29-S31 PolarHBondContact O-N 2.84Å; Q29-S31 VanDerWaalsContact O-N 3.08Å
30	E	36.7	Very low	49.1	Very low	177 Å²	177	99 Å²	99	83%	0.827	55%	0.547	S	S	*	.			trans	-34.9	117.4	162.6	-78.3	178.7	137.2	0	0	109.1	D28 D32	D28-E30 PolarHBondContact O-N 3.44Å; E30-D32 VanDerWaalsContact C-N 3.31Å; E30-D32 PolarHBondContact O-N 3.18Å
31	S	43.7	Very low	51.1	Low	82 Å²	82	96.4 Å²	96.4	57%	0.573	53%	0.527	S	S	*	.			trans	-61	103.3	163.9	59.8	0	0	0	0	106.2	Q29 E33	Q29-S31 PolarHBondContact O-N 2.84Å; Q29-S31 VanDerWaalsContact O-N 3.08Å; S31-E33 PolarHBondContact O-N 3.26Å
32	D	48.2	Very low	53.1	Low	163 Å²	163	88.6 Å²	88.6	87%	0.872	49%	0.494	S	S	*	.			trans	-56.3	5.5	169	-95.7	-22.9	0	0	0	113	E30 K34	E30-D32 VanDerWaalsContact C-N 3.31Å; E30-D32 PolarHBondContact O-N 3.18Å; D32-K34 PolarHBondContact O-N 3.18Å
33	E	54.8	Low	55.3	Low	21 Å²	21	88.4 Å²	88.4	10%	0.098	49%	0.486	C	S	.	.			trans	-76.2	104.2	175.3	-161.6	168.1	-143.1	0	0	109.8	S31 P35 S351 G352 T377 V379 C380	S31-E33 PolarHBondContact O-N 3.26Å; E33-P35 WeakPolarHBondContact O-CD 3.41Å; E33-S351 WeakPolarHBondContact OE1-CA 3.49Å; E33-S351 WeakPolarHBondContact OE1-CB 3.37Å; E33-G352 PolarHBondContact OE1-N 2.63Å; E33-T377 VanDerWaalsContact CD-OG1 3.3Å; E33-T377 PolarHBondContact OE1-OG1 3.35Å; E33-T377 WeakPolarHBondContact OE2-CB 3.43Å; E33-T377 WeakPolarHBondContact OE2-CG2 3.21Å; E33-T377 PolarHBondContact OE2-OG1 2.96Å; E33-V379 HydrophobicContact CG-CG1 4.35Å; E33-C380 PolarHBondContact OE1-SG 2.89Å; E33-C380 VanDerWaalsContact OE1-SG 3.33Å
34	K	61.4	Low	57.2	Low	176 Å²	176	84.5 Å²	84.5	77%	0.765	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-65.3	119.4	174.7	-147	174.8	-173.6	179	0	108.8	D32	D32-K34 PolarHBondContact O-N 3.18Å
35	P	65.6	Low	59.1	Low	82 Å²	82	81.8 Å²	81.8	53%	0.532	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-56.9	148.8	176.2	21.2	-31	0	0	0	111.4	E33 T37 V379	E33-P35 WeakPolarHBondContact O-CD 3.41Å; P35-T37 PolarHBondContact O-N 3Å; P35-V379 HydrophobicContact CB-CG1 3.71Å
36	F	71.2	Confident	61.1	Low	10 Å²	10	79.1 Å²	79.1	4%	0.044	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-60.7	128.7	166.4	-60.6	-14.8	0	0	0	108.2	E40 I41 L44 R359 C380 L384	F36-E40 HydrophobicContact CB-CB 4.33Å; F36-I41 HydrophobicContact CB-CD1 4.07Å; F36-I41 HydrophobicContact CB-CG1 3.67Å; F36-I41 HydrophobicContact CD2-CG1 4.44Å; F36-L44 HydrophobicContact CD2-CD1 4.42Å; F36-L44 HydrophobicContact CE2-CD1 4.39Å; F36-R359 VanDerWaalsContact CE1-NH1 3.26Å; F36-R359 VanDerWaalsContact CE1-NH2 3.32Å; F36-R359 HydrophobicContact CZ-CG 4.34Å; F36-C380 HydrophobicContact CD2-CB 4.36Å; F36-C380 WeakPolarHBondContact CD2-O 3.41Å; F36-C380 HydrophobicContact CE1-CB 4.09Å; F36-C380 HydrophobicContact CE2-CB 3.62Å; F36-C380 WeakPolarHBondContact CE2-O 3.22Å; F36-C380 HydrophobicContact CZ-CB 3.47Å; F36-C380 VanDerWaalsContact CZ-CB 3.47Å; F36-L384 HydrophobicContact CD2-CD1 4.1Å; F36-L384 HydrophobicContact CD2-CG 4.37Å; F36-L384 HydrophobicContact CE2-CD1 3.72Å; F36-L384 HydrophobicContact CE2-CG 4.47Å
37	T	79	Confident	63.2	Low	71 Å²	71	75.3 Å²	75.3	44%	0.436	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-61.6	151.8	170.3	58.7	0	0	0	0	109.3	P35 A39 E40 I41	P35-T37 PolarHBondContact O-N 3Å; T37-A39 PolarHBondContact O-N 2.86Å; T37-A39 VanDerWaalsContact O-N 3.11Å; T37-E40 WeakPolarHBondContact CB-OE2 3.29Å; T37-E40 PolarHBondContact N-OE2 3.31Å; T37-E40 PolarHBondContact O-N 3.35Å; T37-E40 WeakPolarHBondContact OG1-CB 3.35Å; T37-E40 VanDerWaalsContact OG1-CG 3.24Å; T37-E40 WeakPolarHBondContact OG1-CG 3.33Å; T37-E40 PolarHBondContact OG1-N 3.32Å; T37-E40 VanDerWaalsContact OG1-N 3.17Å; T37-E40 PolarHBondContact OG1-OE2 3.46Å; T37-I41 WeakPolarHBondContact O-CG1 3.33Å; T37-I41 PolarHBondContact O-N 2.81Å
38	R	77.8	Confident	64.7	Low	89 Å²	89	67.8 Å²	67.8	34%	0.336	34%	0.344	S	S	.	.	H	α-helix	trans	-55.4	-32	174.9	-69.2	-158	-179.4	159.5	-17.1	111.5	I41 S42 I233 E236 E265	R38-I41 PolarHBondContact O-N 2.79Å; R38-S42 WeakPolarHBondContact O-CB 3.25Å; R38-S42 PolarHBondContact O-N 3.1Å; R38-I233 HydrophobicContact CB-CD1 4.4Å; R38-I233 HydrophobicContact CB-CG1 4.09Å; R38-I233 WeakPolarHBondContact O-CD1 3.24Å; R38-E236 WeakPolarHBondContact CD-OE1 3.49Å; R38-E236 WeakPolarHBondContact CG-OE2 3.46Å; R38-E236 IonicContact CZ-OE1 3.08Å; R38-E236 IonicContact NE-OE1 2.81Å; R38-E236 PolarHBondContact NE-OE1 3.1Å; R38-E236 IonicContact NH1-OE1 3.78Å; R38-E236 PolarHBondContact NH1-OE1 3.16Å; R38-E265 IonicContact CZ-OE1 2.7Å; R38-E265 IonicContact NH1-OE1 3.98Å; R38-E265 PolarHBondContact NH1-OE1 3.35Å; R38-E265 IonicContact NH2-OE1 3.02Å; R38-E265 PolarHBondContact NH2-OE1 3.29Å
39	A	80.5	Confident	66.3	Low	7 Å²	7	62 Å²	62	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-46.6	173.3	0	0	0	0	0	113.9	T37 S42 Y43 T154 I233	T37-A39 PolarHBondContact O-N 2.86Å; T37-A39 VanDerWaalsContact O-N 3.11Å; A39-S42 PolarHBondContact O-N 3.19Å; A39-Y43 WeakPolarHBondContact O-CB 3.22Å; A39-Y43 PolarHBondContact O-N 3.33Å; A39-T154 HydrophobicContact CB-CG2 3.46Å; A39-T154 VanDerWaalsContact CB-CG2 3.46Å; A39-I233 HydrophobicContact CB-CG2 3.85Å
40	E	80.6	Confident	67.5	Low	48 Å²	48	58.2 Å²	58.2	22%	0.224	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-42.4	174.8	-75.1	166.7	115.2	0	0	111.3	F36 T37 Y43 L44 V356 R359	F36-E40 HydrophobicContact CB-CB 4.33Å; T37-E40 WeakPolarHBondContact CB-OE2 3.29Å; T37-E40 PolarHBondContact N-OE2 3.31Å; T37-E40 PolarHBondContact O-N 3.35Å; T37-E40 WeakPolarHBondContact OG1-CB 3.35Å; T37-E40 VanDerWaalsContact OG1-CG 3.24Å; T37-E40 WeakPolarHBondContact OG1-CG 3.33Å; T37-E40 PolarHBondContact OG1-N 3.32Å; T37-E40 VanDerWaalsContact OG1-N 3.17Å; T37-E40 PolarHBondContact OG1-OE2 3.46Å; E40-Y43 PolarHBondContact O-N 3Å; E40-L44 WeakPolarHBondContact O-CB 3.47Å; E40-L44 VanDerWaalsContact O-CG 3.3Å; E40-L44 WeakPolarHBondContact O-CG 3.38Å; E40-L44 PolarHBondContact O-N 3.47Å; E40-V356 HydrophobicContact CG-CG2 4.38Å; E40-R359 IonicContact OE1-CZ 2.75Å; E40-R359 IonicContact OE1-NH1 2.72Å; E40-R359 PolarHBondContact OE1-NH1 3.22Å; E40-R359 IonicContact OE1-NH2 2.72Å
41	I	77.4	Confident	68.4	Low	24 Å²	24	57.7 Å²	57.7	12%	0.123	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-48.9	175.9	-68.7	161.7	0	0	0	110.4	F36 T37 R38 Y43 L44 N45 R382 G383 L384	F36-I41 HydrophobicContact CB-CD1 4.07Å; F36-I41 HydrophobicContact CB-CG1 3.67Å; F36-I41 HydrophobicContact CD2-CG1 4.44Å; T37-I41 WeakPolarHBondContact O-CG1 3.33Å; T37-I41 PolarHBondContact O-N 2.81Å; R38-I41 PolarHBondContact O-N 2.79Å; I41-Y43 VanDerWaalsContact C-N 3.35Å; I41-Y43 PolarHBondContact O-N 2.95Å; I41-L44 PolarHBondContact O-N 3.37Å; I41-N45 VanDerWaalsContact O-CB 3.3Å; I41-N45 WeakPolarHBondContact O-CB 3.44Å; I41-N45 PolarHBondContact O-N 2.8Å; I41-N45 PolarHBondContact O-ND2 3.47Å; I41-N45 PolarHBondContact O-OD1 3.29Å; I41-R382 WeakPolarHBondContact CD1-O 3.45Å; I41-G383 VanDerWaalsContact CG2-O 3.27Å; I41-G383 WeakPolarHBondContact CG2-O 3.34Å; I41-L384 HydrophobicContact CG2-CD2 4.39Å
42	S	78	Confident	68.9	Low	6 Å²	6	56.2 Å²	56.2	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-43.1	178.4	174.3	0	0	0	0	111.9	R38 A39 N45 K46 E230 I233	R38-S42 WeakPolarHBondContact O-CB 3.25Å; R38-S42 PolarHBondContact O-N 3.1Å; A39-S42 PolarHBondContact O-N 3.19Å; S42-N45 PolarHBondContact O-N 3.4Å; S42-K46 WeakPolarHBondContact O-CG 3.35Å; S42-K46 PolarHBondContact O-N 3.23Å; S42-E230 PolarHBondContact OG-OE1 3.32Å; S42-E230 PolarHBondContact OG-OE2 3.13Å; S42-I233 VanDerWaalsContact CB-CD1 3.43Å
43	Y	81.5	Confident	69.2	Low	39 Å²	39	49.7 Å²	49.7	15%	0.153	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-52	175.9	174.2	-106.1	0	0	0	111.9	A39 E40 I41 N45 K46 L47 E156 V356	A39-Y43 WeakPolarHBondContact O-CB 3.22Å; A39-Y43 PolarHBondContact O-N 3.33Å; E40-Y43 PolarHBondContact O-N 3Å; I41-Y43 VanDerWaalsContact C-N 3.35Å; I41-Y43 PolarHBondContact O-N 2.95Å; Y43-N45 VanDerWaalsContact C-N 3.3Å; Y43-N45 PolarHBondContact O-N 3.12Å; Y43-K46 PolarHBondContact O-N 3.28Å; Y43-L47 HydrophobicContact CD1-CD1 3.98Å; Y43-L47 HydrophobicContact CE1-CD1 3.35Å; Y43-L47 HydrophobicContact CE1-CG 4.27Å; Y43-L47 HydrophobicContact CE2-CD1 4.24Å; Y43-L47 HydrophobicContact CE2-CG 4.36Å; Y43-L47 PolarHBondContact O-N 2.91Å; Y43-E156 HydrophobicContact CD1-CB 4.4Å; Y43-E156 HydrophobicContact CD2-CB 3.56Å; Y43-E156 HydrophobicContact CE2-CB 3.72Å; Y43-E156 HydrophobicContact CG-CB 3.9Å; Y43-V356 HydrophobicContact CD1-CG1 3.67Å; Y43-V356 HydrophobicContact CE1-CG1 3.4Å; Y43-V356 VanDerWaalsContact CE1-CG1 3.4Å
44	L	77	Confident	68.9	Low	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-39.9	178.3	-69.9	172.7	0	0	0	111.4	F36 E40 I41 K46 L47 L48 R359 I363 L384	F36-L44 HydrophobicContact CD2-CD1 4.42Å; F36-L44 HydrophobicContact CE2-CD1 4.39Å; E40-L44 WeakPolarHBondContact O-CB 3.47Å; E40-L44 VanDerWaalsContact O-CG 3.3Å; E40-L44 WeakPolarHBondContact O-CG 3.38Å; E40-L44 PolarHBondContact O-N 3.47Å; I41-L44 PolarHBondContact O-N 3.37Å; L44-K46 PolarHBondContact O-N 3.26Å; L44-L47 HydrophobicContact CD2-CD1 4.44Å; L44-L47 WeakPolarHBondContact O-CB 3.3Å; L44-L47 PolarHBondContact O-N 3.44Å; L44-L48 WeakPolarHBondContact O-CB 3.41Å; L44-L48 WeakPolarHBondContact O-CD1 3.37Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.26Å; L44-L48 PolarHBondContact O-N 3.08Å; L44-R359 HydrophobicContact CD1-CB 4.36Å; L44-R359 HydrophobicContact CD2-CB 4.22Å; L44-I363 HydrophobicContact CD2-CD1 4.18Å; L44-L384 HydrophobicContact CB-CD2 3.47Å; L44-L384 VanDerWaalsContact CB-CD2 3.47Å; L44-L384 HydrophobicContact CD1-CD1 4.42Å; L44-L384 HydrophobicContact CD1-CD2 3.71Å; L44-L384 HydrophobicContact CG-CD2 4.24Å
45	N	73.8	Confident	68.4	Low	12 Å²	12	49.1 Å²	49.1	6%	0.064	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-42.2	175.2	-74.1	-11.2	0	0	0	113.3	I41 S42 Y43 L47 L48 N49 G383 L384 D385	I41-N45 VanDerWaalsContact O-CB 3.3Å; I41-N45 WeakPolarHBondContact O-CB 3.44Å; I41-N45 PolarHBondContact O-N 2.8Å; I41-N45 PolarHBondContact O-ND2 3.47Å; I41-N45 PolarHBondContact O-OD1 3.29Å; S42-N45 PolarHBondContact O-N 3.4Å; Y43-N45 VanDerWaalsContact C-N 3.3Å; Y43-N45 PolarHBondContact O-N 3.12Å; N45-L47 VanDerWaalsContact C-N 3.28Å; N45-L47 PolarHBondContact O-N 3.42Å; N45-L48 WeakPolarHBondContact O-CB 3.05Å; N45-L48 PolarHBondContact O-N 2.78Å; N45-N49 WeakPolarHBondContact O-CB 3.39Å; N45-N49 VanDerWaalsContact O-CG 3.29Å; N45-N49 PolarHBondContact O-N 3.43Å; N45-N49 PolarHBondContact O-ND2 2.83Å; N45-G383 PolarHBondContact ND2-O 3.32Å; N45-G383 PolarHBondContact OD1-O 3.38Å; N45-L384 WeakPolarHBondContact OD1-CA 3.37Å; N45-D385 HydrophobicContact CB-CB 4.19Å; N45-D385 WeakPolarHBondContact OD1-CB 3.5Å; N45-D385 PolarHBondContact OD1-N 3.01Å
46	K	74.2	Confident	67.6	Low	34 Å²	34	51.8 Å²	51.8	15%	0.148	26%	0.255	C	S	.	.	H	α-helix	trans	-69.6	-30.2	178.8	-75.3	173.1	152.3	160.8	0	110.9	S42 Y43 L44 L157 Q160 D229 E230	S42-K46 WeakPolarHBondContact O-CG 3.35Å; S42-K46 PolarHBondContact O-N 3.23Å; Y43-K46 PolarHBondContact O-N 3.28Å; L44-K46 PolarHBondContact O-N 3.26Å; K46-L157 HydrophobicContact CD-CD2 3.62Å; K46-Q160 HydrophobicContact CB-CG 4.49Å; K46-Q160 PolarHBondContact O-NE2 3.4Å; K46-D229 IonicContact NZ-OD2 2.89Å; K46-D229 PolarHBondContact NZ-OD2 2.64Å; K46-E230 WeakPolarHBondContact CE-OE1 3.33Å; K46-E230 IonicContact NZ-OE1 3.89Å; K46-E230 PolarHBondContact NZ-OE1 3.16Å
47	L	71.3	Confident	66.7	Low	58 Å²	58	56.1 Å²	56.1	30%	0.304	28%	0.278	S	S	.	.	H	α-helix	trans	-69.2	-42.2	170.6	-69.4	173	0	0	0	111.9	Y43 L44 N45 N49 Q160 E360	Y43-L47 HydrophobicContact CD1-CD1 3.98Å; Y43-L47 HydrophobicContact CE1-CD1 3.35Å; Y43-L47 HydrophobicContact CE1-CG 4.27Å; Y43-L47 HydrophobicContact CE2-CD1 4.24Å; Y43-L47 HydrophobicContact CE2-CG 4.36Å; Y43-L47 PolarHBondContact O-N 2.91Å; L44-L47 HydrophobicContact CD2-CD1 4.44Å; L44-L47 WeakPolarHBondContact O-CB 3.3Å; L44-L47 PolarHBondContact O-N 3.44Å; N45-L47 VanDerWaalsContact C-N 3.28Å; N45-L47 PolarHBondContact O-N 3.42Å; L47-N49 VanDerWaalsContact C-N 3.34Å; L47-N49 PolarHBondContact O-N 2.82Å; L47-Q160 VanDerWaalsContact N-NE2 3.19Å; L47-E360 HydrophobicContact CD1-CB 4.29Å; L47-E360 HydrophobicContact CD1-CG 3.86Å
48	L	64.4	Low	65.2	Low	7 Å²	7	59.6 Å²	59.6	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-40.2	178.2	-83.2	161.1	0	0	0	112.6	L44 N45 S50 I363 R367 D385 P387	L44-L48 WeakPolarHBondContact O-CB 3.41Å; L44-L48 WeakPolarHBondContact O-CD1 3.37Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.26Å; L44-L48 PolarHBondContact O-N 3.08Å; N45-L48 WeakPolarHBondContact O-CB 3.05Å; N45-L48 PolarHBondContact O-N 2.78Å; L48-S50 PolarHBondContact O-N 3.5Å; L48-I363 HydrophobicContact CD1-CD1 4.15Å; L48-I363 HydrophobicContact CD1-CG2 4.34Å; L48-I363 HydrophobicContact CD2-CB 4.39Å; L48-I363 HydrophobicContact CD2-CG2 3.09Å; L48-I363 HydrophobicContact CG-CG2 3.66Å; L48-R367 PolarHBondContact O-NH1 2.82Å; L48-D385 HydrophobicContact CB-CB 4.4Å; L48-D385 WeakPolarHBondContact CB-O 3.48Å; L48-D385 HydrophobicContact CD1-CB 4.4Å; L48-D385 WeakPolarHBondContact CD1-O 3.32Å; L48-D385 WeakPolarHBondContact CD2-O 3.14Å; L48-P387 HydrophobicContact CD2-CG 4.17Å
49	N	64.8	Low	64.3	Low	37 Å²	37	57.1 Å²	57.1	20%	0.198	29%	0.287	C	S	.	.			trans	-80	83.1	-175.4	-75.6	-40	0	0	0	112.8	N45 L47 K51 F53 D385	N45-N49 WeakPolarHBondContact O-CB 3.39Å; N45-N49 VanDerWaalsContact O-CG 3.29Å; N45-N49 PolarHBondContact O-N 3.43Å; N45-N49 PolarHBondContact O-ND2 2.83Å; L47-N49 VanDerWaalsContact C-N 3.34Å; L47-N49 PolarHBondContact O-N 2.82Å; N49-K51 VanDerWaalsContact C-N 3.28Å; N49-F53 WeakPolarHBondContact OD1-CE2 3.16Å; N49-F53 VanDerWaalsContact OD1-CZ 3.29Å; N49-F53 WeakPolarHBondContact OD1-CZ 3.26Å; N49-D385 VanDerWaalsContact CG-OD2 3.3Å; N49-D385 PolarHBondContact ND2-OD2 3.33Å; N49-D385 PolarHBondContact OD1-OD2 3.31Å
50	S	55.8	Low	63.5	Low	79 Å²	79	57.4 Å²	57.4	55%	0.552	29%	0.287	S	S	*	.	S	Bend	trans	-82.2	-4.9	171.4	89.7	0	0	0	0	113.8	L48 R367	L48-S50 PolarHBondContact O-N 3.5Å; S50-R367 VanDerWaalsContact CB-NH2 3.35Å; S50-R367 PolarHBondContact OG-NH2 3.34Å
51	K	56.5	Low	63.2	Low	166 Å²	166	59.2 Å²	59.2	72%	0.722	30%	0.295	S	S	*	.	S	Bend	trans	-134.7	148	178.9	-68.1	-173.2	179.2	-177.3	0	108.7	N49	N49-K51 VanDerWaalsContact C-N 3.28Å
52	L	53.5	Low	63	Low	50 Å²	50	61 Å²	61	26%	0.262	31%	0.305	S	S	.	.			trans	-66.8	140.8	172.1	-67.3	166.8	0	0	0	109.4	F95 G124	L52-F95 HydrophobicContact CD1-CD1 3.78Å; L52-F95 HydrophobicContact CD1-CE1 3.86Å; L52-F95 HydrophobicContact CG-CD1 4.4Å; L52-F95 HydrophobicContact CG-CE1 4.01Å; L52-G124 WeakPolarHBondContact CA-O 3.43Å
53	F	54.7	Low	63	Low	27 Å²	27	63.3 Å²	63.3	12%	0.118	32%	0.316	C	S	.	.			trans	-74	125.3	163.8	-70.4	-71.4	0	0	0	108.8	N49 T55 S123 G124 D385 R419	N49-F53 WeakPolarHBondContact OD1-CE2 3.16Å; N49-F53 VanDerWaalsContact OD1-CZ 3.29Å; N49-F53 WeakPolarHBondContact OD1-CZ 3.26Å; F53-T55 PolarHBondContact O-N 3.28Å; F53-S123 VanDerWaalsContact CD2-O 3.31Å; F53-S123 WeakPolarHBondContact CD2-O 3.31Å; F53-G124 PolarHBondContact N-O 3.09Å; F53-D385 WeakPolarHBondContact CE2-OD2 3.49Å; F53-D385 WeakPolarHBondContact CZ-OD2 3.24Å; F53-R419 VanDerWaalsContact CE1-NH1 3.26Å
54	E	47.4	Very low	62.5	Low	170 Å²	170	66.2 Å²	66.2	79%	0.794	33%	0.327	S	S	*	.			trans	-71.4	111.7	164.7	-71.1	-175.9	173.2	0	0	108
55	T	50.7	Low	62	Low	14 Å²	14	69.4 Å²	69.4	9%	0.086	35%	0.349	C	S	.	.			trans	-100.3	138.7	168.5	37.6	0	0	0	0	108.8	F53 F60 T100 T125	F53-T55 PolarHBondContact O-N 3.28Å; T55-F60 WeakPolarHBondContact OG1-CE2 3.21Å; T55-T100 PolarHBondContact O-OG1 3.5Å; T55-T125 HydrophobicContact CG2-CG2 3.87Å
56	H	50.2	Low	61.7	Low	139 Å²	139	72.6 Å²	72.6	64%	0.644	37%	0.366	S	S	*	.			trans	-76.8	145.1	178.6	-67.7	-59.9	0	0	0	110.2	L58 D59	H56-L58 PolarHBondContact O-N 3.3Å; H56-D59 PolarHBondContact N-OD2 3.07Å; H56-D59 WeakPolarHBondContact O-CB 3.34Å; H56-D59 PolarHBondContact O-N 2.94Å
57	D	51.2	Low	61.4	Low	100 Å²	100	75 Å²	75	54%	0.535	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-50.9	-32.8	-179.9	-68.1	-23.2	0	0	0	113.5	D59 F60 T100	D57-D59 PolarHBondContact O-N 3.06Å; D57-F60 PolarHBondContact O-N 3.1Å; D57-T100 VanDerWaalsContact OD1-CG2 3.25Å; D57-T100 WeakPolarHBondContact OD1-CG2 3.5Å
58	L	48.5	Very low	60.8	Low	144 Å²	144	78.9 Å²	78.9	75%	0.754	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-64.9	-19.1	-178.1	-68.8	167.1	0	0	0	113.7	H56 F60	H56-L58 PolarHBondContact O-N 3.3Å; L58-F60 VanDerWaalsContact C-N 3.33Å
59	D	58.2	Low	60.7	Low	37 Å²	37	81.4 Å²	81.4	20%	0.198	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-80.6	-13.1	-178.6	-63.7	-41.1	0	0	0	112.5	H56 D57 V284 K285 T287	H56-D59 PolarHBondContact N-OD2 3.07Å; H56-D59 WeakPolarHBondContact O-CB 3.34Å; H56-D59 PolarHBondContact O-N 2.94Å; D57-D59 PolarHBondContact O-N 3.06Å; D59-V284 CarbonylContact O-C 3.54Å; D59-V284 VanDerWaalsContact O-CA 3.28Å; D59-V284 WeakPolarHBondContact O-CA 3.45Å; D59-K285 PolarHBondContact O-N 3.42Å; D59-T287 PolarHBondContact OD1-OG1 2.9Å
60	F	63.9	Low	60.4	Low	14 Å²	14	83.2 Å²	83.2	6%	0.061	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	142.1	-179.8	-70.2	-87.5	0	0	0	113.4	T55 D57 L58 T100 I101 R283 V284	T55-F60 WeakPolarHBondContact OG1-CE2 3.21Å; D57-F60 PolarHBondContact O-N 3.1Å; L58-F60 VanDerWaalsContact C-N 3.33Å; F60-T100 HydrophobicContact CD2-CG2 3.5Å; F60-T100 HydrophobicContact CE2-CG2 3.63Å; F60-I101 HydrophobicContact CZ-CB 4.41Å; F60-R283 CarbonylContact C-O 3.59Å; F60-R283 WeakPolarHBondContact CA-O 3.42Å; F60-V284 HydrophobicContact CD1-CG2 3.79Å; F60-V284 HydrophobicContact CE1-CG2 3.33Å; F60-V284 HydrophobicContact CE2-CG2 4.47Å; F60-V284 HydrophobicContact CZ-CG2 3.72Å
61	E	73.3	Confident	61	Low	85 Å²	85	81.5 Å²	81.5	40%	0.397	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.5	164.5	-176.7	177	-166	0	0	108.3	L63 R283 K285	E61-L63 HydrophobicContact CG-CD2 4.11Å; E61-L63 HydrophobicContact CG-CG 4.24Å; E61-R283 PolarHBondContact N-O 3.31Å; E61-R283 PolarHBondContact O-N 3.45Å; E61-K285 HydrophobicContact CB-CG 4.26Å
62	I	75.3	Confident	61.6	Low	63 Å²	63	79.9 Å²	79.9	32%	0.323	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.9	176.7	-49.3	173.6	0	0	0	108.2	R64 L71 Q104 I280 E281 F282	I62-R64 HydrophobicContact CG2-CG 4.43Å; I62-L71 HydrophobicContact CD1-CD1 4.44Å; I62-L71 HydrophobicContact CG2-CD1 3.62Å; I62-Q104 HydrophobicContact CD1-CB 4.35Å; I62-Q104 HydrophobicContact CD1-CG 4.29Å; I62-I280 HydrophobicContact CG2-CG2 4.08Å; I62-E281 CarbonylContact C-O 3.52Å; I62-E281 VanDerWaalsContact CA-O 3.29Å; I62-E281 WeakPolarHBondContact CA-O 3.3Å; I62-F282 HydrophobicContact CD1-CD1 4.45Å; I62-F282 HydrophobicContact CD1-CE1 3.98Å; I62-F282 HydrophobicContact CG1-CD1 3.93Å; I62-F282 HydrophobicContact CG1-CE1 3.91Å; I62-F282 HydrophobicContact CG2-CD1 4.32Å; I62-F282 HydrophobicContact CG2-CE1 3.95Å; I62-F282 HydrophobicContact CG2-CZ 4.45Å
63	L	76.6	Confident	62.7	Low	54 Å²	54	81.6 Å²	81.6	28%	0.283	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.1	173.2	-55.1	171	0	0	0	109.5	E61 E281	E61-L63 HydrophobicContact CG-CD2 4.11Å; E61-L63 HydrophobicContact CG-CG 4.24Å; L63-E281 HydrophobicContact CB-CB 4.11Å; L63-E281 PolarHBondContact N-O 3.11Å; L63-E281 PolarHBondContact O-N 3.38Å
64	R	72.4	Confident	64	Low	99 Å²	99	80.8 Å²	80.8	37%	0.374	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.1	-177.8	-66.7	179.7	-72.7	159.3	7.3	109.4	I62 D66 P67 H69 L71 I280	I62-R64 HydrophobicContact CG2-CG 4.43Å; R64-D66 VanDerWaalsContact C-N 3.31Å; R64-P67 PolarHBondContact NH1-O 3.44Å; R64-P67 PolarHBondContact NH2-O 3.09Å; R64-H69 PolarHBondContact NH1-O 3.49Å; R64-L71 HydrophobicContact CG-CD1 4.22Å; R64-I280 HydrophobicContact CG-CG2 4.5Å
65	S	65.3	Low	65.7	Low	69 Å²	69	81.6 Å²	81.6	48%	0.483	42%	0.42	S	S	.	.	S	Bend	trans	-65.2	-35.7	168.8	52	0	0	0	0	112	N278 P279	S65-N278 PolarHBondContact OG-O 2.98Å; S65-P279 PolarHBondContact N-O 3.46Å; S65-P279 PolarHBondContact OG-O 3.4Å
66	D	68.5	Low	67.4	Low	79 Å²	79	83 Å²	83	42%	0.422	43%	0.429	S	S	.	.			trans	-118.9	107.1	169.8	-172.8	-4.8	0	0	0	111.3	R64 N68 H69	R64-D66 VanDerWaalsContact C-N 3.31Å; D66-N68 PolarHBondContact O-N 3.37Å; D66-N68 WeakPolarHBondContact OD1-CB 3.4Å; D66-N68 PolarHBondContact OD1-N 2.63Å; D66-N68 PolarHBondContact OD1-ND2 3.07Å; D66-H69 PolarHBondContact O-N 2.95Å
67	P	66.8	Low	69.2	Low	83 Å²	83	76.7 Å²	76.7	54%	0.539	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19	177.2	-21.5	32.5	0	0	0	114.5	R64	R64-P67 PolarHBondContact NH1-O 3.44Å; R64-P67 PolarHBondContact NH2-O 3.09Å
68	N	59.9	Low	70.9	Confident	140 Å²	140	78.2 Å²	78.2	75%	0.749	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-14.2	-174.9	-59.1	-57.3	0	0	0	113.3	D66 P70	D66-N68 PolarHBondContact O-N 3.37Å; D66-N68 WeakPolarHBondContact OD1-CB 3.4Å; D66-N68 PolarHBondContact OD1-N 2.63Å; D66-N68 PolarHBondContact OD1-ND2 3.07Å; N68-P70 VanDerWaalsContact O-CD 3.24Å; N68-P70 WeakPolarHBondContact O-CD 3.44Å
69	H	61.1	Low	72.8	Confident	60 Å²	60	76.4 Å²	76.4	28%	0.278	39%	0.391	S	S	.	.	S	Bend	trans	-77.8	113.3	176.4	-158.1	-68.9	0	0	0	109.4	R64 D66 L71 Q115	R64-H69 PolarHBondContact NH1-O 3.49Å; D66-H69 PolarHBondContact O-N 2.95Å; H69-L71 PolarHBondContact O-N 2.99Å; H69-Q115 PolarHBondContact CD2-NE2 3.34Å; H69-Q115 PolarHBondContact CE1-NE2 3.34Å; H69-Q115 PolarHBondContact ND1-NE2 2.96Å; H69-Q115 VanDerWaalsContact ND1-NE2 3.12Å; H69-Q115 PolarHBondContact NE2-NE2 3.25Å; H69-Q115 VanDerWaalsContact NE2-NE2 3.16Å
70	P	58.6	Low	74.1	Confident	76 Å²	76	75.4 Å²	75.4	49%	0.494	39%	0.385	S	S	.	.			trans	-63.6	132.3	179.9	26	-31.9	0	0	0	109.5	N68	N68-P70 VanDerWaalsContact O-CD 3.24Å; N68-P70 WeakPolarHBondContact O-CD 3.44Å
71	L	67.5	Low	75.2	Confident	43 Å²	43	82 Å²	82	23%	0.225	42%	0.422	C	S	.	.			trans	-90.8	117.2	164.7	-66.8	175.5	0	0	0	106.9	I62 R64 H69 S73 S108 I280	I62-L71 HydrophobicContact CD1-CD1 4.44Å; I62-L71 HydrophobicContact CG2-CD1 3.62Å; R64-L71 HydrophobicContact CG-CD1 4.22Å; H69-L71 PolarHBondContact O-N 2.99Å; L71-S73 PolarHBondContact O-N 2.99Å; L71-S108 WeakPolarHBondContact CD2-OG 3.4Å; L71-I280 HydrophobicContact CD1-CG2 4.44Å; L71-I280 HydrophobicContact CD2-CD1 3.68Å; L71-I280 HydrophobicContact CD2-CG1 4.38Å
72	H	69.8	Low	76	Confident	132 Å²	132	78.6 Å²	78.6	61%	0.611	41%	0.406	S	S	*	.			trans	-87.8	105.5	171.9	-71	-74.7	0	0	0	108.1	S107	H72-S107 WeakPolarHBondContact O-CB 3.4Å; H72-S107 PolarHBondContact O-OG 2.85Å
73	S	76.4	Confident	76.8	Confident	85 Å²	85	79.9 Å²	79.9	59%	0.594	41%	0.409	S	S	*	.			trans	-72.4	141.2	169.2	52.9	0	0	0	0	109.9	L71 E103	L71-S73 PolarHBondContact O-N 2.99Å; S73-E103 VanDerWaalsContact CA-O 3.29Å; S73-E103 WeakPolarHBondContact CA-O 3.37Å
74	V	81.6	Confident	77.6	Confident	10 Å²	10	84.1 Å²	84.1	6%	0.061	43%	0.427	C	S	.	.			trans	-113.9	146.5	174.1	-65.6	0	0	0	0	109.5	E79 L80 E103	V74-E79 VanDerWaalsContact CA-OE2 3.29Å; V74-E79 WeakPolarHBondContact CA-OE2 3.43Å; V74-E79 HydrophobicContact CB-CB 4Å; V74-E79 HydrophobicContact CG1-CB 3.83Å; V74-L80 HydrophobicContact CB-CD2 4.32Å; V74-L80 HydrophobicContact CB-CG 4.44Å; V74-L80 HydrophobicContact CG1-CD2 3.84Å; V74-L80 HydrophobicContact CG1-CG 4.29Å; V74-L80 HydrophobicContact CG2-CD1 4.2Å; V74-L80 HydrophobicContact CG2-CD2 3.68Å; V74-L80 HydrophobicContact CG2-CG 3.85Å; V74-E103 PolarHBondContact N-O 2.91Å; V74-E103 WeakPolarHBondContact O-CA 3.42Å; V74-E103 WeakPolarHBondContact O-CB 3.42Å; V74-E103 WeakPolarHBondContact O-CG 3.25Å
75	R	83.1	Confident	78.7	Confident	187 Å²	187	82 Å²	82	71%	0.706	43%	0.426	S	S	*	.	S	Bend	trans	-103.7	-14.1	177.2	-67.9	-172.7	174.1	-170.7	-2.3	113.4	E79 P98	R75-E79 PolarHBondContact N-OE2 2.86Å; R75-P98 WeakPolarHBondContact O-CD 3.3Å
76	T	87.7	Confident	80.1	Confident	44 Å²	44	78.7 Å²	78.7	27%	0.27	40%	0.403	S	S	.	.	S	Bend	trans	-137.1	151.7	-177.2	66.9	0	0	0	0	110.1	Q78 E79	T76-Q78 PolarHBondContact O-N 3.3Å; T76-E79 PolarHBondContact O-N 3.08Å; T76-E79 VanDerWaalsContact OG1-CD 3.28Å; T76-E79 WeakPolarHBondContact OG1-CG 3.46Å; T76-E79 PolarHBondContact OG1-N 2.98Å; T76-E79 PolarHBondContact OG1-OE1 2.81Å
77	F	88.2	Confident	81.3	Confident	7 Å²	7	76.1 Å²	76.1	3%	0.031	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-66.8	-23.6	175	-69.8	-67.7	0	0	0	112.2	E79 L80 L87 I90 F95 K97 P98 L106 L133	F77-E79 VanDerWaalsContact C-N 3.31Å; F77-E79 PolarHBondContact O-N 3.1Å; F77-L80 HydrophobicContact CD1-CD1 4.1Å; F77-L80 WeakPolarHBondContact O-CB 3.42Å; F77-L80 PolarHBondContact O-N 2.86Å; F77-L87 HydrophobicContact CB-CD2 3.75Å; F77-I90 HydrophobicContact CD1-CG2 4.48Å; F77-I90 HydrophobicContact CD2-CG2 3.91Å; F77-I90 HydrophobicContact CE1-CG2 4.32Å; F77-I90 HydrophobicContact CE2-CG2 3.7Å; F77-I90 HydrophobicContact CG-CG2 4.3Å; F77-I90 HydrophobicContact CZ-CG2 3.93Å; F77-F95 HydrophobicContact CE2-CB 4.07Å; F77-F95 HydrophobicContact CZ-CB 4.37Å; F77-K97 WeakPolarHBondContact CE2-O 3.37Å; F77-P98 HydrophobicContact CD1-CG 4.03Å; F77-P98 HydrophobicContact CD2-CG 4.38Å; F77-P98 HydrophobicContact CE1-CB 3.99Å; F77-P98 HydrophobicContact CE1-CG 3.97Å; F77-P98 HydrophobicContact CE2-CG 4.34Å; F77-P98 HydrophobicContact CG-CG 4.22Å; F77-P98 HydrophobicContact CZ-CB 4.05Å; F77-P98 HydrophobicContact CZ-CG 4.14Å; F77-L106 HydrophobicContact CD1-CD1 4.37Å; F77-L106 HydrophobicContact CE1-CD1 4Å; F77-L133 HydrophobicContact CD1-CD1 3.97Å; F77-L133 HydrophobicContact CE1-CD1 3.73Å
78	Q	87	Confident	82.6	Confident	131 Å²	131	78 Å²	78	61%	0.612	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-66.4	-31.6	177.7	-68.5	80.8	-3.7	0	0	112.3	T76 L80 N81	T76-Q78 PolarHBondContact O-N 3.3Å; Q78-L80 PolarHBondContact O-N 2.78Å; Q78-N81 PolarHBondContact O-N 3.18Å
79	E	87.4	Confident	84.2	Confident	107 Å²	107	71.3 Å²	71.3	50%	0.5	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67.3	-16.4	176.3	-74.5	158	-134.3	0	0	113.3	V74 R75 T76 F77 N81	V74-E79 VanDerWaalsContact CA-OE2 3.29Å; V74-E79 WeakPolarHBondContact CA-OE2 3.43Å; V74-E79 HydrophobicContact CB-CB 4Å; V74-E79 HydrophobicContact CG1-CB 3.83Å; R75-E79 PolarHBondContact N-OE2 2.86Å; T76-E79 PolarHBondContact O-N 3.08Å; T76-E79 VanDerWaalsContact OG1-CD 3.28Å; T76-E79 WeakPolarHBondContact OG1-CG 3.46Å; T76-E79 PolarHBondContact OG1-N 2.98Å; T76-E79 PolarHBondContact OG1-OE1 2.81Å; F77-E79 VanDerWaalsContact C-N 3.31Å; F77-E79 PolarHBondContact O-N 3.1Å; E79-N81 VanDerWaalsContact C-N 3.32Å
80	L	86.7	Confident	85.6	Confident	15 Å²	15	68.6 Å²	68.6	8%	0.079	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-84.3	-2.4	-178.6	-69	170.5	0	0	0	114	V74 F77 Q78 L82 L106 I110	V74-L80 HydrophobicContact CB-CD2 4.32Å; V74-L80 HydrophobicContact CB-CG 4.44Å; V74-L80 HydrophobicContact CG1-CD2 3.84Å; V74-L80 HydrophobicContact CG1-CG 4.29Å; V74-L80 HydrophobicContact CG2-CD1 4.2Å; V74-L80 HydrophobicContact CG2-CD2 3.68Å; V74-L80 HydrophobicContact CG2-CG 3.85Å; F77-L80 HydrophobicContact CD1-CD1 4.1Å; F77-L80 WeakPolarHBondContact O-CB 3.42Å; F77-L80 PolarHBondContact O-N 2.86Å; Q78-L80 PolarHBondContact O-N 2.78Å; L80-L82 HydrophobicContact CB-CD1 4.22Å; L80-L82 HydrophobicContact CB-CD2 4.09Å; L80-L82 HydrophobicContact CB-CG 3.75Å; L80-L82 HydrophobicContact CD1-CD1 4.28Å; L80-L82 PolarHBondContact O-N 2.88Å; L80-L106 HydrophobicContact CD1-CB 3.75Å; L80-L106 HydrophobicContact CD1-CD1 3.49Å; L80-L106 VanDerWaalsContact CD1-CD1 3.49Å; L80-L106 HydrophobicContact CD1-CG 4.25Å; L80-L106 HydrophobicContact CD2-CB 3.8Å; L80-L106 HydrophobicContact CG-CB 4.46Å; L80-I110 HydrophobicContact CB-CD1 3.8Å; L80-I110 HydrophobicContact CD2-CD1 3.8Å; L80-I110 HydrophobicContact CG-CD1 4.27Å; L80-I110 WeakPolarHBondContact O-CD1 3.48Å
81	N	86.3	Confident	87.1	Confident	154 Å²	154	66.9 Å²	66.9	82%	0.824	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	40	-178.9	-165.2	36.5	0	0	0	113.4	Q78 E79	Q78-N81 PolarHBondContact O-N 3.18Å; E79-N81 VanDerWaalsContact C-N 3.32Å
82	L	89.9	Confident	88.2	Confident	13 Å²	13	67.7 Å²	67.7	7%	0.068	35%	0.346	C	S	.	.			trans	-71.4	155.5	178.9	-59.5	178.8	0	0	0	111.2	L80 E84 L86 L87 I90 I110 L133 S137	L80-L82 HydrophobicContact CB-CD1 4.22Å; L80-L82 HydrophobicContact CB-CD2 4.09Å; L80-L82 HydrophobicContact CB-CG 3.75Å; L80-L82 HydrophobicContact CD1-CD1 4.28Å; L80-L82 PolarHBondContact O-N 2.88Å; L82-E84 PolarHBondContact O-N 3.01Å; L82-L86 HydrophobicContact CB-CD2 4.41Å; L82-L86 HydrophobicContact CD1-CD2 4.39Å; L82-L86 HydrophobicContact CD2-CD2 4.31Å; L82-L87 HydrophobicContact CB-CD2 3.96Å; L82-L87 HydrophobicContact CB-CG 3.95Å; L82-L87 HydrophobicContact CD1-CD2 3.93Å; L82-L87 HydrophobicContact CG-CD2 4.38Å; L82-I90 HydrophobicContact CD1-CD1 3.96Å; L82-I110 HydrophobicContact CD2-CD1 3.63Å; L82-L133 HydrophobicContact CD1-CD1 4.09Å; L82-L133 HydrophobicContact CD1-CD2 3.83Å; L82-L133 HydrophobicContact CD1-CG 4.15Å; L82-L133 HydrophobicContact CD2-CD2 3.87Å; L82-S137 VanDerWaalsContact CD2-OG 3.22Å; L82-S137 WeakPolarHBondContact CD2-OG 3.47Å
83	K	91.3	Very high	89	Confident	89 Å²	89	63.4 Å²	63.4	39%	0.387	33%	0.327	S	S	.	.			trans	-58.6	132.6	172.5	-61.4	176.5	-176.5	170.7	0	109.6	P85 L86 L87 I139 M172	K83-P85 VanDerWaalsContact C-CD 3.43Å; K83-P85 VanDerWaalsContact C-N 3.32Å; K83-P85 VanDerWaalsContact O-N 3.16Å; K83-L86 WeakPolarHBondContact O-CA 3.48Å; K83-L86 VanDerWaalsContact O-CB 3.29Å; K83-L86 WeakPolarHBondContact O-CB 3.29Å; K83-L86 PolarHBondContact O-N 2.75Å; K83-L87 PolarHBondContact O-N 2.87Å; K83-I139 PolarHBondContact NZ-O 2.78Å; K83-M172 HydrophobicContact CD-CE 4.17Å
84	E	93.6	Very high	89.4	Confident	144 Å²	144	61.2 Å²	61.2	67%	0.673	32%	0.318	S	S	*	.	H	α-helix	trans	-48.5	-42.6	-179.7	-76.5	-62.6	152.1	0	0	114.8	L82 L86 L87 K88	L82-E84 PolarHBondContact O-N 3.01Å; E84-L86 VanDerWaalsContact C-N 3.27Å; E84-L86 PolarHBondContact O-N 3.26Å; E84-L87 PolarHBondContact O-N 3.1Å; E84-K88 PolarHBondContact O-N 3.2Å
85	P	95.3	Very high	89.5	Confident	54 Å²	54	62.6 Å²	62.6	35%	0.351	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-31.3	176.5	-22.5	34.3	0	0	0	114	K83 G89 F171 M172	K83-P85 VanDerWaalsContact C-CD 3.43Å; K83-P85 VanDerWaalsContact C-N 3.32Å; K83-P85 VanDerWaalsContact O-N 3.16Å; P85-G89 PolarHBondContact O-N 2.79Å; P85-G89 VanDerWaalsContact O-N 3.08Å; P85-F171 HydrophobicContact CB-CB 4.04Å; P85-F171 WeakPolarHBondContact CB-O 3.39Å; P85-M172 HydrophobicContact CB-CG 3.78Å
86	L	95.1	Very high	89.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-70.4	-44.2	175.6	179.6	57.3	0	0	0	110.8	L82 K83 E84 K88 G89 I90 L136 M168 M172	L82-L86 HydrophobicContact CB-CD2 4.41Å; L82-L86 HydrophobicContact CD1-CD2 4.39Å; L82-L86 HydrophobicContact CD2-CD2 4.31Å; K83-L86 WeakPolarHBondContact O-CA 3.48Å; K83-L86 VanDerWaalsContact O-CB 3.29Å; K83-L86 WeakPolarHBondContact O-CB 3.29Å; K83-L86 PolarHBondContact O-N 2.75Å; E84-L86 VanDerWaalsContact C-N 3.27Å; E84-L86 PolarHBondContact O-N 3.26Å; L86-K88 VanDerWaalsContact C-N 3.28Å; L86-K88 PolarHBondContact O-N 2.87Å; L86-G89 PolarHBondContact O-N 2.86Å; L86-G89 VanDerWaalsContact O-N 3.09Å; L86-I90 HydrophobicContact CD1-CD1 4.15Å; L86-I90 HydrophobicContact CD1-CG1 4.31Å; L86-I90 HydrophobicContact CG-CD1 3.93Å; L86-I90 VanDerWaalsContact O-CG1 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.93Å; L86-L136 HydrophobicContact CD1-CB 3.92Å; L86-L136 HydrophobicContact CD1-CD1 3.72Å; L86-L136 HydrophobicContact CD1-CG 4.45Å; L86-L136 HydrophobicContact CD2-CB 4.02Å; L86-M168 HydrophobicContact CD1-CG 3.8Å; L86-M168 HydrophobicContact CD1-SD 4.26Å; L86-M172 HydrophobicContact CB-SD 3.96Å; L86-M172 HydrophobicContact CD1-SD 4.32Å
87	L	93.7	Very high	89.3	Confident	24 Å²	24	67.3 Å²	67.3	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-43.4	174.2	-70.5	173.8	0	0	0	111.6	F77 L82 K83 E84 G89 I90 A91	F77-L87 HydrophobicContact CB-CD2 3.75Å; L82-L87 HydrophobicContact CB-CD2 3.96Å; L82-L87 HydrophobicContact CB-CG 3.95Å; L82-L87 HydrophobicContact CD1-CD2 3.93Å; L82-L87 HydrophobicContact CG-CD2 4.38Å; K83-L87 PolarHBondContact O-N 2.87Å; E84-L87 PolarHBondContact O-N 3.1Å; L87-G89 VanDerWaalsContact C-N 3.31Å; L87-G89 PolarHBondContact O-N 2.87Å; L87-I90 PolarHBondContact O-N 3.18Å; L87-A91 WeakPolarHBondContact O-CB 3.27Å; L87-A91 PolarHBondContact O-N 2.8Å
88	K	94.1	Very high	89.1	Confident	122 Å²	122	67.3 Å²	67.3	53%	0.53	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-39	176.1	-165.6	-176.9	175.6	-177.1	0	112.2	E84 L86 A92 F171	E84-K88 PolarHBondContact O-N 3.2Å; L86-K88 VanDerWaalsContact C-N 3.28Å; L86-K88 PolarHBondContact O-N 2.87Å; K88-A92 WeakPolarHBondContact O-CB 3.45Å; K88-A92 PolarHBondContact O-N 2.93Å; K88-F171 HydrophobicContact CB-CD2 3.76Å; K88-F171 HydrophobicContact CB-CE2 4.15Å; K88-F171 HydrophobicContact CB-CG 4.3Å; K88-F171 HydrophobicContact CD-CB 4.48Å; K88-F171 HydrophobicContact CD-CD1 3.82Å; K88-F171 HydrophobicContact CD-CD2 3.79Å; K88-F171 HydrophobicContact CD-CE1 3.93Å; K88-F171 HydrophobicContact CD-CE2 3.91Å; K88-F171 HydrophobicContact CD-CG 3.75Å; K88-F171 HydrophobicContact CD-CZ 3.98Å; K88-F171 VanDerWaalsContact CE-CE1 3.48Å; K88-F171 HydrophobicContact CG-CD2 3.63Å; K88-F171 HydrophobicContact CG-CE1 4.48Å; K88-F171 HydrophobicContact CG-CE2 3.58Å; K88-F171 HydrophobicContact CG-CG 4.12Å; K88-F171 HydrophobicContact CG-CZ 4.04Å
89	G	93.7	Very high	88.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-45.8	177.5	0	0	0	0	0	112.4	P85 L86 L87 A91 A92 M93 M168	P85-G89 PolarHBondContact O-N 2.79Å; P85-G89 VanDerWaalsContact O-N 3.08Å; L86-G89 PolarHBondContact O-N 2.86Å; L86-G89 VanDerWaalsContact O-N 3.09Å; L87-G89 VanDerWaalsContact C-N 3.31Å; L87-G89 PolarHBondContact O-N 2.87Å; G89-A91 VanDerWaalsContact C-N 3.35Å; G89-A91 PolarHBondContact O-N 3.34Å; G89-A92 PolarHBondContact O-N 3.48Å; G89-M93 WeakPolarHBondContact O-CG 3.38Å; G89-M93 PolarHBondContact O-N 3.15Å; G89-M168 WeakPolarHBondContact CA-O 3.28Å
90	I	91.1	Very high	88.5	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.015	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-46.1	175.2	-66.7	164.1	0	0	0	110.6	F77 L82 L86 L87 A92 M93 F95 L133 M168	F77-I90 HydrophobicContact CD1-CG2 4.48Å; F77-I90 HydrophobicContact CD2-CG2 3.91Å; F77-I90 HydrophobicContact CE1-CG2 4.32Å; F77-I90 HydrophobicContact CE2-CG2 3.7Å; F77-I90 HydrophobicContact CG-CG2 4.3Å; F77-I90 HydrophobicContact CZ-CG2 3.93Å; L82-I90 HydrophobicContact CD1-CD1 3.96Å; L86-I90 HydrophobicContact CD1-CD1 4.15Å; L86-I90 HydrophobicContact CD1-CG1 4.31Å; L86-I90 HydrophobicContact CG-CD1 3.93Å; L86-I90 VanDerWaalsContact O-CG1 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.93Å; L87-I90 PolarHBondContact O-N 3.18Å; I90-A92 PolarHBondContact O-N 3.01Å; I90-M93 PolarHBondContact O-N 2.79Å; I90-F95 HydrophobicContact CG2-CB 3.57Å; I90-F95 HydrophobicContact CG2-CD2 4.25Å; I90-F95 HydrophobicContact CG2-CG 4.44Å; I90-F95 WeakPolarHBondContact O-CB 3.39Å; I90-F95 PolarHBondContact O-N 3.13Å; I90-F95 VanDerWaalsContact O-N 3.16Å; I90-L133 HydrophobicContact CD1-CD1 3.49Å; I90-L133 VanDerWaalsContact CD1-CD1 3.49Å; I90-L133 HydrophobicContact CD1-CG 3.97Å; I90-L133 HydrophobicContact CG1-CD1 4.43Å; I90-M168 HydrophobicContact CG1-CG 3.95Å; I90-M168 HydrophobicContact CG1-SD 4.31Å
91	A	90.1	Very high	88.2	Confident	41 Å²	41	56.7 Å²	56.7	34%	0.339	30%	0.295	S	S	.	.	H	α-helix	trans	-64.1	-39.7	177.4	0	0	0	0	0	112.9	L87 G89 M93 G94	L87-A91 WeakPolarHBondContact O-CB 3.27Å; L87-A91 PolarHBondContact O-N 2.8Å; G89-A91 VanDerWaalsContact C-N 3.35Å; G89-A91 PolarHBondContact O-N 3.34Å; A91-M93 PolarHBondContact O-N 2.83Å; A91-G94 WeakPolarHBondContact O-CA 3.46Å; A91-G94 PolarHBondContact O-N 3.17Å
92	A	90.2	Very high	88.2	Confident	60 Å²	60	49.5 Å²	49.5	50%	0.496	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-23.7	177.4	0	0	0	0	0	113.2	K88 G89 I90 G94 F171	K88-A92 WeakPolarHBondContact O-CB 3.45Å; K88-A92 PolarHBondContact O-N 2.93Å; G89-A92 PolarHBondContact O-N 3.48Å; I90-A92 PolarHBondContact O-N 3.01Å; A92-G94 PolarHBondContact O-N 2.89Å; A92-F171 HydrophobicContact CB-CE2 3.91Å; A92-F171 HydrophobicContact CB-CZ 4.41Å
93	M	87.1	Confident	88	Confident	42 Å²	42	51 Å²	51	21%	0.207	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.8	170.9	-62.9	176.1	75.5	0	0	113.2	G89 I90 A91 F95 V164 Q167 M168	G89-M93 WeakPolarHBondContact O-CG 3.38Å; G89-M93 PolarHBondContact O-N 3.15Å; I90-M93 PolarHBondContact O-N 2.79Å; A91-M93 PolarHBondContact O-N 2.83Å; M93-F95 HydrophobicContact CB-CD2 3.87Å; M93-F95 HydrophobicContact CB-CE2 3.84Å; M93-F95 HydrophobicContact CB-CG 4.47Å; M93-F95 HydrophobicContact CB-CZ 4.39Å; M93-F95 HydrophobicContact CE-CE2 3.75Å; M93-F95 HydrophobicContact CE-CZ 4.28Å; M93-F95 HydrophobicContact SD-CD2 4.47Å; M93-F95 HydrophobicContact SD-CE2 4.05Å; M93-V164 HydrophobicContact CE-CG1 3.87Å; M93-Q167 HydrophobicContact CE-CB 4.11Å; M93-Q167 HydrophobicContact CG-CB 4.33Å; M93-Q167 HydrophobicContact SD-CB 4.13Å; M93-M168 WeakPolarHBondContact SD-CA 3.33Å; M93-M168 HydrophobicContact SD-CB 3.65Å; M93-M168 HydrophobicContact SD-CE 4.4Å; M93-M168 HydrophobicContact SD-CG 4.22Å; M93-M168 PolarHBondContact SD-N 3.15Å; M93-M168 VanDerWaalsContact SD-N 3.43Å
94	G	83.9	Confident	87.6	Confident	39 Å²	39	48.2 Å²	48.2	40%	0.402	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	11.9	-178.3	0	0	0	0	0	114.5	A91 A92 Y96	A91-G94 WeakPolarHBondContact O-CA 3.46Å; A91-G94 PolarHBondContact O-N 3.17Å; A92-G94 PolarHBondContact O-N 2.89Å; G94-Y96 VanDerWaalsContact O-CD2 3.25Å; G94-Y96 WeakPolarHBondContact O-CD2 3.24Å; G94-Y96 WeakPolarHBondContact O-CE2 3.49Å; G94-Y96 PolarHBondContact O-N 3.49Å
95	F	84	Confident	87.3	Confident	39 Å²	39	41.3 Å²	41.3	17%	0.171	22%	0.219	C	C	.	.			trans	-88.9	97.4	176.6	-55.8	-37.2	0	0	0	110.3	L52 F77 I90 M93 A129	L52-F95 HydrophobicContact CD1-CD1 3.78Å; L52-F95 HydrophobicContact CD1-CE1 3.86Å; L52-F95 HydrophobicContact CG-CD1 4.4Å; L52-F95 HydrophobicContact CG-CE1 4.01Å; F77-F95 HydrophobicContact CE2-CB 4.07Å; F77-F95 HydrophobicContact CZ-CB 4.37Å; I90-F95 HydrophobicContact CG2-CB 3.57Å; I90-F95 HydrophobicContact CG2-CD2 4.25Å; I90-F95 HydrophobicContact CG2-CG 4.44Å; I90-F95 WeakPolarHBondContact O-CB 3.39Å; I90-F95 PolarHBondContact O-N 3.13Å; I90-F95 VanDerWaalsContact O-N 3.16Å; M93-F95 HydrophobicContact CB-CD2 3.87Å; M93-F95 HydrophobicContact CB-CE2 3.84Å; M93-F95 HydrophobicContact CB-CG 4.47Å; M93-F95 HydrophobicContact CB-CZ 4.39Å; M93-F95 HydrophobicContact CE-CE2 3.75Å; M93-F95 HydrophobicContact CE-CZ 4.28Å; M93-F95 HydrophobicContact SD-CD2 4.47Å; M93-F95 HydrophobicContact SD-CE2 4.05Å; F95-A129 HydrophobicContact CE2-CB 4.33Å
96	Y	81.3	Confident	87.1	Confident	176 Å²	176	38.8 Å²	38.8	69%	0.69	20%	0.202	S	C	*	.			trans	-95.9	-21.4	-179.4	-59.2	-74.5	0	0	0	113.7	G94	G94-Y96 VanDerWaalsContact O-CD2 3.25Å; G94-Y96 WeakPolarHBondContact O-CD2 3.24Å; G94-Y96 WeakPolarHBondContact O-CE2 3.49Å; G94-Y96 PolarHBondContact O-N 3.49Å
97	K	84.9	Confident	86.8	Confident	153 Å²	153	39.7 Å²	39.7	67%	0.665	21%	0.209	S	C	*	.	S	Bend	trans	-137.3	148.1	175.8	-67.8	-174.9	178.2	-178.7	0	109.9	F77	F77-K97 WeakPolarHBondContact CE2-O 3.37Å
98	P	85.4	Confident	86.6	Confident	8 Å²	8	39 Å²	39	5%	0.052	21%	0.206	C	C	.	.			trans	-63.6	147.9	172.9	-11.6	25.8	0	0	0	110.7	R75 F77 Q102 E103	R75-P98 WeakPolarHBondContact O-CD 3.3Å; F77-P98 HydrophobicContact CD1-CG 4.03Å; F77-P98 HydrophobicContact CD2-CG 4.38Å; F77-P98 HydrophobicContact CE1-CB 3.99Å; F77-P98 HydrophobicContact CE1-CG 3.97Å; F77-P98 HydrophobicContact CE2-CG 4.34Å; F77-P98 HydrophobicContact CG-CG 4.22Å; F77-P98 HydrophobicContact CZ-CB 4.05Å; F77-P98 HydrophobicContact CZ-CG 4.14Å; P98-Q102 HydrophobicContact CB-CB 3.62Å; P98-E103 HydrophobicContact CB-CG 3.8Å; P98-E103 HydrophobicContact CG-CG 4.29Å
99	S	81.9	Confident	86.5	Confident	14 Å²	14	33.2 Å²	33.2	10%	0.098	18%	0.181	C	C	.	.			trans	-72.6	165.9	166.1	69.6	0	0	0	0	111.3	I101 Q102 E103 T125	S99-I101 VanDerWaalsContact C-N 3.27Å; S99-I101 PolarHBondContact O-N 2.82Å; S99-I101 VanDerWaalsContact O-N 3.15Å; S99-I101 WeakPolarHBondContact OG-CG2 3.24Å; S99-Q102 CarbonylContact O-C 3.54Å; S99-Q102 WeakPolarHBondContact O-CA 3.38Å; S99-Q102 VanDerWaalsContact O-CB 3.31Å; S99-Q102 WeakPolarHBondContact O-CB 3.34Å; S99-Q102 PolarHBondContact O-N 2.91Å; S99-Q102 WeakPolarHBondContact OG-CG 3.31Å; S99-E103 WeakPolarHBondContact O-CG 3.36Å; S99-E103 PolarHBondContact O-N 3.15Å; S99-T125 WeakPolarHBondContact CB-O 3.37Å; S99-T125 PolarHBondContact OG-O 3.01Å
100	T	79.2	Confident	86.4	Confident	16 Å²	16	34.8 Å²	34.8	10%	0.098	19%	0.189	C	C	.	.	H	α-helix	trans	-49	-44.9	-179.9	-49.6	0	0	0	0	113.6	T55 D57 F60 Q102 Q104	T55-T100 PolarHBondContact O-OG1 3.5Å; D57-T100 VanDerWaalsContact OD1-CG2 3.25Å; D57-T100 WeakPolarHBondContact OD1-CG2 3.5Å; F60-T100 HydrophobicContact CD2-CG2 3.5Å; F60-T100 HydrophobicContact CE2-CG2 3.63Å; T100-Q102 VanDerWaalsContact C-N 3.35Å; T100-Q104 WeakPolarHBondContact O-CG 3.24Å; T100-Q104 PolarHBondContact O-N 3.47Å
101	I	80.7	Confident	86.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.9	-35.2	176	-172.6	169.3	0	0	0	112	F60 S99 A105 A119 T125 K127	F60-I101 HydrophobicContact CZ-CB 4.41Å; S99-I101 VanDerWaalsContact C-N 3.27Å; S99-I101 PolarHBondContact O-N 2.82Å; S99-I101 VanDerWaalsContact O-N 3.15Å; S99-I101 WeakPolarHBondContact OG-CG2 3.24Å; I101-A105 WeakPolarHBondContact O-CB 3.31Å; I101-A105 PolarHBondContact O-N 3.16Å; I101-A119 HydrophobicContact CD1-CB 3.81Å; I101-T125 VanDerWaalsContact CG2-O 3.25Å; I101-T125 WeakPolarHBondContact CG2-O 3.25Å; I101-K127 HydrophobicContact CD1-CG 4.37Å
102	Q	85.9	Confident	86.2	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-71.6	-41	179.1	-69.5	168.8	-0.6	0	0	112	P98 S99 T100 Q104 A105 L106 G126 T130	P98-Q102 HydrophobicContact CB-CB 3.62Å; S99-Q102 CarbonylContact O-C 3.54Å; S99-Q102 WeakPolarHBondContact O-CA 3.38Å; S99-Q102 VanDerWaalsContact O-CB 3.31Å; S99-Q102 WeakPolarHBondContact O-CB 3.34Å; S99-Q102 PolarHBondContact O-N 2.91Å; S99-Q102 WeakPolarHBondContact OG-CG 3.31Å; T100-Q102 VanDerWaalsContact C-N 3.35Å; Q102-Q104 PolarHBondContact O-N 2.94Å; Q102-A105 PolarHBondContact O-N 3.21Å; Q102-L106 HydrophobicContact CB-CD1 3.67Å; Q102-L106 HydrophobicContact CB-CG 4Å; Q102-L106 HydrophobicContact CG-CD1 4.16Å; Q102-L106 HydrophobicContact CG-CG 4.43Å; Q102-L106 VanDerWaalsContact O-CB 3.24Å; Q102-L106 WeakPolarHBondContact O-CB 3.39Å; Q102-L106 VanDerWaalsContact O-CG 3.26Å; Q102-L106 WeakPolarHBondContact O-CG 3.47Å; Q102-L106 PolarHBondContact O-N 3.35Å; Q102-G126 PolarHBondContact NE2-O 3.13Å; Q102-T130 HydrophobicContact CG-CG2 4.38Å; Q102-T130 WeakPolarHBondContact CG-OG1 3.45Å
103	E	85.9	Confident	86.1	Confident	45 Å²	45	45.4 Å²	45.4	21%	0.21	24%	0.235	C	C	.	.	H	α-helix	trans	-55	-38.7	176.1	-70.4	-163.2	165.2	0	0	111.5	S73 V74 P98 S99	S73-E103 VanDerWaalsContact CA-O 3.29Å; S73-E103 WeakPolarHBondContact CA-O 3.37Å; V74-E103 PolarHBondContact N-O 2.91Å; V74-E103 WeakPolarHBondContact O-CA 3.42Å; V74-E103 WeakPolarHBondContact O-CB 3.42Å; V74-E103 WeakPolarHBondContact O-CG 3.25Å; P98-E103 HydrophobicContact CB-CG 3.8Å; P98-E103 HydrophobicContact CG-CG 4.29Å; S99-E103 WeakPolarHBondContact O-CG 3.36Å; S99-E103 PolarHBondContact O-N 3.15Å
104	Q	83.3	Confident	86.3	Confident	30 Å²	30	44.9 Å²	44.9	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-92.4	-33.1	-175.7	-56.6	173.4	3.1	0	0	113.4	I62 T100 Q102 F282	I62-Q104 HydrophobicContact CD1-CB 4.35Å; I62-Q104 HydrophobicContact CD1-CG 4.29Å; T100-Q104 WeakPolarHBondContact O-CG 3.24Å; T100-Q104 PolarHBondContact O-N 3.47Å; Q102-Q104 PolarHBondContact O-N 2.94Å; Q104-F282 HydrophobicContact CB-CD1 4.28Å; Q104-F282 HydrophobicContact CB-CE1 3.46Å; Q104-F282 VanDerWaalsContact CB-CE1 3.46Å; Q104-F282 HydrophobicContact CB-CZ 4.1Å
105	A	87.6	Confident	86.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-90.2	-41.2	-173.9	0	0	0	0	0	113.6	I101 Q102 S107 S108 L109 M117 T130 F282	I101-A105 WeakPolarHBondContact O-CB 3.31Å; I101-A105 PolarHBondContact O-N 3.16Å; Q102-A105 PolarHBondContact O-N 3.21Å; A105-S107 VanDerWaalsContact C-N 3.35Å; A105-S107 PolarHBondContact O-N 2.84Å; A105-S108 PolarHBondContact O-N 3.02Å; A105-L109 HydrophobicContact CB-CD1 4.14Å; A105-L109 HydrophobicContact CB-CG 4.49Å; A105-L109 WeakPolarHBondContact O-CG 3.37Å; A105-L109 PolarHBondContact O-N 3.23Å; A105-L109 VanDerWaalsContact O-N 3.08Å; A105-M117 HydrophobicContact CB-SD 3.66Å; A105-T130 HydrophobicContact CB-CG2 4.22Å; A105-F282 HydrophobicContact CB-CD2 4.32Å; A105-F282 HydrophobicContact CB-CE2 3.7Å; A105-F282 HydrophobicContact CB-CZ 3.9Å
106	L	90.4	Very high	87.3	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-42.7	-162.5	-76.8	177.8	0	0	0	113.2	F77 L80 Q102 S108 L109 I110 T130 L133	F77-L106 HydrophobicContact CD1-CD1 4.37Å; F77-L106 HydrophobicContact CE1-CD1 4Å; L80-L106 HydrophobicContact CD1-CB 3.75Å; L80-L106 HydrophobicContact CD1-CD1 3.49Å; L80-L106 VanDerWaalsContact CD1-CD1 3.49Å; L80-L106 HydrophobicContact CD1-CG 4.25Å; L80-L106 HydrophobicContact CD2-CB 3.8Å; L80-L106 HydrophobicContact CG-CB 4.46Å; Q102-L106 HydrophobicContact CB-CD1 3.67Å; Q102-L106 HydrophobicContact CB-CG 4Å; Q102-L106 HydrophobicContact CG-CD1 4.16Å; Q102-L106 HydrophobicContact CG-CG 4.43Å; Q102-L106 VanDerWaalsContact O-CB 3.24Å; Q102-L106 WeakPolarHBondContact O-CB 3.39Å; Q102-L106 VanDerWaalsContact O-CG 3.26Å; Q102-L106 WeakPolarHBondContact O-CG 3.47Å; Q102-L106 PolarHBondContact O-N 3.35Å; L106-S108 VanDerWaalsContact C-N 3.29Å; L106-S108 PolarHBondContact O-N 3.07Å; L106-L109 PolarHBondContact O-N 2.93Å; L106-L109 VanDerWaalsContact O-N 3.13Å; L106-I110 VanDerWaalsContact O-CG1 3.31Å; L106-I110 WeakPolarHBondContact O-CG1 3.44Å; L106-I110 PolarHBondContact O-N 2.94Å; L106-T130 HydrophobicContact CD2-CG2 3.82Å; L106-T130 HydrophobicContact CG-CG2 4.36Å; L106-L133 HydrophobicContact CD1-CD1 3.79Å; L106-L133 HydrophobicContact CD1-CD2 4.28Å; L106-L133 HydrophobicContact CD2-CB 4.3Å; L106-L133 HydrophobicContact CD2-CD1 4.3Å; L106-L133 HydrophobicContact CD2-CD2 3.74Å; L106-L133 HydrophobicContact CD2-CG 4.33Å
107	S	88.7	Confident	88	Confident	20 Å²	20	35.7 Å²	35.7	14%	0.14	19%	0.189	C	C	.	.	H	α-helix	trans	-56.5	-43	178.4	60.1	0	0	0	0	112.4	H72 A105 L109 S111	H72-S107 WeakPolarHBondContact O-CB 3.4Å; H72-S107 PolarHBondContact O-OG 2.85Å; A105-S107 VanDerWaalsContact C-N 3.35Å; A105-S107 PolarHBondContact O-N 2.84Å; S107-L109 VanDerWaalsContact C-N 3.34Å; S107-S111 VanDerWaalsContact O-CB 3.29Å; S107-S111 WeakPolarHBondContact O-CB 3.1Å; S107-S111 PolarHBondContact O-N 3.12Å; S107-S111 VanDerWaalsContact O-N 3.09Å
108	S	89.1	Confident	88.5	Confident	8 Å²	8	28.6 Å²	28.6	6%	0.056	16%	0.158	C	C	.	.	H	α-helix	trans	-74.4	-28.7	-179.5	-57.7	0	0	0	0	112.3	L71 A105 L106 Q115 I280	L71-S108 WeakPolarHBondContact CD2-OG 3.4Å; A105-S108 PolarHBondContact O-N 3.02Å; L106-S108 VanDerWaalsContact C-N 3.29Å; L106-S108 PolarHBondContact O-N 3.07Å; S108-Q115 PolarHBondContact O-N 3.16Å; S108-Q115 VanDerWaalsContact O-N 3.16Å; S108-I280 VanDerWaalsContact CB-CD1 3.48Å
109	L	93	Very high	88.8	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-75.6	-35.1	179	-66.5	180	0	0	0	113.2	A105 L106 S107 M117 T130 A134 Q256 L258	A105-L109 HydrophobicContact CB-CD1 4.14Å; A105-L109 HydrophobicContact CB-CG 4.49Å; A105-L109 WeakPolarHBondContact O-CG 3.37Å; A105-L109 PolarHBondContact O-N 3.23Å; A105-L109 VanDerWaalsContact O-N 3.08Å; L106-L109 PolarHBondContact O-N 2.93Å; L106-L109 VanDerWaalsContact O-N 3.13Å; S107-L109 VanDerWaalsContact C-N 3.34Å; L109-M117 HydrophobicContact CD1-CE 3.83Å; L109-M117 HydrophobicContact CD1-SD 4.1Å; L109-M117 HydrophobicContact CD2-CB 4Å; L109-M117 HydrophobicContact CD2-CE 4.11Å; L109-M117 HydrophobicContact CD2-SD 3.96Å; L109-M117 HydrophobicContact CG-CE 4.48Å; L109-M117 HydrophobicContact CG-SD 4.28Å; L109-T130 HydrophobicContact CD1-CG2 3.73Å; L109-A134 HydrophobicContact CB-CB 4Å; L109-A134 HydrophobicContact CD1-CB 4.21Å; L109-Q256 PolarHBondContact O-NE2 3.34Å; L109-Q256 VanDerWaalsContact O-NE2 3.12Å; L109-Q256 PolarHBondContact O-OE1 3.31Å; L109-L258 HydrophobicContact CD1-CD1 4.45Å; L109-L258 HydrophobicContact CD2-CD1 4Å; L109-L258 HydrophobicContact CD2-CD2 3.41Å; L109-L258 VanDerWaalsContact CD2-CD2 3.41Å; L109-L258 HydrophobicContact CD2-CG 4.39Å
110	I	91.7	Very high	89	Confident	34 Å²	34	27.8 Å²	27.8	17%	0.174	15%	0.153	C	C	.	.	H	α-helix	trans	-105.7	-4.3	-173.6	74.6	-176.1	0	0	0	114.3	L80 L82 L106 L133 A134	L80-I110 HydrophobicContact CB-CD1 3.8Å; L80-I110 HydrophobicContact CD2-CD1 3.8Å; L80-I110 HydrophobicContact CG-CD1 4.27Å; L80-I110 WeakPolarHBondContact O-CD1 3.48Å; L82-I110 HydrophobicContact CD2-CD1 3.63Å; L106-I110 VanDerWaalsContact O-CG1 3.31Å; L106-I110 WeakPolarHBondContact O-CG1 3.44Å; L106-I110 PolarHBondContact O-N 2.94Å; I110-L133 HydrophobicContact CG2-CD2 4.5Å; I110-A134 HydrophobicContact CG2-CB 4.24Å
111	S	88.9	Confident	88.9	Confident	44 Å²	44	27.1 Å²	27.1	31%	0.308	15%	0.149	S	C	.	.	S	Bend	trans	-60.7	164.7	177.2	70.7	0	0	0	0	112.9	S107 N113 P114	S107-S111 VanDerWaalsContact O-CB 3.29Å; S107-S111 WeakPolarHBondContact O-CB 3.1Å; S107-S111 PolarHBondContact O-N 3.12Å; S107-S111 VanDerWaalsContact O-N 3.09Å; S111-N113 PolarHBondContact O-N 3.48Å; S111-N113 PolarHBondContact OG-N 3.43Å; S111-N113 PolarHBondContact OG-O 2.92Å; S111-N113 VanDerWaalsContact OG-O 3.11Å; S111-P114 WeakPolarHBondContact O-CD 3.3Å
112	D	86.6	Confident	88.3	Confident	177 Å²	177	31.2 Å²	31.2	95%	0.947	17%	0.168	S	C	*	.	S	Bend	trans	-61.2	-23.2	174.6	-65.1	-35.5	0	0	0	113.1	P114	D112-P114 VanDerWaalsContact C-CD 3.41Å; D112-P114 VanDerWaalsContact O-CD 3.23Å; D112-P114 WeakPolarHBondContact O-CD 3.25Å
113	N	88.9	Confident	87.5	Confident	106 Å²	106	32.2 Å²	32.2	57%	0.567	18%	0.175	S	C	*	.	S	Bend	trans	-114.2	73.7	172.6	-171	34.1	0	0	0	110.7	S111 Q115	S111-N113 PolarHBondContact O-N 3.48Å; S111-N113 PolarHBondContact OG-N 3.43Å; S111-N113 PolarHBondContact OG-O 2.92Å; S111-N113 VanDerWaalsContact OG-O 3.11Å; N113-Q115 PolarHBondContact O-N 3.46Å
114	P	92	Very high	86.6	Confident	30 Å²	30	31 Å²	31	20%	0.195	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-65.7	129.6	-170	28.2	-37.4	0	0	0	111.6	S111 D112 Q256	S111-P114 WeakPolarHBondContact O-CD 3.3Å; D112-P114 VanDerWaalsContact C-CD 3.41Å; D112-P114 VanDerWaalsContact O-CD 3.23Å; D112-P114 WeakPolarHBondContact O-CD 3.25Å; P114-Q256 HydrophobicContact CB-CG 4.35Å
115	Q	93	Very high	86	Confident	30 Å²	30	29.6 Å²	29.6	14%	0.14	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-95.4	147.3	-179.1	-60.2	-159.9	2.1	0	0	112.4	H69 S108 N113 Q256 I280	H69-Q115 PolarHBondContact CD2-NE2 3.34Å; H69-Q115 PolarHBondContact CE1-NE2 3.34Å; H69-Q115 PolarHBondContact ND1-NE2 2.96Å; H69-Q115 VanDerWaalsContact ND1-NE2 3.12Å; H69-Q115 PolarHBondContact NE2-NE2 3.25Å; H69-Q115 VanDerWaalsContact NE2-NE2 3.16Å; S108-Q115 PolarHBondContact O-N 3.16Å; S108-Q115 VanDerWaalsContact O-N 3.16Å; N113-Q115 PolarHBondContact O-N 3.46Å; Q115-Q256 WeakPolarHBondContact O-CG 3.44Å; Q115-Q256 PolarHBondContact O-NE2 3.35Å; Q115-I280 HydrophobicContact CB-CD1 3.72Å; Q115-I280 HydrophobicContact CB-CG1 4.17Å; Q115-I280 HydrophobicContact CG-CD1 4.24Å
116	N	96	Very high	85.7	Confident	31 Å²	31	30 Å²	30	17%	0.166	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-69.8	153.8	169.4	-65	-26.6	0	0	0	109.9	Q256 I257 V276 P277 P279 I280	N116-Q256 WeakPolarHBondContact OD1-CA 3.47Å; N116-I257 VanDerWaalsContact CA-O 3.3Å; N116-I257 WeakPolarHBondContact CA-O 3.3Å; N116-I257 WeakPolarHBondContact CB-O 3.45Å; N116-I257 PolarHBondContact OD1-N 3.26Å; N116-V276 HydrophobicContact CB-CG1 3.62Å; N116-P277 WeakPolarHBondContact CB-O 3.49Å; N116-P277 PolarHBondContact ND2-O 3.03Å; N116-P279 WeakPolarHBondContact O-CA 3.3Å; N116-I280 PolarHBondContact O-N 3.01Å
117	M	95.2	Very high	85.5	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	141.5	-174.5	-168.7	-178.8	66	0	0	112.9	A105 L109 A119 I257 L258 L259 F260 I280 F282	A105-M117 HydrophobicContact CB-SD 3.66Å; L109-M117 HydrophobicContact CD1-CE 3.83Å; L109-M117 HydrophobicContact CD1-SD 4.1Å; L109-M117 HydrophobicContact CD2-CB 4Å; L109-M117 HydrophobicContact CD2-CE 4.11Å; L109-M117 HydrophobicContact CD2-SD 3.96Å; L109-M117 HydrophobicContact CG-CE 4.48Å; L109-M117 HydrophobicContact CG-SD 4.28Å; M117-A119 HydrophobicContact CE-CB 3.86Å; M117-A119 HydrophobicContact SD-CB 4.42Å; M117-I257 PolarHBondContact N-O 2.93Å; M117-I257 VanDerWaalsContact N-O 3.1Å; M117-L258 HydrophobicContact CB-CD2 3.78Å; M117-L258 CarbonylContact O-C 3.4Å; M117-L258 WeakPolarHBondContact O-CA 3.46Å; M117-L259 PolarHBondContact O-N 3.22Å; M117-F260 HydrophobicContact CE-CD1 4.49Å; M117-F260 HydrophobicContact CE-CE1 3.42Å; M117-F260 VanDerWaalsContact CE-CE1 3.42Å; M117-F260 HydrophobicContact CE-CE2 4.09Å; M117-F260 HydrophobicContact CE-CZ 3.17Å; M117-I280 CarbonylContact C-O 3.53Å; M117-I280 VanDerWaalsContact CA-O 3.24Å; M117-I280 WeakPolarHBondContact CA-O 2.88Å; M117-I280 WeakPolarHBondContact CG-O 3.35Å; M117-F282 HydrophobicContact CG-CD2 3.77Å; M117-F282 HydrophobicContact CG-CE2 3.91Å; M117-F282 HydrophobicContact SD-CD2 3.52Å; M117-F282 VanDerWaalsContact SD-CD2 3.52Å; M117-F282 HydrophobicContact SD-CE2 3.49Å; M117-F282 WeakPolarHBondContact SD-CE2 3.37Å
118	I	95	Very high	85.6	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.015	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.6	161.9	-64.2	169.5	0	0	0	107.3	Q120 L259 A272 V276 P279 I280 E281 F282	I118-Q120 HydrophobicContact CG2-CG 3.93Å; I118-L259 CarbonylContact C-O 3.55Å; I118-L259 WeakPolarHBondContact CA-O 3.33Å; I118-L259 HydrophobicContact CG2-CD2 4.3Å; I118-A272 HydrophobicContact CD1-CB 3.84Å; I118-A272 HydrophobicContact CG1-CB 4.29Å; I118-A272 HydrophobicContact CG2-CB 4.22Å; I118-V276 HydrophobicContact CD1-CB 4.1Å; I118-V276 HydrophobicContact CD1-CG2 4.38Å; I118-V276 HydrophobicContact CG1-CB 3.83Å; I118-V276 HydrophobicContact CG1-CG1 4.25Å; I118-V276 HydrophobicContact CG1-CG2 3.8Å; I118-P279 HydrophobicContact CB-CB 4.37Å; I118-P279 HydrophobicContact CD1-CB 3.92Å; I118-P279 HydrophobicContact CD1-CG 3.63Å; I118-P279 HydrophobicContact CG1-CB 3.82Å; I118-P279 HydrophobicContact CG1-CG 4.13Å; I118-I280 PolarHBondContact N-O 2.96Å; I118-E281 HydrophobicContact CB-CG 4.24Å; I118-E281 HydrophobicContact CD1-CG 4.45Å; I118-E281 CarbonylContact O-C 3.38Å; I118-E281 VanDerWaalsContact O-CA 3.27Å; I118-E281 WeakPolarHBondContact O-CA 3.48Å; I118-F282 PolarHBondContact O-N 2.68Å
119	A	91.5	Very high	85.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	111.5	-179.4	0	0	0	0	0	110.6	I101 M117 L259 F260 S261	I101-A119 HydrophobicContact CD1-CB 3.81Å; M117-A119 HydrophobicContact CE-CB 3.86Å; M117-A119 HydrophobicContact SD-CB 4.42Å; A119-L259 PolarHBondContact N-O 3.18Å; A119-F260 HydrophobicContact CB-CD1 3.4Å; A119-F260 HydrophobicContact CB-CE1 3.53Å; A119-F260 HydrophobicContact CB-CG 4.3Å; A119-F260 HydrophobicContact CB-CZ 4.48Å; A119-F260 WeakPolarHBondContact O-CA 3.46Å; A119-S261 PolarHBondContact O-N 3.5Å
120	Q	86	Confident	85.7	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.028	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	106.2	-177.2	-59.8	-64	-9.3	0	0	108.9	I118 S261 T263 Y264 F282 R283 V284	I118-Q120 HydrophobicContact CG2-CG 3.93Å; Q120-S261 PolarHBondContact OE1-O 2.92Å; Q120-S261 PolarHBondContact OE1-OG 2.9Å; Q120-T263 PolarHBondContact OE1-O 3.24Å; Q120-Y264 HydrophobicContact CB-CD2 4Å; Q120-Y264 HydrophobicContact CB-CE2 4.49Å; Q120-Y264 HydrophobicContact CG-CD2 3.79Å; Q120-Y264 HydrophobicContact CG-CE2 4.02Å; Q120-F282 PolarHBondContact N-O 3.5Å; Q120-R283 HydrophobicContact CB-CG 4.49Å; Q120-R283 CarbonylContact O-C 3.55Å; Q120-V284 PolarHBondContact O-N 3.17Å
121	S	77	Confident	85.9	Confident	2 Å²	2	29 Å²	29	1%	0.014	17%	0.166	C	C	.	.			trans	-158.4	156.5	177.1	60.8	0	0	0	0	110.4	T125 K127 S261 A262 V284	S121-T125 PolarHBondContact OG-OG1 3.05Å; S121-K127 PolarHBondContact O-NZ 2.89Å; S121-K127 WeakPolarHBondContact OG-CD 3.18Å; S121-K127 WeakPolarHBondContact OG-CG 3.33Å; S121-S261 PolarHBondContact N-O 3.32Å; S121-A262 WeakPolarHBondContact O-CA 3.41Å; S121-V284 VanDerWaalsContact CB-CG2 3.4Å
122	Q	69.6	Low	86.2	Confident	86 Å²	86	26.9 Å²	26.9	40%	0.402	15%	0.152	S	C	.	.			trans	-57.2	166	177.9	65.3	-172.6	4.6	0	0	113.3	T125 K127	Q122-T125 HydrophobicContact CG-CG2 3.65Å; Q122-T125 WeakPolarHBondContact O-CG2 3.19Å; Q122-T125 PolarHBondContact O-OG1 2.78Å; Q122-T125 VanDerWaalsContact O-OG1 3.07Å; Q122-K127 PolarHBondContact O-NZ 3.16Å
123	S	67.6	Low	86.6	Confident	22 Å²	22	18.6 Å²	18.6	15%	0.154	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	148.9	174.2	-65.7	0	0	0	0	111.8	F53 T125	F53-S123 VanDerWaalsContact CD2-O 3.31Å; F53-S123 WeakPolarHBondContact CD2-O 3.31Å; S123-T125 VanDerWaalsContact C-N 3.33Å; S123-T125 PolarHBondContact O-N 2.85Å
124	G	67.8	Low	87	Confident	21 Å²	21	13.6 Å²	13.6	22%	0.216	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	5.8	177.9	0	0	0	0	0	116.8	L52 F53 G126	L52-G124 WeakPolarHBondContact CA-O 3.43Å; F53-G124 PolarHBondContact N-O 3.09Å; G124-G126 PolarHBondContact O-N 2.62Å
125	T	71	Confident	87.3	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.071	C	C	.	.	S	Bend	trans	-74.5	-4.9	171.6	56	0	0	0	0	114.3	T55 S99 I101 S121 Q122 S123	T55-T125 HydrophobicContact CG2-CG2 3.87Å; S99-T125 WeakPolarHBondContact CB-O 3.37Å; S99-T125 PolarHBondContact OG-O 3.01Å; I101-T125 VanDerWaalsContact CG2-O 3.25Å; I101-T125 WeakPolarHBondContact CG2-O 3.25Å; S121-T125 PolarHBondContact OG-OG1 3.05Å; Q122-T125 HydrophobicContact CG-CG2 3.65Å; Q122-T125 WeakPolarHBondContact O-CG2 3.19Å; Q122-T125 PolarHBondContact O-OG1 2.78Å; Q122-T125 VanDerWaalsContact O-OG1 3.07Å; S123-T125 VanDerWaalsContact C-N 3.33Å; S123-T125 PolarHBondContact O-N 2.85Å
126	G	79.8	Confident	87.4	Confident	7 Å²	7	10.7 Å²	10.7	7%	0.072	6%	0.064	C	C	.	.	S	Bend	trans	100.7	7.6	178	0	0	0	0	0	115.9	Q102 G124 T128 A129 T130	Q102-G126 PolarHBondContact NE2-O 3.13Å; G124-G126 PolarHBondContact O-N 2.62Å; G126-T128 VanDerWaalsContact C-N 3.32Å; G126-T128 PolarHBondContact O-N 3.22Å; G126-A129 PolarHBondContact O-N 3.03Å; G126-A129 VanDerWaalsContact O-N 3.09Å; G126-T130 PolarHBondContact O-N 2.85Å; G126-T130 PolarHBondContact O-OG1 3.29Å
127	K	87.7	Confident	87.4	Confident	10 Å²	10	10.7 Å²	10.7	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-44.6	-51.9	177.8	-63.3	-168.7	-59.4	-89.4	0	113.5	I101 S121 Q122 A129 T130 F131 F260	I101-K127 HydrophobicContact CD1-CG 4.37Å; S121-K127 PolarHBondContact O-NZ 2.89Å; S121-K127 WeakPolarHBondContact OG-CD 3.18Å; S121-K127 WeakPolarHBondContact OG-CG 3.33Å; Q122-K127 PolarHBondContact O-NZ 3.16Å; K127-A129 PolarHBondContact O-N 3.3Å; K127-T130 VanDerWaalsContact O-CB 3.3Å; K127-T130 WeakPolarHBondContact O-CB 3.39Å; K127-T130 PolarHBondContact O-N 3.45Å; K127-T130 VanDerWaalsContact O-N 3.15Å; K127-F131 VanDerWaalsContact O-CD1 3.28Å; K127-F131 WeakPolarHBondContact O-CD1 3.43Å; K127-F131 PolarHBondContact O-N 2.67Å; K127-F131 VanDerWaalsContact O-N 3.17Å; K127-F260 HydrophobicContact CB-CD1 3.66Å; K127-F260 HydrophobicContact CB-CE1 4.2Å; K127-F260 HydrophobicContact CB-CG 4.42Å; K127-F260 HydrophobicContact CD-CB 4.22Å; K127-F260 HydrophobicContact CD-CD1 4Å; K127-F260 HydrophobicContact CG-CD1 3.95Å
128	T	90.2	Very high	87.3	Confident	26 Å²	26	13.9 Å²	13.9	16%	0.16	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-44.2	-178.6	-54.8	0	0	0	0	112.4	G126 T130 F131 L132 I161	G126-T128 VanDerWaalsContact C-N 3.32Å; G126-T128 PolarHBondContact O-N 3.22Å; T128-T130 VanDerWaalsContact C-N 3.32Å; T128-T130 PolarHBondContact O-N 2.93Å; T128-F131 VanDerWaalsContact CA-CE1 3.43Å; T128-F131 HydrophobicContact CG2-CE1 4.19Å; T128-F131 HydrophobicContact CG2-CZ 3.84Å; T128-L132 HydrophobicContact CG2-CD1 3.83Å; T128-L132 WeakPolarHBondContact O-CB 3.48Å; T128-L132 WeakPolarHBondContact O-CD1 3.46Å; T128-L132 VanDerWaalsContact O-CG 3.28Å; T128-L132 WeakPolarHBondContact O-CG 3.47Å; T128-L132 PolarHBondContact O-N 2.82Å; T128-L132 VanDerWaalsContact O-N 3.13Å; T128-I161 HydrophobicContact CG2-CG1 4.13Å; T128-I161 HydrophobicContact CG2-CG2 4.45Å
129	A	91.1	Very high	87.4	Confident	7 Å²	7	13.9 Å²	13.9	6%	0.058	8%	0.079	C	C	.	.	H	α-helix	trans	-65.1	-37	175.1	0	0	0	0	0	111.8	F95 G126 K127 L132 L133 M168	F95-A129 HydrophobicContact CE2-CB 4.33Å; G126-A129 PolarHBondContact O-N 3.03Å; G126-A129 VanDerWaalsContact O-N 3.09Å; K127-A129 PolarHBondContact O-N 3.3Å; A129-L132 PolarHBondContact O-N 3.01Å; A129-L133 WeakPolarHBondContact O-CB 3.4Å; A129-L133 PolarHBondContact O-N 2.89Å; A129-M168 HydrophobicContact CB-CE 4.02Å
130	T	92.9	Very high	87.6	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58	-53	177.9	-52.8	0	0	0	0	111.9	Q102 A105 L106 L109 G126 K127 T128 A134	Q102-T130 HydrophobicContact CG-CG2 4.38Å; Q102-T130 WeakPolarHBondContact CG-OG1 3.45Å; A105-T130 HydrophobicContact CB-CG2 4.22Å; L106-T130 HydrophobicContact CD2-CG2 3.82Å; L106-T130 HydrophobicContact CG-CG2 4.36Å; L109-T130 HydrophobicContact CD1-CG2 3.73Å; G126-T130 PolarHBondContact O-N 2.85Å; G126-T130 PolarHBondContact O-OG1 3.29Å; K127-T130 VanDerWaalsContact O-CB 3.3Å; K127-T130 WeakPolarHBondContact O-CB 3.39Å; K127-T130 PolarHBondContact O-N 3.45Å; K127-T130 VanDerWaalsContact O-N 3.15Å; T128-T130 VanDerWaalsContact C-N 3.32Å; T128-T130 PolarHBondContact O-N 2.93Å; T130-A134 PolarHBondContact O-N 3.25Å
131	F	95.8	Very high	88	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-74.6	-32.5	-177.8	70.9	-113.6	0	0	0	113	K127 T128 L133 A134 M135 I161 V227 D229 L258 F260	K127-F131 VanDerWaalsContact O-CD1 3.28Å; K127-F131 WeakPolarHBondContact O-CD1 3.43Å; K127-F131 PolarHBondContact O-N 2.67Å; K127-F131 VanDerWaalsContact O-N 3.17Å; T128-F131 VanDerWaalsContact CA-CE1 3.43Å; T128-F131 HydrophobicContact CG2-CE1 4.19Å; T128-F131 HydrophobicContact CG2-CZ 3.84Å; F131-L133 VanDerWaalsContact C-N 3.35Å; F131-A134 PolarHBondContact O-N 3.12Å; F131-M135 HydrophobicContact CD2-CE 4.26Å; F131-M135 HydrophobicContact CD2-SD 4.39Å; F131-M135 VanDerWaalsContact O-CG 3.3Å; F131-M135 WeakPolarHBondContact O-CG 3.46Å; F131-M135 PolarHBondContact O-N 2.75Å; F131-I161 HydrophobicContact CE2-CG2 3.63Å; F131-I161 HydrophobicContact CZ-CD1 4.23Å; F131-I161 HydrophobicContact CZ-CG1 4.27Å; F131-I161 HydrophobicContact CZ-CG2 3.7Å; F131-V227 HydrophobicContact CB-CG1 4.18Å; F131-V227 HydrophobicContact CB-CG2 4.13Å; F131-V227 HydrophobicContact CD1-CG1 3.93Å; F131-V227 HydrophobicContact CD2-CG1 4.06Å; F131-V227 HydrophobicContact CD2-CG2 4.42Å; F131-V227 HydrophobicContact CE1-CG1 4.24Å; F131-V227 HydrophobicContact CE2-CG1 4.42Å; F131-V227 HydrophobicContact CG-CG1 3.83Å; F131-V227 HydrophobicContact CG-CG2 4.43Å; F131-D229 HydrophobicContact CE1-CB 4.17Å; F131-D229 HydrophobicContact CZ-CB 4.41Å; F131-L258 HydrophobicContact CB-CD1 4.28Å; F131-F260 HydrophobicContact CB-CD2 4.49Å; F131-F260 HydrophobicContact CB-CE2 3.55Å; F131-F260 HydrophobicContact CB-CZ 3.69Å; F131-F260 AromaticContact CD1-CD2 3.8Å; F131-F260 HydrophobicContact CD1-CD2 3.8Å; F131-F260 AromaticContact CD1-CE2 3.66Å; F131-F260 HydrophobicContact CD1-CE2 3.66Å; F131-F260 HydrophobicContact CD1-CG 4.31Å; F131-F260 HydrophobicContact CD1-CZ 4.03Å; F131-F260 HydrophobicContact CE1-CD2 4.49Å; F131-F260 HydrophobicContact CG-CE2 4.02Å; F131-F260 HydrophobicContact CG-CZ 4.37Å
132	L	96.4	Very high	88.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-41.8	175.7	-75.9	171	0	0	0	111.2	T128 A129 A134 M135 L136 I161 V164 M168	T128-L132 HydrophobicContact CG2-CD1 3.83Å; T128-L132 WeakPolarHBondContact O-CB 3.48Å; T128-L132 WeakPolarHBondContact O-CD1 3.46Å; T128-L132 VanDerWaalsContact O-CG 3.28Å; T128-L132 WeakPolarHBondContact O-CG 3.47Å; T128-L132 PolarHBondContact O-N 2.82Å; T128-L132 VanDerWaalsContact O-N 3.13Å; A129-L132 PolarHBondContact O-N 3.01Å; L132-A134 VanDerWaalsContact C-N 3.32Å; L132-A134 PolarHBondContact O-N 3.07Å; L132-M135 PolarHBondContact O-N 2.98Å; L132-L136 WeakPolarHBondContact O-CB 3.49Å; L132-L136 VanDerWaalsContact O-CG 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.22Å; L132-L136 PolarHBondContact O-N 2.94Å; L132-I161 HydrophobicContact CD1-CG2 4.35Å; L132-I161 HydrophobicContact CD2-CG2 4.01Å; L132-I161 HydrophobicContact CG-CG2 4.39Å; L132-V164 HydrophobicContact CD1-CB 3.78Å; L132-V164 HydrophobicContact CD1-CG1 3.47Å; L132-V164 VanDerWaalsContact CD1-CG1 3.47Å; L132-M168 HydrophobicContact CB-CE 4.28Å; L132-M168 HydrophobicContact CB-SD 4.15Å
133	L	95.2	Very high	90.1	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-43.5	173.8	-171	163.7	0	0	0	110.5	F77 L82 I90 L106 I110 A129 F131 L136 S137 M168	F77-L133 HydrophobicContact CD1-CD1 3.97Å; F77-L133 HydrophobicContact CE1-CD1 3.73Å; L82-L133 HydrophobicContact CD1-CD1 4.09Å; L82-L133 HydrophobicContact CD1-CD2 3.83Å; L82-L133 HydrophobicContact CD1-CG 4.15Å; L82-L133 HydrophobicContact CD2-CD2 3.87Å; I90-L133 HydrophobicContact CD1-CD1 3.49Å; I90-L133 VanDerWaalsContact CD1-CD1 3.49Å; I90-L133 HydrophobicContact CD1-CG 3.97Å; I90-L133 HydrophobicContact CG1-CD1 4.43Å; L106-L133 HydrophobicContact CD1-CD1 3.79Å; L106-L133 HydrophobicContact CD1-CD2 4.28Å; L106-L133 HydrophobicContact CD2-CB 4.3Å; L106-L133 HydrophobicContact CD2-CD1 4.3Å; L106-L133 HydrophobicContact CD2-CD2 3.74Å; L106-L133 HydrophobicContact CD2-CG 4.33Å; I110-L133 HydrophobicContact CG2-CD2 4.5Å; A129-L133 WeakPolarHBondContact O-CB 3.4Å; A129-L133 PolarHBondContact O-N 2.89Å; F131-L133 VanDerWaalsContact C-N 3.35Å; L133-L136 PolarHBondContact O-N 2.76Å; L133-S137 WeakPolarHBondContact O-CB 3.27Å; L133-S137 PolarHBondContact O-N 2.84Å; L133-S137 PolarHBondContact O-OG 3.05Å; L133-M168 HydrophobicContact CB-SD 3.94Å
134	A	96	Very high	91.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-46.6	175.4	0	0	0	0	0	112.1	L109 I110 T130 F131 L132 L136 S137 R138 M225	L109-A134 HydrophobicContact CB-CB 4Å; L109-A134 HydrophobicContact CD1-CB 4.21Å; I110-A134 HydrophobicContact CG2-CB 4.24Å; T130-A134 PolarHBondContact O-N 3.25Å; F131-A134 PolarHBondContact O-N 3.12Å; L132-A134 VanDerWaalsContact C-N 3.32Å; L132-A134 PolarHBondContact O-N 3.07Å; A134-L136 PolarHBondContact O-N 3.48Å; A134-S137 PolarHBondContact O-N 3.34Å; A134-R138 WeakPolarHBondContact O-CB 3.31Å; A134-R138 WeakPolarHBondContact O-CG 3.34Å; A134-R138 PolarHBondContact O-N 2.88Å; A134-R138 VanDerWaalsContact O-N 3.14Å; A134-M225 HydrophobicContact CB-CE 3.71Å; A134-M225 HydrophobicContact CB-SD 4.34Å
135	M	97.5	Very high	92.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57	-52	175.4	-73	-175.6	174	0	0	111.4	F131 L132 S137 R138 I139 C148 L149 C150 I198 M225 V227	F131-M135 HydrophobicContact CD2-CE 4.26Å; F131-M135 HydrophobicContact CD2-SD 4.39Å; F131-M135 VanDerWaalsContact O-CG 3.3Å; F131-M135 WeakPolarHBondContact O-CG 3.46Å; F131-M135 PolarHBondContact O-N 2.75Å; L132-M135 PolarHBondContact O-N 2.98Å; M135-S137 PolarHBondContact O-N 3.41Å; M135-R138 PolarHBondContact O-N 2.87Å; M135-R138 VanDerWaalsContact O-N 3.08Å; M135-I139 WeakPolarHBondContact O-CG2 3.18Å; M135-I139 PolarHBondContact O-N 2.99Å; M135-I139 VanDerWaalsContact O-N 3.1Å; M135-C148 HydrophobicContact CB-CB 4.07Å; M135-C148 HydrophobicContact CE-CB 4.33Å; M135-C148 HydrophobicContact CG-CB 3.76Å; M135-C148 HydrophobicContact SD-CB 3.95Å; M135-L149 WeakPolarHBondContact CE-O 3.36Å; M135-C150 HydrophobicContact CE-CB 3.68Å; M135-I198 HydrophobicContact CB-CD1 4.2Å; M135-I198 HydrophobicContact SD-CG2 3.97Å; M135-M225 HydrophobicContact CB-SD 4.3Å; M135-M225 HydrophobicContact CG-SD 3.47Å; M135-M225 WeakPolarHBondContact CG-SD 3.45Å; M135-V227 HydrophobicContact CE-CB 3.64Å; M135-V227 HydrophobicContact CE-CG2 3.23Å
136	L	97.1	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-29.3	-178.2	-72.1	169.9	0	0	0	113.2	L86 L132 L133 A134 I139 M168 A169 M172 V175 F177 I198	L86-L136 HydrophobicContact CD1-CB 3.92Å; L86-L136 HydrophobicContact CD1-CD1 3.72Å; L86-L136 HydrophobicContact CD1-CG 4.45Å; L86-L136 HydrophobicContact CD2-CB 4.02Å; L132-L136 WeakPolarHBondContact O-CB 3.49Å; L132-L136 VanDerWaalsContact O-CG 3.3Å; L132-L136 WeakPolarHBondContact O-CG 3.22Å; L132-L136 PolarHBondContact O-N 2.94Å; L133-L136 PolarHBondContact O-N 2.76Å; A134-L136 PolarHBondContact O-N 3.48Å; L136-I139 HydrophobicContact CD2-CD1 4.11Å; L136-I139 WeakPolarHBondContact O-CG1 3.04Å; L136-M168 HydrophobicContact CD1-CB 3.89Å; L136-M168 HydrophobicContact CD1-CG 3.7Å; L136-M168 HydrophobicContact CD1-SD 3.76Å; L136-A169 HydrophobicContact CD1-CB 4.1Å; L136-A169 HydrophobicContact CD2-CB 3.73Å; L136-M172 HydrophobicContact CD2-SD 4.49Å; L136-V175 HydrophobicContact CD2-CG1 3.76Å; L136-V175 HydrophobicContact CD2-CG2 4.47Å; L136-F177 HydrophobicContact CD2-CE2 4.46Å; L136-F177 HydrophobicContact CD2-CZ 4.06Å; L136-I198 HydrophobicContact CD2-CD1 3.78Å; L136-I198 HydrophobicContact CG-CD1 4.3Å
137	S	95	Very high	95	Very high	30 Å²	30	29.3 Å²	29.3	21%	0.21	15%	0.149	C	C	.	.	H	α-helix	trans	-72.2	-33	175.3	-57	0	0	0	0	112.2	L82 L133 A134 M135	L82-S137 VanDerWaalsContact CD2-OG 3.22Å; L82-S137 WeakPolarHBondContact CD2-OG 3.47Å; L133-S137 WeakPolarHBondContact O-CB 3.27Å; L133-S137 PolarHBondContact O-N 2.84Å; L133-S137 PolarHBondContact O-OG 3.05Å; A134-S137 PolarHBondContact O-N 3.34Å; M135-S137 PolarHBondContact O-N 3.41Å
138	R	93.4	Very high	95.5	Very high	68 Å²	68	28.8 Å²	28.8	26%	0.257	15%	0.147	S	C	.	.	H	α-helix	trans	-93.2	-21.2	-171.7	-70.8	-157.3	68.4	-178.3	-2.7	115.3	A134 M135 M225	A134-R138 WeakPolarHBondContact O-CB 3.31Å; A134-R138 WeakPolarHBondContact O-CG 3.34Å; A134-R138 PolarHBondContact O-N 2.88Å; A134-R138 VanDerWaalsContact O-N 3.14Å; M135-R138 PolarHBondContact O-N 2.87Å; M135-R138 VanDerWaalsContact O-N 3.08Å; R138-M225 HydrophobicContact CG-CE 4.21Å
139	I	95.7	Very high	95.9	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	14%	0.139	C	C	.	.			trans	-66.7	141.1	177.6	56.4	171.6	0	0	0	112.1	K83 M135 L136 Q147 C148 V175 Q197 I198	K83-I139 PolarHBondContact NZ-O 2.78Å; M135-I139 WeakPolarHBondContact O-CG2 3.18Å; M135-I139 PolarHBondContact O-N 2.99Å; M135-I139 VanDerWaalsContact O-N 3.1Å; L136-I139 HydrophobicContact CD2-CD1 4.11Å; L136-I139 WeakPolarHBondContact O-CG1 3.04Å; I139-Q147 HydrophobicContact CG2-CB 4.11Å; I139-C148 HydrophobicContact CG2-CB 4.49Å; I139-V175 HydrophobicContact CD1-CB 4.2Å; I139-V175 HydrophobicContact CD1-CG1 3.66Å; I139-V175 HydrophobicContact CD1-CG2 3.52Å; I139-Q197 HydrophobicContact CG2-CB 4.27Å; I139-I198 HydrophobicContact CD1-CD1 4.17Å; I139-I198 HydrophobicContact CG2-CD1 4.43Å; I139-I198 HydrophobicContact CG2-CG1 4.07Å
140	N	95.8	Very high	96.3	Very high	72 Å²	72	27.2 Å²	27.2	39%	0.385	14%	0.136	S	C	.	.			trans	-91.8	116.4	162.2	-174.5	-8.3	0	0	0	109.2	D142 V143 Q147	N140-D142 VanDerWaalsContact C-N 3.29Å; N140-D142 PolarHBondContact O-N 2.87Å; N140-D142 PolarHBondContact OD1-N 2.84Å; N140-V143 HydrophobicContact CB-CG2 4.36Å; N140-Q147 PolarHBondContact O-NE2 3.4Å
141	T	95	Very high	96.5	Very high	27 Å²	27	27.2 Å²	27.2	17%	0.166	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-24.7	-177.8	43	0	0	0	0	113.3	V143 E174 V175 Q197	T141-V143 PolarHBondContact O-N 2.8Å; T141-E174 HydrophobicContact CG2-CB 4.01Å; T141-V175 HydrophobicContact CG2-CG2 3.73Å; T141-Q197 PolarHBondContact O-NE2 2.76Å
142	D	95.6	Very high	96.5	Very high	131 Å²	131	27.2 Å²	27.2	70%	0.701	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-3.6	-176.2	-56.2	-28.1	0	0	0	112.9	N140	N140-D142 VanDerWaalsContact C-N 3.29Å; N140-D142 PolarHBondContact O-N 2.87Å; N140-D142 PolarHBondContact OD1-N 2.84Å
143	V	95.6	Very high	96.4	Very high	42 Å²	42	27.4 Å²	27.4	26%	0.255	14%	0.138	S	C	.	.	S	Bend	trans	-126.5	119	-172.5	-159.8	0	0	0	0	111	N140 T141 Y145 Q147 Q197	N140-V143 HydrophobicContact CB-CG2 4.36Å; T141-V143 PolarHBondContact O-N 2.8Å; V143-Y145 HydrophobicContact CB-CE1 4.17Å; V143-Y145 HydrophobicContact CG1-CD1 3.49Å; V143-Y145 VanDerWaalsContact CG1-CD1 3.49Å; V143-Y145 HydrophobicContact CG1-CE1 2.96Å; V143-Y145 HydrophobicContact CG1-CE2 4.35Å; V143-Y145 HydrophobicContact CG1-CG 4.39Å; V143-Y145 VanDerWaalsContact CG1-CZ 3.43Å; V143-Y145 PolarHBondContact O-N 3.4Å; V143-Q147 PolarHBondContact O-NE2 2.87Å; V143-Q147 VanDerWaalsContact O-NE2 3.07Å; V143-Q197 WeakPolarHBondContact O-CG 3.34Å
144	H	96.1	Very high	96.2	Very high	112 Å²	112	28.5 Å²	28.5	52%	0.519	15%	0.145	S	C	.	.			trans	-98	74.7	-170.3	-57.1	-60.4	0	0	0	112.4	T195	H144-T195 CarbonylContact C-O 3.59Å; H144-T195 VanDerWaalsContact C-O 3.25Å; H144-T195 WeakPolarHBondContact CA-O 3.24Å
145	Y	97.1	Very high	96	Very high	73 Å²	73	33.9 Å²	33.9	29%	0.286	17%	0.165	S	C	.	.	S	Bend	trans	-152.3	162	166.9	52.2	-115.1	0	0	0	110.2	V143 Q147 V194 T195 D196 Q197 K222	V143-Y145 HydrophobicContact CB-CE1 4.17Å; V143-Y145 HydrophobicContact CG1-CD1 3.49Å; V143-Y145 VanDerWaalsContact CG1-CD1 3.49Å; V143-Y145 HydrophobicContact CG1-CE1 2.96Å; V143-Y145 HydrophobicContact CG1-CE2 4.35Å; V143-Y145 HydrophobicContact CG1-CG 4.39Å; V143-Y145 VanDerWaalsContact CG1-CZ 3.43Å; V143-Y145 PolarHBondContact O-N 3.4Å; Y145-Q147 HydrophobicContact CD2-CG 3.7Å; Y145-Q147 HydrophobicContact CE2-CG 3.46Å; Y145-Q147 VanDerWaalsContact CE2-CG 3.46Å; Y145-Q147 PolarHBondContact O-N 3.1Å; Y145-Q147 VanDerWaalsContact O-N 3.13Å; Y145-V194 WeakPolarHBondContact CA-O 3.13Å; Y145-T195 PolarHBondContact N-O 2.87Å; Y145-D196 CarbonylContact C-O 3.58Å; Y145-Q197 WeakPolarHBondContact O-CA 3.43Å; Y145-K222 HydrophobicContact CD1-CD 3.6Å; Y145-K222 HydrophobicContact CD2-CB 3.64Å; Y145-K222 HydrophobicContact CD2-CD 3.67Å; Y145-K222 HydrophobicContact CD2-CG 4.15Å; Y145-K222 HydrophobicContact CE1-CD 3.8Å; Y145-K222 HydrophobicContact CE2-CB 3.65Å; Y145-K222 HydrophobicContact CE2-CD 3.95Å; Y145-K222 HydrophobicContact CE2-CG 4.08Å; Y145-K222 HydrophobicContact CG-CB 4.36Å; Y145-K222 HydrophobicContact CG-CD 3.52Å; Y145-K222 HydrophobicContact CG-CG 4.48Å
146	C	98	Very high	95.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.02	18%	0.179	C	C	.	.			trans	-57.9	114.6	174.7	176.2	0	0	0	0	112	V194 D196 V199 I218	C146-V194 PolarHBondContact N-O 3.41Å; C146-D196 WeakPolarHBondContact CA-O 3.3Å; C146-D196 PolarHBondContact N-O 3.47Å; C146-D196 VanDerWaalsContact N-O 3.15Å; C146-V199 HydrophobicContact CB-CG2 3.83Å; C146-V199 WeakPolarHBondContact SG-CG2 3.28Å; C146-I218 HydrophobicContact CB-CD1 4.49Å; C146-I218 HydrophobicContact CB-CG1 4.2Å; C146-I218 HydrophobicContact CB-CG2 4.04Å
147	Q	98.2	Very high	95.3	Very high	7 Å²	7	36.9 Å²	36.9	3%	0.033	18%	0.179	C	C	.	.			trans	-108.8	-37.7	178.9	-74.2	172.6	62	0	0	111.9	I139 N140 V143 Y145 Q197 V223 V224 M225	I139-Q147 HydrophobicContact CG2-CB 4.11Å; N140-Q147 PolarHBondContact O-NE2 3.4Å; V143-Q147 PolarHBondContact O-NE2 2.87Å; V143-Q147 VanDerWaalsContact O-NE2 3.07Å; Y145-Q147 HydrophobicContact CD2-CG 3.7Å; Y145-Q147 HydrophobicContact CE2-CG 3.46Å; Y145-Q147 VanDerWaalsContact CE2-CG 3.46Å; Y145-Q147 PolarHBondContact O-N 3.1Å; Y145-Q147 VanDerWaalsContact O-N 3.13Å; Q147-Q197 PolarHBondContact N-O 3.27Å; Q147-V223 CarbonylContact O-C 3.47Å; Q147-V223 WeakPolarHBondContact O-CA 3.21Å; Q147-V224 HydrophobicContact CB-CG2 4.33Å; Q147-V224 WeakPolarHBondContact O-CG2 3.46Å; Q147-V224 PolarHBondContact O-N 2.6Å; Q147-M225 PolarHBondContact O-N 3.33Å
148	C	98.5	Very high	95.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137	177.5	-63.9	0	0	0	0	110.6	M135 I139 Q197 I198 V199 M225	M135-C148 HydrophobicContact CB-CB 4.07Å; M135-C148 HydrophobicContact CE-CB 4.33Å; M135-C148 HydrophobicContact CG-CB 3.76Å; M135-C148 HydrophobicContact SD-CB 3.95Å; I139-C148 HydrophobicContact CG2-CB 4.49Å; C148-Q197 PolarHBondContact N-O 3.32Å; C148-I198 HydrophobicContact CB-CG1 4.22Å; C148-I198 WeakPolarHBondContact O-CA 3.41Å; C148-V199 PolarHBondContact O-N 3.09Å; C148-M225 WeakPolarHBondContact CA-O 3.45Å
149	L	98.4	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.5	-179.6	-178.4	68.1	0	0	0	110.3	M135 M151 V199 I206 F210 I218 V223 M225 F226 V227 V247	M135-L149 WeakPolarHBondContact CE-O 3.36Å; L149-M151 HydrophobicContact CD2-CE 4.5Å; L149-V199 CarbonylContact C-O 3.59Å; L149-V199 WeakPolarHBondContact CA-O 3.34Å; L149-V199 HydrophobicContact CD1-CB 3.98Å; L149-V199 HydrophobicContact CD1-CG1 4Å; L149-I206 HydrophobicContact CD1-CD1 3.76Å; L149-I206 HydrophobicContact CD1-CG1 4.09Å; L149-I206 HydrophobicContact CD1-CG2 3.89Å; L149-I206 HydrophobicContact CD2-CG2 3.9Å; L149-I206 HydrophobicContact CG-CD1 4.48Å; L149-I206 HydrophobicContact CG-CG2 4.42Å; L149-F210 HydrophobicContact CD1-CE2 4.5Å; L149-F210 HydrophobicContact CD2-CE2 3.75Å; L149-F210 HydrophobicContact CD2-CZ 3.62Å; L149-I218 HydrophobicContact CD1-CD1 4.36Å; L149-V223 HydrophobicContact CB-CG1 4.08Å; L149-M225 PolarHBondContact N-O 3.19Å; L149-F226 HydrophobicContact CB-CD2 4.07Å; L149-F226 HydrophobicContact CD2-CD2 3.7Å; L149-F226 HydrophobicContact CD2-CE2 3.83Å; L149-F226 HydrophobicContact CD2-CG 4.47Å; L149-F226 HydrophobicContact CG-CD2 3.89Å; L149-F226 HydrophobicContact CG-CE2 4.15Å; L149-F226 CarbonylContact O-C 3.58Å; L149-F226 WeakPolarHBondContact O-CA 3.45Å; L149-V227 PolarHBondContact O-N 3.27Å; L149-V247 HydrophobicContact CD2-CG1 4.06Å
150	C	98.5	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.6	170.6	-168.1	0	0	0	0	110.1	M135 V199 I200 G201 V227	M135-C150 HydrophobicContact CE-CB 3.68Å; C150-V199 PolarHBondContact N-O 3.24Å; C150-I200 HydrophobicContact CB-CB 4.32Å; C150-I200 HydrophobicContact CB-CG1 3.88Å; C150-I200 HydrophobicContact CB-CG2 4.17Å; C150-I200 CarbonylContact O-C 3.57Å; C150-I200 WeakPolarHBondContact O-CA 3.42Å; C150-G201 PolarHBondContact O-N 3.07Å; C150-V227 CarbonylContact C-O 3.54Å; C150-V227 WeakPolarHBondContact CA-O 3.35Å; C150-V227 HydrophobicContact CB-CB 4.41Å
151	M	98	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.4	167.9	-81.4	-178.3	-169.1	0	0	110.3	L149 G201 P203 I206 F226 V227 L228 D229 M234 C244 V247	L149-M151 HydrophobicContact CD2-CE 4.5Å; M151-G201 WeakPolarHBondContact CA-O 3.35Å; M151-P203 HydrophobicContact SD-CB 4.19Å; M151-P203 HydrophobicContact SD-CG 4.27Å; M151-I206 HydrophobicContact CE-CB 3.86Å; M151-I206 HydrophobicContact CE-CD1 4.31Å; M151-I206 HydrophobicContact CE-CG2 3.35Å; M151-I206 HydrophobicContact CG-CD1 3.5Å; M151-I206 VanDerWaalsContact CG-CD1 3.5Å; M151-F226 HydrophobicContact CB-CE2 4.22Å; M151-F226 HydrophobicContact CE-CE2 4.06Å; M151-F226 HydrophobicContact CE-CZ 3.89Å; M151-F226 HydrophobicContact CG-CE2 3.85Å; M151-F226 HydrophobicContact CG-CZ 4.27Å; M151-F226 HydrophobicContact SD-CE2 3.86Å; M151-F226 HydrophobicContact SD-CZ 3.65Å; M151-V227 PolarHBondContact N-O 2.9Å; M151-L228 HydrophobicContact CB-CD1 3.78Å; M151-L228 HydrophobicContact SD-CD1 4.38Å; M151-D229 PolarHBondContact O-N 3.33Å; M151-M234 HydrophobicContact CB-CE 3.84Å; M151-C244 HydrophobicContact SD-CB 4.32Å; M151-V247 HydrophobicContact CE-CB 3.68Å; M151-V247 HydrophobicContact CE-CG1 3.57Å; M151-V247 HydrophobicContact CE-CG2 3.66Å
152	A	95.7	Very high	94.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.			trans	-125.2	148.8	170.9	0	0	0	0	0	109.3	T154 L157 A158 I161 G201 T202 P203	A152-T154 VanDerWaalsContact C-N 3.34Å; A152-T154 PolarHBondContact O-N 3.48Å; A152-L157 HydrophobicContact CB-CB 4.12Å; A152-A158 HydrophobicContact CB-CB 4.22Å; A152-I161 HydrophobicContact CB-CD1 3.75Å; A152-G201 PolarHBondContact N-O 3.36Å; A152-T202 WeakPolarHBondContact O-CA 3.5Å; A152-P203 WeakPolarHBondContact O-CD 3.21Å
153	P	93	Very high	94.7	Very high	4 Å²	4	27.3 Å²	27.3	3%	0.026	13%	0.132	C	C	.	.	S	Bend	trans	-67.4	-34.8	-170.2	23.2	-31.7	0	0	0	112.2	L157 E230 I233 M234 F240	P153-L157 HydrophobicContact CG-CD1 3.6Å; P153-E230 HydrophobicContact CG-CB 3.97Å; P153-I233 HydrophobicContact CB-CB 4.36Å; P153-I233 HydrophobicContact CB-CG2 3.84Å; P153-I233 HydrophobicContact CG-CB 3.97Å; P153-I233 HydrophobicContact CG-CG2 3.72Å; P153-M234 HydrophobicContact CB-CE 4.33Å; P153-M234 HydrophobicContact CB-CG 4.24Å; P153-M234 HydrophobicContact CB-SD 3.76Å; P153-F240 HydrophobicContact CB-CE2 4.46Å; P153-F240 VanDerWaalsContact O-CE2 3.31Å; P153-F240 WeakPolarHBondContact O-CE2 3.37Å
154	T	91.6	Very high	94.6	Very high	26 Å²	26	26.9 Å²	26.9	16%	0.16	13%	0.13	C	C	.	.	S	Bend	trans	-121.9	164.1	-178.1	67	0	0	0	0	113.2	A39 A152 E156 L157 A158	A39-T154 HydrophobicContact CB-CG2 3.46Å; A39-T154 VanDerWaalsContact CB-CG2 3.46Å; A152-T154 VanDerWaalsContact C-N 3.34Å; A152-T154 PolarHBondContact O-N 3.48Å; T154-E156 VanDerWaalsContact C-N 3.3Å; T154-L157 WeakPolarHBondContact OG1-CD1 3.4Å; T154-L157 WeakPolarHBondContact OG1-CG 3.4Å; T154-L157 PolarHBondContact OG1-N 2.82Å; T154-A158 WeakPolarHBondContact O-CB 3.47Å; T154-A158 PolarHBondContact O-N 2.98Å
155	R	92	Very high	94.5	Very high	112 Å²	112	21.6 Å²	21.6	42%	0.423	11%	0.105	S	C	.	.	H	α-helix	trans	-63	-41.1	176.1	166.6	176.3	169.1	-96.5	4.1	110.8	A158 L159 V181	R155-A158 PolarHBondContact O-N 2.79Å; R155-L159 HydrophobicContact CG-CD1 3.99Å; R155-L159 HydrophobicContact CG-CG 4.41Å; R155-L159 VanDerWaalsContact O-CG 3.27Å; R155-L159 WeakPolarHBondContact O-CG 3.42Å; R155-L159 PolarHBondContact O-N 3.44Å; R155-V181 HydrophobicContact CB-CB 4.34Å; R155-V181 HydrophobicContact CB-CG1 4.11Å; R155-V181 HydrophobicContact CG-CB 4.11Å; R155-V181 HydrophobicContact CG-CG1 4.09Å; R155-V181 HydrophobicContact CG-CG2 4.18Å
156	E	88.8	Confident	94.5	Very high	64 Å²	64	23.2 Å²	23.2	30%	0.299	11%	0.111	S	C	.	.	H	α-helix	trans	-64.3	-46.2	-176.5	-67.2	62.7	-136.4	0	0	110.1	Y43 T154 L159 Q160	Y43-E156 HydrophobicContact CD1-CB 4.4Å; Y43-E156 HydrophobicContact CD2-CB 3.56Å; Y43-E156 HydrophobicContact CE2-CB 3.72Å; Y43-E156 HydrophobicContact CG-CB 3.9Å; T154-E156 VanDerWaalsContact C-N 3.3Å; E156-L159 PolarHBondContact O-N 2.9Å; E156-Q160 PolarHBondContact O-N 3.43Å
157	L	91.1	Very high	94.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-41.5	174	-72	168.4	0	0	0	112.3	K46 A152 P153 T154 L159 Q160 I161 E230	K46-L157 HydrophobicContact CD-CD2 3.62Å; A152-L157 HydrophobicContact CB-CB 4.12Å; P153-L157 HydrophobicContact CG-CD1 3.6Å; T154-L157 WeakPolarHBondContact OG1-CD1 3.4Å; T154-L157 WeakPolarHBondContact OG1-CG 3.4Å; T154-L157 PolarHBondContact OG1-N 2.82Å; L157-L159 PolarHBondContact O-N 2.94Å; L157-Q160 PolarHBondContact O-N 2.99Å; L157-I161 VanDerWaalsContact O-CG1 3.28Å; L157-I161 WeakPolarHBondContact O-CG1 3.41Å; L157-I161 PolarHBondContact O-N 2.93Å; L157-E230 HydrophobicContact CD1-CG 4.33Å
158	A	94.6	Very high	94.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.3	-45.2	176.4	0	0	0	0	0	112.1	A152 T154 R155 Q160 I161 E162 V181 I200	A152-A158 HydrophobicContact CB-CB 4.22Å; T154-A158 WeakPolarHBondContact O-CB 3.47Å; T154-A158 PolarHBondContact O-N 2.98Å; R155-A158 PolarHBondContact O-N 2.79Å; A158-Q160 VanDerWaalsContact C-N 3.3Å; A158-Q160 PolarHBondContact O-N 3.46Å; A158-I161 PolarHBondContact O-N 2.86Å; A158-E162 PolarHBondContact O-N 2.86Å; A158-V181 HydrophobicContact CB-CG1 4.15Å; A158-I200 HydrophobicContact CB-CG2 3.99Å; A158-I200 WeakPolarHBondContact O-CG2 3.17Å
159	L	92.3	Very high	94	Very high	36 Å²	36	27.7 Å²	27.7	19%	0.188	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-35.3	177.8	-71.7	175.2	0	0	0	112.5	R155 E156 L157 E162 S163 T179	R155-L159 HydrophobicContact CG-CD1 3.99Å; R155-L159 HydrophobicContact CG-CG 4.41Å; R155-L159 VanDerWaalsContact O-CG 3.27Å; R155-L159 WeakPolarHBondContact O-CG 3.42Å; R155-L159 PolarHBondContact O-N 3.44Å; E156-L159 PolarHBondContact O-N 2.9Å; L157-L159 PolarHBondContact O-N 2.94Å; L159-E162 PolarHBondContact O-N 3.49Å; L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.17Å; L159-T179 HydrophobicContact CD2-CG2 3.74Å; L159-T179 HydrophobicContact CG-CG2 4.47Å
160	Q	89.1	Confident	93.9	Very high	26 Å²	26	32.5 Å²	32.5	12%	0.121	16%	0.155	C	C	.	.	H	α-helix	trans	-68.2	-45.6	176.2	-177.4	166.3	31.1	0	0	112.3	K46 L47 E156 L157 A158 E162 S163 V164	K46-Q160 HydrophobicContact CB-CG 4.49Å; K46-Q160 PolarHBondContact O-NE2 3.4Å; L47-Q160 VanDerWaalsContact N-NE2 3.19Å; E156-Q160 PolarHBondContact O-N 3.43Å; L157-Q160 PolarHBondContact O-N 2.99Å; A158-Q160 VanDerWaalsContact C-N 3.3Å; A158-Q160 PolarHBondContact O-N 3.46Å; Q160-E162 VanDerWaalsContact C-N 3.26Å; Q160-E162 PolarHBondContact O-N 3.23Å; Q160-S163 WeakPolarHBondContact O-CB 3.34Å; Q160-S163 PolarHBondContact O-N 2.92Å; Q160-V164 WeakPolarHBondContact O-CG2 3.41Å; Q160-V164 PolarHBondContact O-N 2.81Å
161	I	94.3	Very high	93.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-41.2	175.1	-63.5	162.3	0	0	0	109.9	T128 F131 L132 A152 L157 A158 V164 G165 I200 D229	T128-I161 HydrophobicContact CG2-CG1 4.13Å; T128-I161 HydrophobicContact CG2-CG2 4.45Å; F131-I161 HydrophobicContact CE2-CG2 3.63Å; F131-I161 HydrophobicContact CZ-CD1 4.23Å; F131-I161 HydrophobicContact CZ-CG1 4.27Å; F131-I161 HydrophobicContact CZ-CG2 3.7Å; L132-I161 HydrophobicContact CD1-CG2 4.35Å; L132-I161 HydrophobicContact CD2-CG2 4.01Å; L132-I161 HydrophobicContact CG-CG2 4.39Å; A152-I161 HydrophobicContact CB-CD1 3.75Å; L157-I161 VanDerWaalsContact O-CG1 3.28Å; L157-I161 WeakPolarHBondContact O-CG1 3.41Å; L157-I161 PolarHBondContact O-N 2.93Å; A158-I161 PolarHBondContact O-N 2.86Å; I161-V164 PolarHBondContact O-N 3.5Å; I161-G165 PolarHBondContact O-N 3.38Å; I161-I200 HydrophobicContact CB-CD1 4.44Å; I161-I200 HydrophobicContact CB-CG2 4.1Å; I161-I200 HydrophobicContact CG2-CD1 3.84Å; I161-I200 HydrophobicContact CG2-CG1 4.31Å; I161-I200 HydrophobicContact CG2-CG2 4.14Å; I161-D229 HydrophobicContact CD1-CB 4.26Å; I161-D229 WeakPolarHBondContact CD1-OD2 3.44Å
162	E	95.3	Very high	93.7	Very high	11 Å²	11	36.3 Å²	36.3	5%	0.051	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-47.4	174.4	-172.9	-155.9	171.8	0	0	111.3	A158 L159 Q160 V164 G165 R166 F177 T179 I200	A158-E162 PolarHBondContact O-N 2.86Å; L159-E162 PolarHBondContact O-N 3.49Å; Q160-E162 VanDerWaalsContact C-N 3.26Å; Q160-E162 PolarHBondContact O-N 3.23Å; E162-V164 PolarHBondContact O-N 2.75Å; E162-G165 PolarHBondContact O-N 3.48Å; E162-R166 HydrophobicContact CG-CG 4.5Å; E162-R166 WeakPolarHBondContact O-CG 3.28Å; E162-R166 PolarHBondContact O-N 2.91Å; E162-R166 IonicContact OE1-CZ 3.22Å; E162-R166 IonicContact OE1-NE 3.59Å; E162-R166 PolarHBondContact OE1-NE 3.09Å; E162-R166 IonicContact OE1-NH2 3.12Å; E162-R166 PolarHBondContact OE1-NH2 3.42Å; E162-F177 HydrophobicContact CG-CB 4.17Å; E162-T179 PolarHBondContact OE1-OG1 2.96Å; E162-T179 PolarHBondContact OE2-OG1 3.47Å; E162-I200 VanDerWaalsContact CA-CD1 3.45Å; E162-I200 HydrophobicContact CB-CD1 3.91Å; E162-I200 HydrophobicContact CG-CD1 4.48Å
163	S	93.1	Very high	93.7	Very high	57 Å²	57	42.1 Å²	42.1	40%	0.399	21%	0.21	S	C	.	.	H	α-helix	trans	-58.3	-47.6	178.5	-178.7	0	0	0	0	112	L159 Q160 G165 R166 Q167	L159-S163 WeakPolarHBondContact O-CB 3.48Å; L159-S163 PolarHBondContact O-N 3.17Å; Q160-S163 WeakPolarHBondContact O-CB 3.34Å; Q160-S163 PolarHBondContact O-N 2.92Å; S163-G165 VanDerWaalsContact C-N 3.35Å; S163-G165 PolarHBondContact O-N 2.79Å; S163-R166 PolarHBondContact O-N 3.46Å; S163-Q167 WeakPolarHBondContact O-CG 3.35Å; S163-Q167 PolarHBondContact O-N 3.09Å; S163-Q167 PolarHBondContact OG-NE2 2.77Å
164	V	92.3	Very high	93.8	Very high	34 Å²	34	47.4 Å²	47.4	21%	0.206	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-43.4	176.8	177.5	0	0	0	0	110.6	M93 L132 Q160 I161 E162 R166 Q167 M168	M93-V164 HydrophobicContact CE-CG1 3.87Å; L132-V164 HydrophobicContact CD1-CB 3.78Å; L132-V164 HydrophobicContact CD1-CG1 3.47Å; L132-V164 VanDerWaalsContact CD1-CG1 3.47Å; Q160-V164 WeakPolarHBondContact O-CG2 3.41Å; Q160-V164 PolarHBondContact O-N 2.81Å; I161-V164 PolarHBondContact O-N 3.5Å; E162-V164 PolarHBondContact O-N 2.75Å; V164-R166 PolarHBondContact O-N 3.42Å; V164-Q167 PolarHBondContact O-N 2.9Å; V164-M168 WeakPolarHBondContact O-CB 3.39Å; V164-M168 PolarHBondContact O-N 3.15Å
165	G	95.3	Very high	94	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-43.9	177.9	0	0	0	0	0	112.8	I161 E162 S163 M168 A169 F177	I161-G165 PolarHBondContact O-N 3.38Å; E162-G165 PolarHBondContact O-N 3.48Å; S163-G165 VanDerWaalsContact C-N 3.35Å; S163-G165 PolarHBondContact O-N 2.79Å; G165-M168 PolarHBondContact O-N 3.11Å; G165-A169 VanDerWaalsContact O-CB 3.31Å; G165-A169 WeakPolarHBondContact O-CB 3.48Å; G165-A169 PolarHBondContact O-N 3.47Å; G165-F177 WeakPolarHBondContact O-CZ 3.5Å
166	R	95.4	Very high	94.2	Very high	107 Å²	107	42.2 Å²	42.2	40%	0.404	22%	0.216	S	C	.	.	H	α-helix	trans	-65.1	-39.8	176.6	-73.1	-174	-175.4	-74.6	0	112.6	E162 S163 V164 A169 Q170 F177	E162-R166 HydrophobicContact CG-CG 4.5Å; E162-R166 WeakPolarHBondContact O-CG 3.28Å; E162-R166 PolarHBondContact O-N 2.91Å; E162-R166 IonicContact OE1-CZ 3.22Å; E162-R166 IonicContact OE1-NE 3.59Å; E162-R166 PolarHBondContact OE1-NE 3.09Å; E162-R166 IonicContact OE1-NH2 3.12Å; E162-R166 PolarHBondContact OE1-NH2 3.42Å; S163-R166 PolarHBondContact O-N 3.46Å; V164-R166 PolarHBondContact O-N 3.42Å; R166-A169 CarbonylContact O-C 3.49Å; R166-A169 PolarHBondContact O-N 3.14Å; R166-Q170 PolarHBondContact O-N 2.87Å; R166-F177 HydrophobicContact CG-CB 4.48Å; R166-F177 HydrophobicContact CG-CD2 3.85Å; R166-F177 HydrophobicContact CG-CE2 4.25Å; R166-F177 HydrophobicContact CG-CG 4.18Å; R166-F177 PolarHBondContact NH2-O 3.36Å
167	Q	93.6	Very high	94.7	Very high	95 Å²	95	39.4 Å²	39.4	44%	0.444	20%	0.202	S	C	.	.	H	α-helix	trans	-64.3	-41.6	174.9	-72.3	177.3	58.1	0	0	111.6	M93 S163 V164 A169 Q170	M93-Q167 HydrophobicContact CE-CB 4.11Å; M93-Q167 HydrophobicContact CG-CB 4.33Å; M93-Q167 HydrophobicContact SD-CB 4.13Å; S163-Q167 WeakPolarHBondContact O-CG 3.35Å; S163-Q167 PolarHBondContact O-N 3.09Å; S163-Q167 PolarHBondContact OG-NE2 2.77Å; V164-Q167 PolarHBondContact O-N 2.9Å; Q167-A169 VanDerWaalsContact C-N 3.31Å; Q167-A169 PolarHBondContact O-N 3.36Å; Q167-Q170 WeakPolarHBondContact O-CB 3.36Å; Q167-Q170 VanDerWaalsContact O-CG 3.27Å; Q167-Q170 WeakPolarHBondContact O-CG 3.4Å; Q167-Q170 PolarHBondContact O-N 3.28Å; Q167-Q170 PolarHBondContact O-NE2 3.42Å
168	M	94.5	Very high	95	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-35.8	176.3	-168.4	177.7	-68.7	0	0	111.9	L86 G89 I90 M93 A129 L132 L133 L136 V164 G165	L86-M168 HydrophobicContact CD1-CG 3.8Å; L86-M168 HydrophobicContact CD1-SD 4.26Å; G89-M168 WeakPolarHBondContact CA-O 3.28Å; I90-M168 HydrophobicContact CG1-CG 3.95Å; I90-M168 HydrophobicContact CG1-SD 4.31Å; M93-M168 WeakPolarHBondContact SD-CA 3.33Å; M93-M168 HydrophobicContact SD-CB 3.65Å; M93-M168 HydrophobicContact SD-CE 4.4Å; M93-M168 HydrophobicContact SD-CG 4.22Å; M93-M168 PolarHBondContact SD-N 3.15Å; M93-M168 VanDerWaalsContact SD-N 3.43Å; A129-M168 HydrophobicContact CB-CE 4.02Å; L132-M168 HydrophobicContact CB-CE 4.28Å; L132-M168 HydrophobicContact CB-SD 4.15Å; L133-M168 HydrophobicContact CB-SD 3.94Å; L136-M168 HydrophobicContact CD1-CB 3.89Å; L136-M168 HydrophobicContact CD1-CG 3.7Å; L136-M168 HydrophobicContact CD1-SD 3.76Å; V164-M168 WeakPolarHBondContact O-CB 3.39Å; V164-M168 PolarHBondContact O-N 3.15Å; G165-M168 PolarHBondContact O-N 3.11Å
169	A	96.7	Very high	95.1	Very high	8 Å²	8	39.4 Å²	39.4	7%	0.066	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	11	178.5	0	0	0	0	0	114.2	L136 G165 R166 Q167 F171 M172 V175 F177	L136-A169 HydrophobicContact CD1-CB 4.1Å; L136-A169 HydrophobicContact CD2-CB 3.73Å; G165-A169 VanDerWaalsContact O-CB 3.31Å; G165-A169 WeakPolarHBondContact O-CB 3.48Å; G165-A169 PolarHBondContact O-N 3.47Å; R166-A169 CarbonylContact O-C 3.49Å; R166-A169 PolarHBondContact O-N 3.14Å; Q167-A169 VanDerWaalsContact C-N 3.31Å; Q167-A169 PolarHBondContact O-N 3.36Å; A169-F171 PolarHBondContact O-N 2.66Å; A169-M172 HydrophobicContact CB-CB 4.46Å; A169-M172 WeakPolarHBondContact O-CA 3.45Å; A169-M172 WeakPolarHBondContact O-CB 3.28Å; A169-M172 PolarHBondContact O-N 3.38Å; A169-V175 HydrophobicContact CB-CB 4.44Å; A169-V175 HydrophobicContact CB-CG1 4.28Å; A169-F177 HydrophobicContact CB-CE2 3.9Å; A169-F177 HydrophobicContact CB-CZ 4.32Å
170	Q	96.5	Very high	95.3	Very high	101 Å²	101	37.7 Å²	37.7	47%	0.472	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.7	-170	71.3	-175.1	-76.5	0	0	114.6	R166 Q167	R166-Q170 PolarHBondContact O-N 2.87Å; Q167-Q170 WeakPolarHBondContact O-CB 3.36Å; Q167-Q170 VanDerWaalsContact O-CG 3.27Å; Q167-Q170 WeakPolarHBondContact O-CG 3.4Å; Q167-Q170 PolarHBondContact O-N 3.28Å; Q167-Q170 PolarHBondContact O-NE2 3.42Å
171	F	96.9	Very high	95.5	Very high	67 Å²	67	36.7 Å²	36.7	29%	0.294	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	8.1	175.5	-57.3	-72	0	0	0	113.6	P85 K88 A92 A169 P173	P85-F171 HydrophobicContact CB-CB 4.04Å; P85-F171 WeakPolarHBondContact CB-O 3.39Å; K88-F171 HydrophobicContact CB-CD2 3.76Å; K88-F171 HydrophobicContact CB-CE2 4.15Å; K88-F171 HydrophobicContact CB-CG 4.3Å; K88-F171 HydrophobicContact CD-CB 4.48Å; K88-F171 HydrophobicContact CD-CD1 3.82Å; K88-F171 HydrophobicContact CD-CD2 3.79Å; K88-F171 HydrophobicContact CD-CE1 3.93Å; K88-F171 HydrophobicContact CD-CE2 3.91Å; K88-F171 HydrophobicContact CD-CG 3.75Å; K88-F171 HydrophobicContact CD-CZ 3.98Å; K88-F171 VanDerWaalsContact CE-CE1 3.48Å; K88-F171 HydrophobicContact CG-CD2 3.63Å; K88-F171 HydrophobicContact CG-CE1 4.48Å; K88-F171 HydrophobicContact CG-CE2 3.58Å; K88-F171 HydrophobicContact CG-CG 4.12Å; K88-F171 HydrophobicContact CG-CZ 4.04Å; A92-F171 HydrophobicContact CB-CE2 3.91Å; A92-F171 HydrophobicContact CB-CZ 4.41Å; A169-F171 PolarHBondContact O-N 2.66Å; F171-P173 VanDerWaalsContact O-CD 3.25Å; F171-P173 WeakPolarHBondContact O-CD 3.33Å
172	M	96.6	Very high	95.2	Very high	14 Å²	14	48 Å²	48	7%	0.069	23%	0.232	C	C	.	.			trans	-113.4	75.5	178.1	-60.3	177.5	75.3	0	0	109.9	K83 P85 L86 L136 A169 E174 V175	K83-M172 HydrophobicContact CD-CE 4.17Å; P85-M172 HydrophobicContact CB-CG 3.78Å; L86-M172 HydrophobicContact CB-SD 3.96Å; L86-M172 HydrophobicContact CD1-SD 4.32Å; L136-M172 HydrophobicContact CD2-SD 4.49Å; A169-M172 HydrophobicContact CB-CB 4.46Å; A169-M172 WeakPolarHBondContact O-CA 3.45Å; A169-M172 WeakPolarHBondContact O-CB 3.28Å; A169-M172 PolarHBondContact O-N 3.38Å; M172-E174 PolarHBondContact O-N 2.97Å; M172-E174 VanDerWaalsContact O-N 3.1Å; M172-V175 HydrophobicContact CB-CB 4.19Å; M172-V175 HydrophobicContact CB-CG2 3.61Å; M172-V175 HydrophobicContact CE-CG2 3.72Å; M172-V175 HydrophobicContact CG-CG2 4.49Å; M172-V175 WeakPolarHBondContact O-CB 3.26Å; M172-V175 PolarHBondContact O-N 3.37Å; M172-V175 HydrophobicContact SD-CG2 4.24Å
173	P	94.6	Very high	94.8	Very high	121 Å²	121	51.5 Å²	51.5	79%	0.786	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.9	-171.3	25.3	-35.7	0	0	0	114.4	F171 V175	F171-P173 VanDerWaalsContact O-CD 3.25Å; F171-P173 WeakPolarHBondContact O-CD 3.33Å; P173-V175 VanDerWaalsContact C-N 3.27Å; P173-V175 PolarHBondContact O-N 2.62Å
174	E	95.2	Very high	94.6	Very high	116 Å²	116	51.2 Å²	51.2	54%	0.542	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.3	177.8	-57	-62.6	167.3	0	0	113.4	T141 M172 Q197	T141-E174 HydrophobicContact CG2-CB 4.01Å; M172-E174 PolarHBondContact O-N 2.97Å; M172-E174 VanDerWaalsContact O-N 3.1Å; E174-Q197 PolarHBondContact O-NE2 3.09Å; E174-Q197 VanDerWaalsContact O-NE2 3.07Å
175	V	96.4	Very high	94.5	Very high	14 Å²	14	56.6 Å²	56.6	9%	0.085	27%	0.271	C	S	.	.			trans	-82.7	130.1	179.2	178.6	0	0	0	0	109.4	L136 I139 T141 A169 M172 P173 F177 I198	L136-V175 HydrophobicContact CD2-CG1 3.76Å; L136-V175 HydrophobicContact CD2-CG2 4.47Å; I139-V175 HydrophobicContact CD1-CB 4.2Å; I139-V175 HydrophobicContact CD1-CG1 3.66Å; I139-V175 HydrophobicContact CD1-CG2 3.52Å; T141-V175 HydrophobicContact CG2-CG2 3.73Å; A169-V175 HydrophobicContact CB-CB 4.44Å; A169-V175 HydrophobicContact CB-CG1 4.28Å; M172-V175 HydrophobicContact CB-CB 4.19Å; M172-V175 HydrophobicContact CB-CG2 3.61Å; M172-V175 HydrophobicContact CE-CG2 3.72Å; M172-V175 HydrophobicContact CG-CG2 4.49Å; M172-V175 WeakPolarHBondContact O-CB 3.26Å; M172-V175 PolarHBondContact O-N 3.37Å; M172-V175 HydrophobicContact SD-CG2 4.24Å; P173-V175 VanDerWaalsContact C-N 3.27Å; P173-V175 PolarHBondContact O-N 2.62Å; V175-F177 HydrophobicContact CG1-CD2 4.17Å; V175-F177 HydrophobicContact CG1-CE2 3.67Å; V175-F177 HydrophobicContact CG1-CZ 4.38Å; V175-I198 HydrophobicContact CG1-CD1 4.34Å
176	S	96.5	Very high	94.4	Very high	14 Å²	14	58.3 Å²	58.3	10%	0.098	28%	0.281	C	S	.	.			trans	-128.5	144.8	177.6	62.7	0	0	0	0	112.1	D196 Q197 I198	S176-D196 WeakPolarHBondContact CB-OD1 3.47Å; S176-D196 VanDerWaalsContact OG-CA 3.31Å; S176-D196 WeakPolarHBondContact OG-CA 3.43Å; S176-D196 PolarHBondContact OG-OD1 3.35Å; S176-Q197 PolarHBondContact O-N 3.19Å; S176-Q197 PolarHBondContact OG-OE1 3.41Å; S176-I198 PolarHBondContact O-N 2.89Å; S176-I198 VanDerWaalsContact O-N 3.16Å
177	F	97.6	Very high	94.4	Very high	5 Å²	5	59.3 Å²	59.3	2%	0.022	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.3	-176.6	-69.9	-105.4	0	0	0	108.9	L136 E162 G165 R166 A169 V175 I198 I200	L136-F177 HydrophobicContact CD2-CE2 4.46Å; L136-F177 HydrophobicContact CD2-CZ 4.06Å; E162-F177 HydrophobicContact CG-CB 4.17Å; G165-F177 WeakPolarHBondContact O-CZ 3.5Å; R166-F177 HydrophobicContact CG-CB 4.48Å; R166-F177 HydrophobicContact CG-CD2 3.85Å; R166-F177 HydrophobicContact CG-CE2 4.25Å; R166-F177 HydrophobicContact CG-CG 4.18Å; R166-F177 PolarHBondContact NH2-O 3.36Å; A169-F177 HydrophobicContact CB-CE2 3.9Å; A169-F177 HydrophobicContact CB-CZ 4.32Å; V175-F177 HydrophobicContact CG1-CD2 4.17Å; V175-F177 HydrophobicContact CG1-CE2 3.67Å; V175-F177 HydrophobicContact CG1-CZ 4.38Å; F177-I198 CarbonylContact C-O 3.54Å; F177-I198 VanDerWaalsContact CA-O 3.28Å; F177-I198 WeakPolarHBondContact CA-O 3.21Å; F177-I198 HydrophobicContact CD1-CB 3.79Å; F177-I198 HydrophobicContact CD1-CD1 4.37Å; F177-I198 HydrophobicContact CD1-CG2 3.69Å; F177-I198 HydrophobicContact CE1-CB 3.99Å; F177-I198 HydrophobicContact CE1-CD1 3.72Å; F177-I198 HydrophobicContact CE1-CG1 4.43Å; F177-I198 HydrophobicContact CE1-CG2 3.76Å; F177-I198 HydrophobicContact CE2-CD1 4.4Å; F177-I198 HydrophobicContact CG-CB 4.31Å; F177-I198 HydrophobicContact CZ-CD1 3.74Å; F177-I200 HydrophobicContact CD1-CD1 3.88Å; F177-I200 HydrophobicContact CE1-CD1 4.25Å
178	A	97.3	Very high	94.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	149.6	169.4	0	0	0	0	0	111.6	R185 V186 V194 D196 I198 V199 I200	A178-R185 CarbonylContact C-O 3.54Å; A178-R185 VanDerWaalsContact CA-O 3.26Å; A178-R185 WeakPolarHBondContact CA-O 3.36Å; A178-V186 HydrophobicContact CB-CB 3.87Å; A178-V186 HydrophobicContact CB-CG2 3.64Å; A178-V194 HydrophobicContact CB-CG1 4.24Å; A178-D196 HydrophobicContact CB-CB 3.71Å; A178-D196 WeakPolarHBondContact CB-OD2 3.32Å; A178-I198 PolarHBondContact N-O 3.08Å; A178-V199 HydrophobicContact CB-CG2 4.17Å; A178-V199 WeakPolarHBondContact O-CA 3.34Å; A178-I200 PolarHBondContact O-N 3.31Å
179	T	96.8	Very high	94.5	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	109.5	178.8	-51.8	0	0	0	0	110.7	L159 E162 V181 P184 R185 I200	L159-T179 HydrophobicContact CD2-CG2 3.74Å; L159-T179 HydrophobicContact CG-CG2 4.47Å; E162-T179 PolarHBondContact OE1-OG1 2.96Å; E162-T179 PolarHBondContact OE2-OG1 3.47Å; T179-V181 HydrophobicContact CG2-CB 4.49Å; T179-V181 HydrophobicContact CG2-CG1 3.8Å; T179-V181 HydrophobicContact CG2-CG2 3.95Å; T179-V181 PolarHBondContact O-N 3.24Å; T179-P184 WeakPolarHBondContact O-CA 3.36Å; T179-P184 WeakPolarHBondContact O-CB 3.36Å; T179-R185 PolarHBondContact N-O 3.25Å; T179-R185 PolarHBondContact O-N 3.37Å; T179-I200 CarbonylContact C-O 3.56Å; T179-I200 VanDerWaalsContact CA-O 3.24Å; T179-I200 WeakPolarHBondContact CA-O 3.31Å
180	A	97	Very high	94.4	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	77.8	-179.2	0	0	0	0	0	110.6	V199 I200 G201 T202 T205 I206 W209	A180-V199 HydrophobicContact CB-CG1 3.9Å; A180-I200 PolarHBondContact N-O 3.03Å; A180-G201 WeakPolarHBondContact O-CA 3.41Å; A180-T202 PolarHBondContact O-N 3.07Å; A180-T205 HydrophobicContact CB-CG2 4.08Å; A180-T205 WeakPolarHBondContact O-CB 3.4Å; A180-T205 PolarHBondContact O-OG1 3.25Å; A180-I206 HydrophobicContact CB-CG1 3.8Å; A180-W209 HydrophobicContact CB-CD2 4.07Å; A180-W209 HydrophobicContact CB-CE3 3.89Å; A180-W209 HydrophobicContact CB-CH2 3.64Å; A180-W209 HydrophobicContact CB-CZ2 3.85Å; A180-W209 HydrophobicContact CB-CZ3 3.66Å
181	V	93.9	Very high	94.3	Very high	4 Å²	4	66 Å²	66	2%	0.024	34%	0.341	C	S	.	.	S	Bend	trans	-127.9	177.1	175.8	-61.3	0	0	0	0	109.8	R155 A158 T179 S183 P184 T202	R155-V181 HydrophobicContact CB-CB 4.34Å; R155-V181 HydrophobicContact CB-CG1 4.11Å; R155-V181 HydrophobicContact CG-CB 4.11Å; R155-V181 HydrophobicContact CG-CG1 4.09Å; R155-V181 HydrophobicContact CG-CG2 4.18Å; A158-V181 HydrophobicContact CB-CG1 4.15Å; T179-V181 HydrophobicContact CG2-CB 4.49Å; T179-V181 HydrophobicContact CG2-CG1 3.8Å; T179-V181 HydrophobicContact CG2-CG2 3.95Å; T179-V181 PolarHBondContact O-N 3.24Å; V181-S183 WeakPolarHBondContact CG2-O 3.47Å; V181-S183 PolarHBondContact O-N 2.84Å; V181-P184 WeakPolarHBondContact O-CD 3.23Å; V181-T202 HydrophobicContact CG1-CG2 4.33Å
182	R	87.4	Confident	94.2	Very high	239 Å²	239	63.3 Å²	63.3	90%	0.902	33%	0.332	S	S	*	.	S	Bend	trans	-55.5	-18	-178.9	-73.8	-172.7	-179.4	-172.3	2.1	114.6
183	S	88.3	Confident	94.2	Very high	84 Å²	84	67.2 Å²	67.2	59%	0.587	35%	0.347	S	S	*	.	S	Bend	trans	-127	83.4	170.4	-54	0	0	0	0	108.7	V181	V181-S183 WeakPolarHBondContact CG2-O 3.47Å; V181-S183 PolarHBondContact O-N 2.84Å
184	P	87.5	Confident	94.3	Very high	51 Å²	51	61.7 Å²	61.7	33%	0.331	31%	0.31	S	S	.	.			trans	-72.9	148.5	-168.5	29.5	-34.5	0	0	0	112.2	T179 V181 V186 W209	T179-P184 WeakPolarHBondContact O-CA 3.36Å; T179-P184 WeakPolarHBondContact O-CB 3.36Å; V181-P184 WeakPolarHBondContact O-CD 3.23Å; P184-V186 HydrophobicContact CB-CG1 4.18Å; P184-W209 HydrophobicContact CB-CH2 4.24Å; P184-W209 HydrophobicContact CB-CZ2 3.7Å; P184-W209 HydrophobicContact CG-CZ2 4.46Å
185	R	90.8	Very high	94.4	Very high	146 Å²	146	57.7 Å²	57.7	55%	0.551	29%	0.294	S	S	*	.	B	Isolated β-bridge	trans	-118.6	101.9	169	-72.7	-176	-103.3	-174.1	-6.9	107	A178 T179	A178-R185 CarbonylContact C-O 3.54Å; A178-R185 VanDerWaalsContact CA-O 3.26Å; A178-R185 WeakPolarHBondContact CA-O 3.36Å; T179-R185 PolarHBondContact N-O 3.25Å; T179-R185 PolarHBondContact O-N 3.37Å
186	V	93.9	Very high	94.5	Very high	36 Å²	36	57.2 Å²	57.2	22%	0.218	29%	0.291	C	S	.	.			trans	-154.4	145.2	-168.3	60.7	0	0	0	0	111.4	A178 P184 V188 V194 W209 H216	A178-V186 HydrophobicContact CB-CB 3.87Å; A178-V186 HydrophobicContact CB-CG2 3.64Å; P184-V186 HydrophobicContact CB-CG1 4.18Å; V186-V188 HydrophobicContact CG2-CG1 4.26Å; V186-V194 HydrophobicContact CG2-CB 4.15Å; V186-V194 HydrophobicContact CG2-CG1 3.64Å; V186-V194 HydrophobicContact CG2-CG2 3.67Å; V186-W209 HydrophobicContact CB-CH2 3.78Å; V186-W209 HydrophobicContact CB-CZ3 4.47Å; V186-W209 HydrophobicContact CG1-CH2 3.86Å; V186-W209 HydrophobicContact CG1-CZ2 4.17Å; V186-W209 HydrophobicContact CG2-CH2 3.79Å; V186-W209 HydrophobicContact CG2-CZ3 4Å; V186-H216 WeakPolarHBondContact CG1-CD2 3.43Å; V186-H216 WeakPolarHBondContact CG1-NE2 3.43Å
187	K	94.5	Very high	94.6	Very high	128 Å²	128	56.6 Å²	56.6	56%	0.557	29%	0.287	S	S	*	.			trans	-98.4	136.4	168.9	-60.1	173.9	-174.2	172.1	0	108.9	V194 T195 D196	K187-V194 WeakPolarHBondContact O-CA 3.35Å; K187-T195 WeakPolarHBondContact CB-OG1 3.19Å; K187-T195 PolarHBondContact O-N 3.08Å; K187-T195 PolarHBondContact O-OG1 2.99Å; K187-D196 WeakPolarHBondContact CB-OD2 3.32Å; K187-D196 PolarHBondContact N-OD2 3.3Å
188	V	95.8	Very high	94.6	Very high	62 Å²	62	56.3 Å²	56.3	38%	0.376	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-130.5	155.3	177.8	-65.2	0	0	0	0	111.8	V186 Y193 V194	V186-V188 HydrophobicContact CG2-CG1 4.26Å; V188-Y193 CarbonylContact C-O 3.45Å; V188-Y193 WeakPolarHBondContact CA-O 3.28Å; V188-V194 HydrophobicContact CG1-CG2 4.46Å
189	D	95	Very high	94.7	Very high	61 Å²	61	56.3 Å²	56.3	33%	0.326	29%	0.285	S	S	.	.			trans	-77.6	-178.6	166.9	75.4	4.8	0	0	0	111.9	N191 G192 Y193 T195	D189-N191 PolarHBondContact O-N 3.19Å; D189-N191 VanDerWaalsContact O-N 3.12Å; D189-N191 WeakPolarHBondContact OD1-CA 3.38Å; D189-N191 WeakPolarHBondContact OD1-CB 3.4Å; D189-N191 PolarHBondContact OD1-N 3.14Å; D189-G192 PolarHBondContact O-N 2.98Å; D189-G192 VanDerWaalsContact O-N 3.07Å; D189-G192 PolarHBondContact OD1-N 2.64Å; D189-Y193 PolarHBondContact N-O 2.97Å; D189-Y193 PolarHBondContact OD1-N 2.93Å; D189-T195 HydrophobicContact CB-CG2 4.13Å
190	S	94.2	Very high	94.7	Very high	120 Å²	120	56.3 Å²	56.3	84%	0.839	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.5	178.8	54.1	0	0	0	0	114.7
191	N	93.6	Very high	94.8	Very high	104 Å²	104	56.3 Å²	56.3	56%	0.556	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	2.1	178.8	-60.4	-55.2	0	0	0	112.4	D189 Y193 R217	D189-N191 PolarHBondContact O-N 3.19Å; D189-N191 VanDerWaalsContact O-N 3.12Å; D189-N191 WeakPolarHBondContact OD1-CA 3.38Å; D189-N191 WeakPolarHBondContact OD1-CB 3.4Å; D189-N191 PolarHBondContact OD1-N 3.14Å; N191-Y193 HydrophobicContact CB-CD2 3.83Å; N191-Y193 HydrophobicContact CB-CE2 4.12Å; N191-R217 PolarHBondContact O-NE 3.39Å
192	G	94.9	Very high	94.9	Very high	9 Å²	9	57.1 Å²	57.1	9%	0.093	29%	0.29	C	S	.	.			trans	82.2	9.2	-177.9	0	0	0	0	0	114.2	D189 E215 H216 R217	D189-G192 PolarHBondContact O-N 2.98Å; D189-G192 VanDerWaalsContact O-N 3.07Å; D189-G192 PolarHBondContact OD1-N 2.64Å; G192-E215 VanDerWaalsContact CA-O 3.32Å; G192-E215 WeakPolarHBondContact CA-O 3.22Å; G192-H216 CarbonylContact O-C 3.56Å; G192-H216 WeakPolarHBondContact O-CA 3.25Å; G192-R217 PolarHBondContact O-N 3.48Å
193	Y	97	Very high	95.3	Very high	97 Å²	97	45.8 Å²	45.8	38%	0.38	25%	0.248	S	C	.	.	B	Isolated β-bridge	trans	-75.3	132	175	-73.9	-80.1	0	0	0	110.9	V188 D189 N191 T195 R217 D219	V188-Y193 CarbonylContact C-O 3.45Å; V188-Y193 WeakPolarHBondContact CA-O 3.28Å; D189-Y193 PolarHBondContact N-O 2.97Å; D189-Y193 PolarHBondContact OD1-N 2.93Å; N191-Y193 HydrophobicContact CB-CD2 3.83Å; N191-Y193 HydrophobicContact CB-CE2 4.12Å; Y193-T195 PolarHBondContact O-N 3.5Å; Y193-R217 WeakPolarHBondContact CA-O 3.43Å; Y193-R217 HydrophobicContact CD1-CB 3.82Å; Y193-R217 HydrophobicContact CE1-CB 3.94Å; Y193-R217 HydrophobicContact CG-CB 4.35Å; Y193-D219 HydrophobicContact CD1-CB 4.36Å; Y193-D219 HydrophobicContact CE1-CB 4.18Å
194	V	97.3	Very high	95.6	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.024	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-62.1	125.1	177.2	178	0	0	0	0	110.6	Y145 C146 A178 V186 K187 V188 D196 V199 W209 R217 I218	Y145-V194 WeakPolarHBondContact CA-O 3.13Å; C146-V194 PolarHBondContact N-O 3.41Å; A178-V194 HydrophobicContact CB-CG1 4.24Å; V186-V194 HydrophobicContact CG2-CB 4.15Å; V186-V194 HydrophobicContact CG2-CG1 3.64Å; V186-V194 HydrophobicContact CG2-CG2 3.67Å; K187-V194 WeakPolarHBondContact O-CA 3.35Å; V188-V194 HydrophobicContact CG1-CG2 4.46Å; V194-D196 HydrophobicContact CG1-CB 4.04Å; V194-V199 HydrophobicContact CG1-CG2 3.84Å; V194-W209 HydrophobicContact CG2-CE3 3.65Å; V194-W209 HydrophobicContact CG2-CH2 4.44Å; V194-W209 HydrophobicContact CG2-CZ3 3.58Å; V194-R217 PolarHBondContact N-O 2.93Å; V194-I218 HydrophobicContact CB-CG1 4.3Å; V194-I218 HydrophobicContact CG2-CG1 4Å
195	T	97.4	Very high	96	Very high	33 Å²	33	42.3 Å²	42.3	20%	0.202	23%	0.229	C	C	.	.			trans	-96.1	-13	179.1	55.7	0	0	0	0	113.2	H144 Y145 K187 D189 Y193	H144-T195 CarbonylContact C-O 3.59Å; H144-T195 VanDerWaalsContact C-O 3.25Å; H144-T195 WeakPolarHBondContact CA-O 3.24Å; Y145-T195 PolarHBondContact N-O 2.87Å; K187-T195 WeakPolarHBondContact CB-OG1 3.19Å; K187-T195 PolarHBondContact O-N 3.08Å; K187-T195 PolarHBondContact O-OG1 2.99Å; D189-T195 HydrophobicContact CB-CG2 4.13Å; Y193-T195 PolarHBondContact O-N 3.5Å
196	D	97.8	Very high	96.3	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.203	C	C	.	.			trans	-68.1	136.1	172.6	-59.9	-79.9	0	0	0	111.7	Y145 C146 S176 A178 K187 V194	Y145-D196 CarbonylContact C-O 3.58Å; C146-D196 WeakPolarHBondContact CA-O 3.3Å; C146-D196 PolarHBondContact N-O 3.47Å; C146-D196 VanDerWaalsContact N-O 3.15Å; S176-D196 WeakPolarHBondContact CB-OD1 3.47Å; S176-D196 VanDerWaalsContact OG-CA 3.31Å; S176-D196 WeakPolarHBondContact OG-CA 3.43Å; S176-D196 PolarHBondContact OG-OD1 3.35Å; A178-D196 HydrophobicContact CB-CB 3.71Å; A178-D196 WeakPolarHBondContact CB-OD2 3.32Å; K187-D196 WeakPolarHBondContact CB-OD2 3.32Å; K187-D196 PolarHBondContact N-OD2 3.3Å; V194-D196 HydrophobicContact CG1-CB 4.04Å
197	Q	98.2	Very high	96.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-75.1	-28.5	-175.4	-60.9	92.8	-20.5	0	0	113.5	I139 T141 V143 Y145 Q147 C148 E174 S176	I139-Q197 HydrophobicContact CG2-CB 4.27Å; T141-Q197 PolarHBondContact O-NE2 2.76Å; V143-Q197 WeakPolarHBondContact O-CG 3.34Å; Y145-Q197 WeakPolarHBondContact O-CA 3.43Å; Q147-Q197 PolarHBondContact N-O 3.27Å; C148-Q197 PolarHBondContact N-O 3.32Å; E174-Q197 PolarHBondContact O-NE2 3.09Å; E174-Q197 VanDerWaalsContact O-NE2 3.07Å; S176-Q197 PolarHBondContact O-N 3.19Å; S176-Q197 PolarHBondContact OG-OE1 3.41Å
198	I	98.4	Very high	96.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.3	179.3	-57.1	179.7	0	0	0	109.2	M135 L136 I139 C148 V175 S176 F177 A178 I200	M135-I198 HydrophobicContact CB-CD1 4.2Å; M135-I198 HydrophobicContact SD-CG2 3.97Å; L136-I198 HydrophobicContact CD2-CD1 3.78Å; L136-I198 HydrophobicContact CG-CD1 4.3Å; I139-I198 HydrophobicContact CD1-CD1 4.17Å; I139-I198 HydrophobicContact CG2-CD1 4.43Å; I139-I198 HydrophobicContact CG2-CG1 4.07Å; C148-I198 HydrophobicContact CB-CG1 4.22Å; C148-I198 WeakPolarHBondContact O-CA 3.41Å; V175-I198 HydrophobicContact CG1-CD1 4.34Å; S176-I198 PolarHBondContact O-N 2.89Å; S176-I198 VanDerWaalsContact O-N 3.16Å; F177-I198 CarbonylContact C-O 3.54Å; F177-I198 VanDerWaalsContact CA-O 3.28Å; F177-I198 WeakPolarHBondContact CA-O 3.21Å; F177-I198 HydrophobicContact CD1-CB 3.79Å; F177-I198 HydrophobicContact CD1-CD1 4.37Å; F177-I198 HydrophobicContact CD1-CG2 3.69Å; F177-I198 HydrophobicContact CE1-CB 3.99Å; F177-I198 HydrophobicContact CE1-CD1 3.72Å; F177-I198 HydrophobicContact CE1-CG1 4.43Å; F177-I198 HydrophobicContact CE1-CG2 3.76Å; F177-I198 HydrophobicContact CE2-CD1 4.4Å; F177-I198 HydrophobicContact CG-CB 4.31Å; F177-I198 HydrophobicContact CZ-CD1 3.74Å; A178-I198 PolarHBondContact N-O 3.08Å; I198-I200 HydrophobicContact CG2-CD1 4.39Å; I198-I200 HydrophobicContact CG2-CG1 4.2Å
199	V	98.5	Very high	96.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.3	174.6	179	0	0	0	0	109.8	C146 C148 L149 C150 A178 A180 V194 W209 I218	C146-V199 HydrophobicContact CB-CG2 3.83Å; C146-V199 WeakPolarHBondContact SG-CG2 3.28Å; C148-V199 PolarHBondContact O-N 3.09Å; L149-V199 CarbonylContact C-O 3.59Å; L149-V199 WeakPolarHBondContact CA-O 3.34Å; L149-V199 HydrophobicContact CD1-CB 3.98Å; L149-V199 HydrophobicContact CD1-CG1 4Å; C150-V199 PolarHBondContact N-O 3.24Å; A178-V199 HydrophobicContact CB-CG2 4.17Å; A178-V199 WeakPolarHBondContact O-CA 3.34Å; A180-V199 HydrophobicContact CB-CG1 3.9Å; V194-V199 HydrophobicContact CG1-CG2 3.84Å; V199-W209 HydrophobicContact CG1-CE3 4.32Å; V199-W209 HydrophobicContact CG1-CZ3 3.95Å; V199-I218 HydrophobicContact CB-CD1 4.26Å; V199-I218 HydrophobicContact CG1-CD1 4.06Å; V199-I218 HydrophobicContact CG2-CD1 4.01Å
200	I	98.3	Very high	96.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.5	175.2	-57.7	158.5	0	0	0	108.2	C150 A158 I161 E162 F177 A178 T179 A180 I198	C150-I200 HydrophobicContact CB-CB 4.32Å; C150-I200 HydrophobicContact CB-CG1 3.88Å; C150-I200 HydrophobicContact CB-CG2 4.17Å; C150-I200 CarbonylContact O-C 3.57Å; C150-I200 WeakPolarHBondContact O-CA 3.42Å; A158-I200 HydrophobicContact CB-CG2 3.99Å; A158-I200 WeakPolarHBondContact O-CG2 3.17Å; I161-I200 HydrophobicContact CB-CD1 4.44Å; I161-I200 HydrophobicContact CB-CG2 4.1Å; I161-I200 HydrophobicContact CG2-CD1 3.84Å; I161-I200 HydrophobicContact CG2-CG1 4.31Å; I161-I200 HydrophobicContact CG2-CG2 4.14Å; E162-I200 VanDerWaalsContact CA-CD1 3.45Å; E162-I200 HydrophobicContact CB-CD1 3.91Å; E162-I200 HydrophobicContact CG-CD1 4.48Å; F177-I200 HydrophobicContact CD1-CD1 3.88Å; F177-I200 HydrophobicContact CE1-CD1 4.25Å; A178-I200 PolarHBondContact O-N 3.31Å; T179-I200 CarbonylContact C-O 3.56Å; T179-I200 VanDerWaalsContact CA-O 3.24Å; T179-I200 WeakPolarHBondContact CA-O 3.31Å; A180-I200 PolarHBondContact N-O 3.03Å; I198-I200 HydrophobicContact CG2-CD1 4.39Å; I198-I200 HydrophobicContact CG2-CG1 4.2Å
201	G	97.6	Very high	96.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-175.3	-178.9	0	0	0	0	0	115.7	C150 M151 A152 A180	C150-G201 PolarHBondContact O-N 3.07Å; M151-G201 WeakPolarHBondContact CA-O 3.35Å; A152-G201 PolarHBondContact N-O 3.36Å; A180-G201 WeakPolarHBondContact O-CA 3.41Å
202	T	96.3	Very high	96.2	Very high	22 Å²	22	23.4 Å²	23.4	14%	0.135	13%	0.128	C	C	.	.			trans	-87	149.2	178.7	58.1	0	0	0	0	111.5	A152 A180 V181 G204 T205 I206	A152-T202 WeakPolarHBondContact O-CA 3.5Å; A180-T202 PolarHBondContact O-N 3.07Å; V181-T202 HydrophobicContact CG1-CG2 4.33Å; T202-G204 VanDerWaalsContact C-N 3.31Å; T202-G204 PolarHBondContact O-N 2.85Å; T202-T205 PolarHBondContact O-N 3.5Å; T202-T205 VanDerWaalsContact O-N 3.16Å; T202-T205 PolarHBondContact OG1-OG1 3.27Å; T202-T205 VanDerWaalsContact OG1-OG1 3.04Å; T202-I206 PolarHBondContact O-N 2.98Å
203	P	96.3	Very high	95.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-52.3	-45.7	-176	-29.7	35.5	0	0	0	113.6	M151 A152 T205 I206 A207 M234 F240 I243	M151-P203 HydrophobicContact SD-CB 4.19Å; M151-P203 HydrophobicContact SD-CG 4.27Å; A152-P203 WeakPolarHBondContact O-CD 3.21Å; P203-T205 PolarHBondContact O-N 2.72Å; P203-I206 PolarHBondContact O-N 2.88Å; P203-A207 WeakPolarHBondContact O-CB 3.21Å; P203-A207 PolarHBondContact O-N 3.07Å; P203-M234 HydrophobicContact CG-CE 3.68Å; P203-M234 HydrophobicContact CG-SD 3.65Å; P203-F240 HydrophobicContact CB-CG 4.38Å; P203-F240 HydrophobicContact CG-CB 4.47Å; P203-F240 HydrophobicContact CG-CD2 3.85Å; P203-F240 HydrophobicContact CG-CE2 4.24Å; P203-F240 HydrophobicContact CG-CG 4.07Å; P203-I243 HydrophobicContact CB-CB 4.25Å; P203-I243 HydrophobicContact CB-CG2 3.79Å; P203-I243 VanDerWaalsContact O-CG2 3.32Å; P203-I243 WeakPolarHBondContact O-CG2 3.33Å
204	G	94.5	Very high	94.9	Very high	38 Å²	38	24.3 Å²	24.3	39%	0.392	15%	0.148	S	C	.	.	H	α-helix	trans	-61.2	-42.6	-178.9	0	0	0	0	0	113.7	T202 N208	T202-G204 VanDerWaalsContact C-N 3.31Å; T202-G204 PolarHBondContact O-N 2.85Å; G204-N208 PolarHBondContact O-N 3.47Å
205	T	95.4	Very high	94.6	Very high	24 Å²	24	31.7 Å²	31.7	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-71.5	-46	-179.6	-45.2	0	0	0	0	110.9	A180 T202 P203 A207 N208 W209	A180-T205 HydrophobicContact CB-CG2 4.08Å; A180-T205 WeakPolarHBondContact O-CB 3.4Å; A180-T205 PolarHBondContact O-OG1 3.25Å; T202-T205 PolarHBondContact O-N 3.5Å; T202-T205 VanDerWaalsContact O-N 3.16Å; T202-T205 PolarHBondContact OG1-OG1 3.27Å; T202-T205 VanDerWaalsContact OG1-OG1 3.04Å; P203-T205 PolarHBondContact O-N 2.72Å; T205-A207 VanDerWaalsContact C-N 3.31Å; T205-A207 PolarHBondContact O-N 3.05Å; T205-N208 WeakPolarHBondContact O-CB 3.29Å; T205-N208 PolarHBondContact O-N 3.04Å; T205-N208 VanDerWaalsContact O-N 3.09Å; T205-W209 VanDerWaalsContact O-CD1 3.28Å; T205-W209 PolarHBondContact O-N 2.95Å
206	I	97.2	Very high	94.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-42.7	177.6	-72.5	166.6	0	0	0	110.7	L149 M151 A180 T202 P203 N208 W209 F210 V247	L149-I206 HydrophobicContact CD1-CD1 3.76Å; L149-I206 HydrophobicContact CD1-CG1 4.09Å; L149-I206 HydrophobicContact CD1-CG2 3.89Å; L149-I206 HydrophobicContact CD2-CG2 3.9Å; L149-I206 HydrophobicContact CG-CD1 4.48Å; L149-I206 HydrophobicContact CG-CG2 4.42Å; M151-I206 HydrophobicContact CE-CB 3.86Å; M151-I206 HydrophobicContact CE-CD1 4.31Å; M151-I206 HydrophobicContact CE-CG2 3.35Å; M151-I206 HydrophobicContact CG-CD1 3.5Å; M151-I206 VanDerWaalsContact CG-CD1 3.5Å; A180-I206 HydrophobicContact CB-CG1 3.8Å; T202-I206 PolarHBondContact O-N 2.98Å; P203-I206 PolarHBondContact O-N 2.88Å; I206-N208 PolarHBondContact O-N 3.41Å; I206-W209 PolarHBondContact O-N 3.16Å; I206-W209 VanDerWaalsContact O-N 3.08Å; I206-F210 HydrophobicContact CG2-CD2 3.82Å; I206-F210 HydrophobicContact CG2-CE2 3.87Å; I206-F210 WeakPolarHBondContact O-CD2 3.17Å; I206-F210 PolarHBondContact O-N 2.98Å; I206-V247 HydrophobicContact CG2-CG1 4.42Å
207	A	95.8	Very high	94.4	Very high	17 Å²	17	35.8 Å²	35.8	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-32.7	177.1	0	0	0	0	0	112.8	P203 T205 R211 I243 V247	P203-A207 WeakPolarHBondContact O-CB 3.21Å; P203-A207 PolarHBondContact O-N 3.07Å; T205-A207 VanDerWaalsContact C-N 3.31Å; T205-A207 PolarHBondContact O-N 3.05Å; A207-R211 PolarHBondContact O-N 2.8Å; A207-I243 HydrophobicContact CB-CG2 3.42Å; A207-I243 VanDerWaalsContact CB-CG2 3.42Å; A207-V247 HydrophobicContact CB-CG2 4Å
208	N	94.8	Very high	94.4	Very high	62 Å²	62	36.1 Å²	36.1	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-66.2	-43.9	171.8	-166.5	34.7	0	0	0	111.5	G204 T205 I206 F210 R211 G212	G204-N208 PolarHBondContact O-N 3.47Å; T205-N208 WeakPolarHBondContact O-CB 3.29Å; T205-N208 PolarHBondContact O-N 3.04Å; T205-N208 VanDerWaalsContact O-N 3.09Å; I206-N208 PolarHBondContact O-N 3.41Å; N208-F210 VanDerWaalsContact C-N 3.3Å; N208-F210 PolarHBondContact O-N 2.97Å; N208-R211 WeakPolarHBondContact O-CB 3.04Å; N208-R211 PolarHBondContact O-N 3.2Å; N208-R211 PolarHBondContact OD1-NH1 3Å; N208-G212 PolarHBondContact O-N 3.4Å
209	W	96.8	Very high	94.3	Very high	5 Å²	5	38.3 Å²	38.3	2%	0.019	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-34.6	177.3	-66.1	14	0	0	0	111.9	A180 P184 V186 V194 V199 T205 I206 R211 G212 H216 R217 I218	A180-W209 HydrophobicContact CB-CD2 4.07Å; A180-W209 HydrophobicContact CB-CE3 3.89Å; A180-W209 HydrophobicContact CB-CH2 3.64Å; A180-W209 HydrophobicContact CB-CZ2 3.85Å; A180-W209 HydrophobicContact CB-CZ3 3.66Å; P184-W209 HydrophobicContact CB-CH2 4.24Å; P184-W209 HydrophobicContact CB-CZ2 3.7Å; P184-W209 HydrophobicContact CG-CZ2 4.46Å; V186-W209 HydrophobicContact CB-CH2 3.78Å; V186-W209 HydrophobicContact CB-CZ3 4.47Å; V186-W209 HydrophobicContact CG1-CH2 3.86Å; V186-W209 HydrophobicContact CG1-CZ2 4.17Å; V186-W209 HydrophobicContact CG2-CH2 3.79Å; V186-W209 HydrophobicContact CG2-CZ3 4Å; V194-W209 HydrophobicContact CG2-CE3 3.65Å; V194-W209 HydrophobicContact CG2-CH2 4.44Å; V194-W209 HydrophobicContact CG2-CZ3 3.58Å; V199-W209 HydrophobicContact CG1-CE3 4.32Å; V199-W209 HydrophobicContact CG1-CZ3 3.95Å; T205-W209 VanDerWaalsContact O-CD1 3.28Å; T205-W209 PolarHBondContact O-N 2.95Å; I206-W209 PolarHBondContact O-N 3.16Å; I206-W209 VanDerWaalsContact O-N 3.08Å; W209-R211 VanDerWaalsContact C-N 3.3Å; W209-R211 PolarHBondContact O-N 3.21Å; W209-G212 PolarHBondContact O-N 3.44Å; W209-H216 HydrophobicContact CD2-CB 3.72Å; W209-H216 VanDerWaalsContact CE2-CB 3.44Å; W209-H216 AromaticContact CE2-CG 3.84Å; W209-H216 HydrophobicContact CE3-CB 4.38Å; W209-H216 HydrophobicContact CG-CB 3.92Å; W209-H216 HydrophobicContact CZ2-CB 3.89Å; W209-H216 AromaticContact CZ2-CG 3.85Å; W209-H216 AromaticContact NE1-CG 3.9Å; W209-H216 AromaticContact NE1-ND1 3.79Å; W209-R217 WeakPolarHBondContact O-CA 3.09Å; W209-I218 HydrophobicContact CB-CD1 4.32Å; W209-I218 HydrophobicContact CB-CG1 4.32Å; W209-I218 HydrophobicContact CE3-CD1 3.77Å; W209-I218 HydrophobicContact CE3-CG1 4.07Å; W209-I218 PolarHBondContact O-N 3.1Å; W209-I218 VanDerWaalsContact O-N 3.1Å
210	F	96.5	Very high	94.2	Very high	11 Å²	11	39.6 Å²	39.6	5%	0.048	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.9	172.8	-88.7	-119.7	0	0	0	113.6	L149 I206 N208 I218 P220 V223 V247 K250 L251	L149-F210 HydrophobicContact CD1-CE2 4.5Å; L149-F210 HydrophobicContact CD2-CE2 3.75Å; L149-F210 HydrophobicContact CD2-CZ 3.62Å; I206-F210 HydrophobicContact CG2-CD2 3.82Å; I206-F210 HydrophobicContact CG2-CE2 3.87Å; I206-F210 WeakPolarHBondContact O-CD2 3.17Å; I206-F210 PolarHBondContact O-N 2.98Å; N208-F210 VanDerWaalsContact C-N 3.3Å; N208-F210 PolarHBondContact O-N 2.97Å; F210-I218 HydrophobicContact CD2-CB 3.94Å; F210-I218 HydrophobicContact CD2-CD1 4.21Å; F210-I218 HydrophobicContact CD2-CG2 4.2Å; F210-I218 HydrophobicContact CE2-CB 3.74Å; F210-I218 HydrophobicContact CE2-CD1 3.78Å; F210-I218 HydrophobicContact CE2-CG1 4.38Å; F210-I218 HydrophobicContact CE2-CG2 3.54Å; F210-I218 HydrophobicContact CZ-CG2 3.88Å; F210-P220 HydrophobicContact CD1-CB 4.02Å; F210-P220 HydrophobicContact CD1-CG 3.62Å; F210-P220 HydrophobicContact CE1-CB 3.69Å; F210-P220 HydrophobicContact CE1-CG 3.78Å; F210-P220 HydrophobicContact CG-CG 4.39Å; F210-V223 HydrophobicContact CZ-CG2 4.25Å; F210-V247 HydrophobicContact CD1-CG1 3.84Å; F210-V247 HydrophobicContact CE1-CG1 3.68Å; F210-V247 HydrophobicContact CE2-CG1 4.38Å; F210-V247 HydrophobicContact CG-CG1 4.28Å; F210-V247 HydrophobicContact CG-CG2 4.49Å; F210-V247 HydrophobicContact CZ-CG1 3.98Å; F210-K250 HydrophobicContact CB-CD 4.25Å; F210-K250 HydrophobicContact CD1-CB 4.21Å; F210-K250 HydrophobicContact CD1-CD 4.06Å; F210-K250 PolarHBondContact O-NZ 3.37Å; F210-L251 HydrophobicContact CE1-CD2 3.77Å; F210-L251 HydrophobicContact CZ-CD2 4.04Å
211	R	93.1	Very high	94.1	Very high	145 Å²	145	43.4 Å²	43.4	55%	0.547	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-30.2	174	-163.7	-174.8	-67.1	111.9	-3.8	111.1	A207 N208 W209 T213	A207-R211 PolarHBondContact O-N 2.8Å; N208-R211 WeakPolarHBondContact O-CB 3.04Å; N208-R211 PolarHBondContact O-N 3.2Å; N208-R211 PolarHBondContact OD1-NH1 3Å; W209-R211 VanDerWaalsContact C-N 3.3Å; W209-R211 PolarHBondContact O-N 3.21Å; R211-T213 VanDerWaalsContact C-N 3.31Å; R211-T213 WeakPolarHBondContact CD-OG1 3.33Å; R211-T213 HydrophobicContact CG-CG2 3.83Å; R211-T213 PolarHBondContact O-N 3.06Å
212	G	87.4	Confident	94.1	Very high	20 Å²	20	47.1 Å²	47.1	21%	0.206	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	16.9	179	0	0	0	0	0	114.4	N208 W209 R217	N208-G212 PolarHBondContact O-N 3.4Å; W209-G212 PolarHBondContact O-N 3.44Å; G212-R217 PolarHBondContact O-NH1 3.29Å
213	T	80.5	Confident	94.2	Very high	99 Å²	99	46 Å²	46	61%	0.607	25%	0.253	S	S	*	.			trans	-100.5	21.6	-175.3	56.7	0	0	0	0	113.5	R211	R211-T213 VanDerWaalsContact C-N 3.31Å; R211-T213 WeakPolarHBondContact CD-OG1 3.33Å; R211-T213 HydrophobicContact CG-CG2 3.83Å; R211-T213 PolarHBondContact O-N 3.06Å
214	G	84.9	Confident	94.2	Very high	27 Å²	27	48.3 Å²	48.3	28%	0.278	27%	0.266	S	S	.	.	S	Bend	trans	-144.8	-164.6	-178.1	0	0	0	0	0	112.9	H216	G214-H216 VanDerWaalsContact C-N 3.27Å; G214-H216 PolarHBondContact O-N 3.45Å
215	E	90.8	Very high	94.4	Very high	158 Å²	158	46.5 Å²	46.5	74%	0.738	25%	0.248	S	C	*	.	S	Bend	trans	-66	-28.1	-178.7	-64	176.2	168.3	0	0	113.3	G192	G192-E215 VanDerWaalsContact CA-O 3.32Å; G192-E215 WeakPolarHBondContact CA-O 3.22Å
216	H	95.4	Very high	94.5	Very high	33 Å²	33	45.3 Å²	45.3	15%	0.153	24%	0.241	C	C	.	.			trans	-121.1	139.8	-175.4	-47.7	101.5	0	0	0	110.7	V186 G192 W209 G214	V186-H216 WeakPolarHBondContact CG1-CD2 3.43Å; V186-H216 WeakPolarHBondContact CG1-NE2 3.43Å; G192-H216 CarbonylContact O-C 3.56Å; G192-H216 WeakPolarHBondContact O-CA 3.25Å; W209-H216 HydrophobicContact CD2-CB 3.72Å; W209-H216 VanDerWaalsContact CE2-CB 3.44Å; W209-H216 AromaticContact CE2-CG 3.84Å; W209-H216 HydrophobicContact CE3-CB 4.38Å; W209-H216 HydrophobicContact CG-CB 3.92Å; W209-H216 HydrophobicContact CZ2-CB 3.89Å; W209-H216 AromaticContact CZ2-CG 3.85Å; W209-H216 AromaticContact NE1-CG 3.9Å; W209-H216 AromaticContact NE1-ND1 3.79Å; G214-H216 VanDerWaalsContact C-N 3.27Å; G214-H216 PolarHBondContact O-N 3.45Å
217	R	96.7	Very high	94.6	Very high	90 Å²	90	45.3 Å²	45.3	34%	0.34	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-140.7	138.7	-174.7	-45.8	-177.1	-175	-142	-2.6	110.3	N191 G192 Y193 V194 W209 G212	N191-R217 PolarHBondContact O-NE 3.39Å; G192-R217 PolarHBondContact O-N 3.48Å; Y193-R217 WeakPolarHBondContact CA-O 3.43Å; Y193-R217 HydrophobicContact CD1-CB 3.82Å; Y193-R217 HydrophobicContact CE1-CB 3.94Å; Y193-R217 HydrophobicContact CG-CB 4.35Å; V194-R217 PolarHBondContact N-O 2.93Å; W209-R217 WeakPolarHBondContact O-CA 3.09Å; G212-R217 PolarHBondContact O-NH1 3.29Å
218	I	97.8	Very high	94.7	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.041	23%	0.234	C	C	.	.			trans	-114.5	134.2	167.7	-68.8	169.5	0	0	0	107.5	C146 L149 V194 V199 W209 F210 P220 V223	C146-I218 HydrophobicContact CB-CD1 4.49Å; C146-I218 HydrophobicContact CB-CG1 4.2Å; C146-I218 HydrophobicContact CB-CG2 4.04Å; L149-I218 HydrophobicContact CD1-CD1 4.36Å; V194-I218 HydrophobicContact CB-CG1 4.3Å; V194-I218 HydrophobicContact CG2-CG1 4Å; V199-I218 HydrophobicContact CB-CD1 4.26Å; V199-I218 HydrophobicContact CG1-CD1 4.06Å; V199-I218 HydrophobicContact CG2-CD1 4.01Å; W209-I218 HydrophobicContact CB-CD1 4.32Å; W209-I218 HydrophobicContact CB-CG1 4.32Å; W209-I218 HydrophobicContact CE3-CD1 3.77Å; W209-I218 HydrophobicContact CE3-CG1 4.07Å; W209-I218 PolarHBondContact O-N 3.1Å; W209-I218 VanDerWaalsContact O-N 3.1Å; F210-I218 HydrophobicContact CD2-CB 3.94Å; F210-I218 HydrophobicContact CD2-CD1 4.21Å; F210-I218 HydrophobicContact CD2-CG2 4.2Å; F210-I218 HydrophobicContact CE2-CB 3.74Å; F210-I218 HydrophobicContact CE2-CD1 3.78Å; F210-I218 HydrophobicContact CE2-CG1 4.38Å; F210-I218 HydrophobicContact CE2-CG2 3.54Å; F210-I218 HydrophobicContact CZ-CG2 3.88Å; I218-P220 VanDerWaalsContact O-CD 3.24Å; I218-P220 WeakPolarHBondContact O-CD 3.39Å; I218-V223 HydrophobicContact CG2-CG2 4.02Å
219	D	96.5	Very high	94.7	Very high	46 Å²	46	41.6 Å²	41.6	25%	0.246	22%	0.218	C	C	.	.			trans	-81.3	108.7	168.7	-178.6	-9.5	0	0	0	109.4	Y193 S221 K222	Y193-D219 HydrophobicContact CD1-CB 4.36Å; Y193-D219 HydrophobicContact CE1-CB 4.18Å; D219-S221 VanDerWaalsContact CG-OG 3.24Å; D219-S221 PolarHBondContact O-N 2.82Å; D219-S221 WeakPolarHBondContact OD1-CB 3.24Å; D219-S221 PolarHBondContact OD1-N 3.28Å; D219-S221 PolarHBondContact OD1-OG 3.23Å; D219-S221 PolarHBondContact OD2-OG 2.91Å; D219-K222 HydrophobicContact CB-CD 3.99Å; D219-K222 HydrophobicContact CB-CG 4.2Å; D219-K222 PolarHBondContact O-N 2.69Å; D219-K222 WeakPolarHBondContact OD2-CE 3.28Å; D219-K222 IonicContact OD2-NZ 2.73Å
220	P	96.8	Very high	94.4	Very high	26 Å²	26	41.5 Å²	41.5	17%	0.169	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-63.6	-23.3	-176.4	-22.5	36.5	0	0	0	113.6	F210 I218 K222 V223 K250	F210-P220 HydrophobicContact CD1-CB 4.02Å; F210-P220 HydrophobicContact CD1-CG 3.62Å; F210-P220 HydrophobicContact CE1-CB 3.69Å; F210-P220 HydrophobicContact CE1-CG 3.78Å; F210-P220 HydrophobicContact CG-CG 4.39Å; I218-P220 VanDerWaalsContact O-CD 3.24Å; I218-P220 WeakPolarHBondContact O-CD 3.39Å; P220-K222 PolarHBondContact O-N 2.99Å; P220-V223 PolarHBondContact O-N 3.3Å; P220-K250 HydrophobicContact CB-CB 4.02Å; P220-K250 VanDerWaalsContact CB-O 3.24Å; P220-K250 WeakPolarHBondContact CB-O 3.39Å; P220-K250 HydrophobicContact CG-CB 4.15Å
221	S	96	Very high	94.2	Very high	81 Å²	81	41 Å²	41	57%	0.566	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-70.3	-18.7	-178.2	71.8	0	0	0	0	113.1	D219	D219-S221 VanDerWaalsContact CG-OG 3.24Å; D219-S221 PolarHBondContact O-N 2.82Å; D219-S221 WeakPolarHBondContact OD1-CB 3.24Å; D219-S221 PolarHBondContact OD1-N 3.28Å; D219-S221 PolarHBondContact OD1-OG 3.23Å; D219-S221 PolarHBondContact OD2-OG 2.91Å
222	K	96.8	Very high	93.9	Very high	77 Å²	77	34.5 Å²	34.5	34%	0.335	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-96	-9.8	-176.9	-64.9	-177.3	179.7	173.4	0	114	Y145 D219 P220 V224	Y145-K222 HydrophobicContact CD1-CD 3.6Å; Y145-K222 HydrophobicContact CD2-CB 3.64Å; Y145-K222 HydrophobicContact CD2-CD 3.67Å; Y145-K222 HydrophobicContact CD2-CG 4.15Å; Y145-K222 HydrophobicContact CE1-CD 3.8Å; Y145-K222 HydrophobicContact CE2-CB 3.65Å; Y145-K222 HydrophobicContact CE2-CD 3.95Å; Y145-K222 HydrophobicContact CE2-CG 4.08Å; Y145-K222 HydrophobicContact CG-CB 4.36Å; Y145-K222 HydrophobicContact CG-CD 3.52Å; Y145-K222 HydrophobicContact CG-CG 4.48Å; D219-K222 HydrophobicContact CB-CD 3.99Å; D219-K222 HydrophobicContact CB-CG 4.2Å; D219-K222 PolarHBondContact O-N 2.69Å; D219-K222 WeakPolarHBondContact OD2-CE 3.28Å; D219-K222 IonicContact OD2-NZ 2.73Å; P220-K222 PolarHBondContact O-N 2.99Å; K222-V224 PolarHBondContact O-N 3.19Å
223	V	97.8	Very high	94	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.			trans	-77.9	119.3	178.2	-179.2	0	0	0	0	109.1	Q147 L149 F210 I218 P220 M225 L251	Q147-V223 CarbonylContact O-C 3.47Å; Q147-V223 WeakPolarHBondContact O-CA 3.21Å; L149-V223 HydrophobicContact CB-CG1 4.08Å; F210-V223 HydrophobicContact CZ-CG2 4.25Å; I218-V223 HydrophobicContact CG2-CG2 4.02Å; P220-V223 PolarHBondContact O-N 3.3Å; V223-M225 VanDerWaalsContact CG1-O 3.31Å; V223-M225 WeakPolarHBondContact CG1-O 3.36Å; V223-L251 HydrophobicContact CB-CD2 3.78Å; V223-L251 HydrophobicContact CG1-CD2 3.88Å; V223-L251 HydrophobicContact CG2-CD2 4.26Å
224	V	97.4	Very high	94.5	Very high	47 Å²	47	29 Å²	29	29%	0.285	15%	0.154	S	C	.	.			trans	-99.7	-20.4	-178.9	-59.3	0	0	0	0	113	Q147 K222 Q256	Q147-V224 HydrophobicContact CB-CG2 4.33Å; Q147-V224 WeakPolarHBondContact O-CG2 3.46Å; Q147-V224 PolarHBondContact O-N 2.6Å; K222-V224 PolarHBondContact O-N 3.19Å; V224-Q256 PolarHBondContact O-N 3.18Å
225	M	98.2	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	135.2	176.3	-176.6	-174.3	-77.8	0	0	111	A134 M135 R138 Q147 C148 L149 V223 V227 Q256 L258	A134-M225 HydrophobicContact CB-CE 3.71Å; A134-M225 HydrophobicContact CB-SD 4.34Å; M135-M225 HydrophobicContact CB-SD 4.3Å; M135-M225 HydrophobicContact CG-SD 3.47Å; M135-M225 WeakPolarHBondContact CG-SD 3.45Å; R138-M225 HydrophobicContact CG-CE 4.21Å; Q147-M225 PolarHBondContact O-N 3.33Å; C148-M225 WeakPolarHBondContact CA-O 3.45Å; L149-M225 PolarHBondContact N-O 3.19Å; V223-M225 VanDerWaalsContact CG1-O 3.31Å; V223-M225 WeakPolarHBondContact CG1-O 3.36Å; M225-V227 HydrophobicContact CG-CG2 4.18Å; M225-V227 HydrophobicContact SD-CG2 4.15Å; M225-Q256 CarbonylContact C-O 3.25Å; M225-Q256 WeakPolarHBondContact CA-O 3.49Å; M225-L258 HydrophobicContact CE-CD1 4.24Å; M225-L258 HydrophobicContact CG-CD1 4.48Å; M225-L258 HydrophobicContact SD-CD1 4.01Å
226	F	98.4	Very high	94.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.8	174.1	178.1	-147.7	0	0	0	110.9	L149 M151 V247 K248 L251 Q256 I257 L258 F275	L149-F226 HydrophobicContact CB-CD2 4.07Å; L149-F226 HydrophobicContact CD2-CD2 3.7Å; L149-F226 HydrophobicContact CD2-CE2 3.83Å; L149-F226 HydrophobicContact CD2-CG 4.47Å; L149-F226 HydrophobicContact CG-CD2 3.89Å; L149-F226 HydrophobicContact CG-CE2 4.15Å; L149-F226 CarbonylContact O-C 3.58Å; L149-F226 WeakPolarHBondContact O-CA 3.45Å; M151-F226 HydrophobicContact CB-CE2 4.22Å; M151-F226 HydrophobicContact CE-CE2 4.06Å; M151-F226 HydrophobicContact CE-CZ 3.89Å; M151-F226 HydrophobicContact CG-CE2 3.85Å; M151-F226 HydrophobicContact CG-CZ 4.27Å; M151-F226 HydrophobicContact SD-CE2 3.86Å; M151-F226 HydrophobicContact SD-CZ 3.65Å; F226-V247 HydrophobicContact CE1-CG1 4.5Å; F226-V247 HydrophobicContact CZ-CG1 4.34Å; F226-K248 HydrophobicContact CE1-CB 4.22Å; F226-L251 HydrophobicContact CB-CD1 3.61Å; F226-L251 HydrophobicContact CD1-CD1 3.36Å; F226-L251 HydrophobicContact CE1-CD1 4.19Å; F226-L251 HydrophobicContact CG-CD1 3.71Å; F226-Q256 PolarHBondContact N-O 3.05Å; F226-I257 WeakPolarHBondContact O-CA 3.4Å; F226-L258 PolarHBondContact O-N 2.77Å; F226-F275 HydrophobicContact CD1-CE1 4.49Å; F226-F275 HydrophobicContact CD1-CZ 4.09Å; F226-F275 HydrophobicContact CE1-CE1 4.13Å; F226-F275 HydrophobicContact CE1-CE2 4.19Å; F226-F275 AromaticContact CE1-CZ 3.34Å; F226-F275 HydrophobicContact CE1-CZ 3.34Å; F226-F275 AromaticContact CZ-CZ 3.84Å; F226-F275 HydrophobicContact CZ-CZ 3.84Å
227	V	98.4	Very high	93.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	132.4	-179.8	-179.7	0	0	0	0	110.1	F131 M135 L149 C150 M151 M225 L258 F260	F131-V227 HydrophobicContact CB-CG1 4.18Å; F131-V227 HydrophobicContact CB-CG2 4.13Å; F131-V227 HydrophobicContact CD1-CG1 3.93Å; F131-V227 HydrophobicContact CD2-CG1 4.06Å; F131-V227 HydrophobicContact CD2-CG2 4.42Å; F131-V227 HydrophobicContact CE1-CG1 4.24Å; F131-V227 HydrophobicContact CE2-CG1 4.42Å; F131-V227 HydrophobicContact CG-CG1 3.83Å; F131-V227 HydrophobicContact CG-CG2 4.43Å; M135-V227 HydrophobicContact CE-CB 3.64Å; M135-V227 HydrophobicContact CE-CG2 3.23Å; L149-V227 PolarHBondContact O-N 3.27Å; C150-V227 CarbonylContact C-O 3.54Å; C150-V227 WeakPolarHBondContact CA-O 3.35Å; C150-V227 HydrophobicContact CB-CB 4.41Å; M151-V227 PolarHBondContact N-O 2.9Å; M225-V227 HydrophobicContact CG-CG2 4.18Å; M225-V227 HydrophobicContact SD-CG2 4.15Å; V227-L258 CarbonylContact C-O 3.51Å; V227-L258 WeakPolarHBondContact CA-O 3.37Å; V227-L258 HydrophobicContact CG2-CB 4.1Å; V227-L258 HydrophobicContact CG2-CD1 3.99Å; V227-L258 HydrophobicContact CG2-CG 4.23Å; V227-F260 HydrophobicContact CG1-CD2 3.87Å; V227-F260 HydrophobicContact CG1-CE2 3.94Å
228	L	97.4	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	108.4	167.1	-167.8	71.4	0	0	0	108.6	M151 A231 M234 C244 L258 L259 F260 F271 F275	M151-L228 HydrophobicContact CB-CD1 3.78Å; M151-L228 HydrophobicContact SD-CD1 4.38Å; L228-A231 HydrophobicContact CD2-CB 4.3Å; L228-M234 HydrophobicContact CD1-CE 3.72Å; L228-M234 HydrophobicContact CD1-CG 4.33Å; L228-C244 HydrophobicContact CD1-CB 4.26Å; L228-C244 VanDerWaalsContact CD1-SG 3.59Å; L228-L258 PolarHBondContact N-O 3.47Å; L228-L259 HydrophobicContact CB-CG 4.46Å; L228-L259 HydrophobicContact CD2-CD1 3.93Å; L228-L259 HydrophobicContact CD2-CG 4.35Å; L228-L259 WeakPolarHBondContact O-CA 3.25Å; L228-F260 PolarHBondContact O-N 2.95Å; L228-F271 HydrophobicContact CD2-CE1 3.47Å; L228-F271 VanDerWaalsContact CD2-CE1 3.47Å; L228-F271 HydrophobicContact CD2-CZ 3.74Å; L228-F275 HydrophobicContact CB-CE1 3.88Å; L228-F275 HydrophobicContact CB-CZ 4.2Å; L228-F275 HydrophobicContact CD2-CD1 4.22Å; L228-F275 HydrophobicContact CD2-CE1 3.94Å; L228-F275 HydrophobicContact CD2-CE2 4.31Å; L228-F275 HydrophobicContact CD2-CG 4.49Å; L228-F275 HydrophobicContact CD2-CZ 3.95Å; L228-F275 HydrophobicContact CG-CE1 4.49Å; L228-F275 HydrophobicContact CG-CZ 4.49Å
229	D	95.1	Very high	93	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.			trans	-95.9	150.3	177.7	-163.9	28.8	0	0	0	110.7	K46 F131 M151 I161 A231	K46-D229 IonicContact NZ-OD2 2.89Å; K46-D229 PolarHBondContact NZ-OD2 2.64Å; F131-D229 HydrophobicContact CE1-CB 4.17Å; F131-D229 HydrophobicContact CZ-CB 4.41Å; M151-D229 PolarHBondContact O-N 3.33Å; I161-D229 HydrophobicContact CD1-CB 4.26Å; I161-D229 WeakPolarHBondContact CD1-OD2 3.44Å; D229-A231 PolarHBondContact O-N 3.24Å
230	E	90.4	Very high	92.9	Very high	3 Å²	3	35 Å²	35	1%	0.014	19%	0.186	C	C	.	.			trans	53.4	50.6	179.8	-51.1	-72.2	176.5	0	0	113.2	S42 K46 P153 L157 D232 I233 M234 F260	S42-E230 PolarHBondContact OG-OE1 3.32Å; S42-E230 PolarHBondContact OG-OE2 3.13Å; K46-E230 WeakPolarHBondContact CE-OE1 3.33Å; K46-E230 IonicContact NZ-OE1 3.89Å; K46-E230 PolarHBondContact NZ-OE1 3.16Å; P153-E230 HydrophobicContact CG-CB 3.97Å; L157-E230 HydrophobicContact CD1-CG 4.33Å; E230-D232 PolarHBondContact O-N 3.48Å; E230-I233 HydrophobicContact CB-CB 4.18Å; E230-I233 HydrophobicContact CB-CD1 3.9Å; E230-I233 HydrophobicContact CB-CG1 4.12Å; E230-I233 HydrophobicContact CG-CD1 4.23Å; E230-I233 PolarHBondContact O-N 3.49Å; E230-M234 PolarHBondContact O-N 3.01Å; E230-F260 PolarHBondContact N-O 3.15Å; E230-F260 VanDerWaalsContact N-O 3.08Å
231	A	92.2	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-28.9	-174.9	0	0	0	0	0	113.5	L228 D229 I233 M234 I235 L259 F260 F271	L228-A231 HydrophobicContact CD2-CB 4.3Å; D229-A231 PolarHBondContact O-N 3.24Å; A231-I233 VanDerWaalsContact C-N 3.32Å; A231-I233 PolarHBondContact O-N 3.19Å; A231-M234 WeakPolarHBondContact O-CB 3.12Å; A231-M234 PolarHBondContact O-N 3.27Å; A231-I235 WeakPolarHBondContact O-CD1 3.45Å; A231-I235 VanDerWaalsContact O-CG1 3.24Å; A231-I235 WeakPolarHBondContact O-CG1 3.46Å; A231-I235 PolarHBondContact O-N 3.03Å; A231-I235 VanDerWaalsContact O-N 3.13Å; A231-L259 HydrophobicContact CB-CD1 4.11Å; A231-L259 HydrophobicContact CB-CD2 3.69Å; A231-L259 HydrophobicContact CB-CG 3.86Å; A231-F260 PolarHBondContact N-O 3.48Å; A231-F271 HydrophobicContact CB-CE1 4.49Å
232	D	87.6	Confident	92.5	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-39.7	172.2	47.6	-51.5	0	0	0	112.6	E230 S261 A262 T263 V268	E230-D232 PolarHBondContact O-N 3.48Å; D232-S261 VanDerWaalsContact CB-OG 3.25Å; D232-S261 WeakPolarHBondContact CB-OG 3.45Å; D232-S261 PolarHBondContact N-OG 2.83Å; D232-S261 WeakPolarHBondContact OD1-CA 3.45Å; D232-S261 VanDerWaalsContact OD1-CB 3.28Å; D232-S261 WeakPolarHBondContact OD1-CB 3.27Å; D232-S261 PolarHBondContact OD1-OG 3.41Å; D232-A262 PolarHBondContact OD1-N 3.02Å; D232-A262 VanDerWaalsContact OD1-N 3.14Å; D232-T263 HydrophobicContact CB-CG2 4.35Å; D232-T263 WeakPolarHBondContact CB-OG1 3.36Å; D232-V268 HydrophobicContact CB-CG2 4.09Å
233	I	88.7	Confident	92.4	Very high	4 Å²	4	35 Å²	35	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-76.9	-35.5	176.2	-53.1	-179.8	0	0	0	110.4	R38 A39 S42 P153 E230 A231 I235 E236	R38-I233 HydrophobicContact CB-CD1 4.4Å; R38-I233 HydrophobicContact CB-CG1 4.09Å; R38-I233 WeakPolarHBondContact O-CD1 3.24Å; A39-I233 HydrophobicContact CB-CG2 3.85Å; S42-I233 VanDerWaalsContact CB-CD1 3.43Å; P153-I233 HydrophobicContact CB-CB 4.36Å; P153-I233 HydrophobicContact CB-CG2 3.84Å; P153-I233 HydrophobicContact CG-CB 3.97Å; P153-I233 HydrophobicContact CG-CG2 3.72Å; E230-I233 HydrophobicContact CB-CB 4.18Å; E230-I233 HydrophobicContact CB-CD1 3.9Å; E230-I233 HydrophobicContact CB-CG1 4.12Å; E230-I233 HydrophobicContact CG-CD1 4.23Å; E230-I233 PolarHBondContact O-N 3.49Å; A231-I233 VanDerWaalsContact C-N 3.32Å; A231-I233 PolarHBondContact O-N 3.19Å; I233-I235 PolarHBondContact O-N 3.36Å; I233-E236 PolarHBondContact O-N 3.13Å
234	M	90.6	Very high	92.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-28	176	-70.3	-74.4	-158.8	0	0	113.2	M151 P153 P203 L228 E230 A231 F240 L241	M151-M234 HydrophobicContact CB-CE 3.84Å; P153-M234 HydrophobicContact CB-CE 4.33Å; P153-M234 HydrophobicContact CB-CG 4.24Å; P153-M234 HydrophobicContact CB-SD 3.76Å; P203-M234 HydrophobicContact CG-CE 3.68Å; P203-M234 HydrophobicContact CG-SD 3.65Å; L228-M234 HydrophobicContact CD1-CE 3.72Å; L228-M234 HydrophobicContact CD1-CG 4.33Å; E230-M234 PolarHBondContact O-N 3.01Å; A231-M234 WeakPolarHBondContact O-CB 3.12Å; A231-M234 PolarHBondContact O-N 3.27Å; M234-F240 WeakPolarHBondContact O-CB 3.32Å; M234-F240 HydrophobicContact SD-CB 4.47Å; M234-F240 HydrophobicContact SD-CD2 3.68Å; M234-F240 HydrophobicContact SD-CE2 4.44Å; M234-L241 HydrophobicContact CB-CD2 4.2Å
235	I	88.2	Confident	92.3	Very high	42 Å²	42	33.9 Å²	33.9	22%	0.215	17%	0.173	C	C	.	.	H	α-helix	trans	-75	-29	-179.2	-71.7	160.9	0	0	0	112	A231 I233 E237 L241 V268 F271	A231-I235 WeakPolarHBondContact O-CD1 3.45Å; A231-I235 VanDerWaalsContact O-CG1 3.24Å; A231-I235 WeakPolarHBondContact O-CG1 3.46Å; A231-I235 PolarHBondContact O-N 3.03Å; A231-I235 VanDerWaalsContact O-N 3.13Å; I233-I235 PolarHBondContact O-N 3.36Å; I235-E237 VanDerWaalsContact C-N 3.33Å; I235-L241 HydrophobicContact CB-CD1 4.22Å; I235-L241 HydrophobicContact CB-CD2 4.35Å; I235-L241 HydrophobicContact CG1-CD1 3.68Å; I235-L241 HydrophobicContact CG1-CD2 3.52Å; I235-L241 HydrophobicContact CG1-CG 4.12Å; I235-L241 HydrophobicContact CG2-CD1 4.31Å; I235-V268 HydrophobicContact CD1-CB 3.83Å; I235-V268 HydrophobicContact CD1-CG1 4.01Å; I235-V268 HydrophobicContact CD1-CG2 3.62Å; I235-F271 HydrophobicContact CD1-CB 4.14Å; I235-F271 HydrophobicContact CD1-CD1 4.12Å; I235-F271 HydrophobicContact CD1-CG 4.38Å; I235-F271 HydrophobicContact CG1-CD1 4.32Å; I235-F271 HydrophobicContact CG1-CG 4.49Å
236	E	84.3	Confident	92.2	Very high	97 Å²	97	41.5 Å²	41.5	45%	0.453	20%	0.202	S	C	.	.	H	α-helix	trans	-73.2	-27.7	179.3	-61	-176.6	164.5	0	0	112.6	R38 I233	R38-E236 WeakPolarHBondContact CD-OE1 3.49Å; R38-E236 WeakPolarHBondContact CG-OE2 3.46Å; R38-E236 IonicContact CZ-OE1 3.08Å; R38-E236 IonicContact NE-OE1 2.81Å; R38-E236 PolarHBondContact NE-OE1 3.1Å; R38-E236 IonicContact NH1-OE1 3.78Å; R38-E236 PolarHBondContact NH1-OE1 3.16Å; I233-E236 PolarHBondContact O-N 3.13Å
237	E	86.5	Confident	92.1	Very high	85 Å²	85	41.6 Å²	41.6	40%	0.397	20%	0.202	S	C	.	.	S	Bend	trans	-84	117.9	-177.6	-70.9	-67.9	161.2	0	0	111.7	I235 G239 F240	I235-E237 VanDerWaalsContact C-N 3.33Å; E237-G239 PolarHBondContact O-N 3.09Å; E237-G239 VanDerWaalsContact O-N 3.17Å; E237-F240 HydrophobicContact CB-CB 4.06Å; E237-F240 HydrophobicContact CB-CD1 3.94Å; E237-F240 HydrophobicContact CB-CD2 3.35Å; E237-F240 HydrophobicContact CB-CE1 4.2Å; E237-F240 HydrophobicContact CB-CE2 3.63Å; E237-F240 HydrophobicContact CB-CG 3.53Å; E237-F240 HydrophobicContact CB-CZ 4.05Å; E237-F240 HydrophobicContact CG-CD2 3.89Å; E237-F240 HydrophobicContact CG-CE2 3.73Å; E237-F240 HydrophobicContact CG-CZ 4.24Å; E237-F240 WeakPolarHBondContact O-CB 3.28Å; E237-F240 PolarHBondContact O-N 2.83Å; E237-F240 VanDerWaalsContact O-N 3.13Å
238	E	85.9	Confident	92	Very high	193 Å²	193	43.5 Å²	43.5	90%	0.902	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	122.8	-174.9	-166.5	-175.9	168.9	0	0	111.7	F240	E238-F240 VanDerWaalsContact C-N 3.3Å; E238-F240 PolarHBondContact O-N 3.47Å
239	G	90.2	Very high	92	Very high	31 Å²	31	51.5 Å²	51.5	32%	0.32	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-6.9	176.4	0	0	0	0	0	115.5	E237 L241 N242 I243	E237-G239 PolarHBondContact O-N 3.09Å; E237-G239 VanDerWaalsContact O-N 3.17Å; G239-L241 PolarHBondContact O-N 3Å; G239-N242 PolarHBondContact O-N 3.49Å; G239-I243 VanDerWaalsContact O-CG1 3.28Å; G239-I243 WeakPolarHBondContact O-CG1 3.44Å; G239-I243 PolarHBondContact O-N 3.13Å
240	F	93.1	Very high	92	Very high	39 Å²	39	56.1 Å²	56.1	17%	0.171	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-45.8	179.7	-85	23	0	0	0	112	P153 P203 M234 E237 E238 N242 I243 C244	P153-F240 HydrophobicContact CB-CE2 4.46Å; P153-F240 VanDerWaalsContact O-CE2 3.31Å; P153-F240 WeakPolarHBondContact O-CE2 3.37Å; P203-F240 HydrophobicContact CB-CG 4.38Å; P203-F240 HydrophobicContact CG-CB 4.47Å; P203-F240 HydrophobicContact CG-CD2 3.85Å; P203-F240 HydrophobicContact CG-CE2 4.24Å; P203-F240 HydrophobicContact CG-CG 4.07Å; M234-F240 WeakPolarHBondContact O-CB 3.32Å; M234-F240 HydrophobicContact SD-CB 4.47Å; M234-F240 HydrophobicContact SD-CD2 3.68Å; M234-F240 HydrophobicContact SD-CE2 4.44Å; E237-F240 HydrophobicContact CB-CB 4.06Å; E237-F240 HydrophobicContact CB-CD1 3.94Å; E237-F240 HydrophobicContact CB-CD2 3.35Å; E237-F240 HydrophobicContact CB-CE1 4.2Å; E237-F240 HydrophobicContact CB-CE2 3.63Å; E237-F240 HydrophobicContact CB-CG 3.53Å; E237-F240 HydrophobicContact CB-CZ 4.05Å; E237-F240 HydrophobicContact CG-CD2 3.89Å; E237-F240 HydrophobicContact CG-CE2 3.73Å; E237-F240 HydrophobicContact CG-CZ 4.24Å; E237-F240 WeakPolarHBondContact O-CB 3.28Å; E237-F240 PolarHBondContact O-N 2.83Å; E237-F240 VanDerWaalsContact O-N 3.13Å; E238-F240 VanDerWaalsContact C-N 3.3Å; E238-F240 PolarHBondContact O-N 3.47Å; F240-N242 VanDerWaalsContact C-N 3.32Å; F240-N242 PolarHBondContact O-N 3Å; F240-I243 CarbonylContact O-C 3.58Å; F240-I243 WeakPolarHBondContact O-CA 3.5Å; F240-I243 WeakPolarHBondContact O-CB 3.31Å; F240-I243 PolarHBondContact O-N 3.24Å; F240-C244 PolarHBondContact O-N 2.73Å; F240-C244 PolarHBondContact O-SG 3.35Å
241	L	91	Very high	92.3	Very high	43 Å²	43	57 Å²	57	23%	0.225	27%	0.27	C	S	.	.	H	α-helix	trans	-58	-44	177.1	-52.6	-178.9	0	0	0	112.5	M234 I235 G239 I243 C244 M245 F271	M234-L241 HydrophobicContact CB-CD2 4.2Å; I235-L241 HydrophobicContact CB-CD1 4.22Å; I235-L241 HydrophobicContact CB-CD2 4.35Å; I235-L241 HydrophobicContact CG1-CD1 3.68Å; I235-L241 HydrophobicContact CG1-CD2 3.52Å; I235-L241 HydrophobicContact CG1-CG 4.12Å; I235-L241 HydrophobicContact CG2-CD1 4.31Å; G239-L241 PolarHBondContact O-N 3Å; L241-I243 VanDerWaalsContact C-N 3.26Å; L241-I243 PolarHBondContact O-N 2.98Å; L241-C244 PolarHBondContact O-N 3.22Å; L241-M245 WeakPolarHBondContact O-CB 3.13Å; L241-M245 WeakPolarHBondContact O-CG 3.47Å; L241-M245 PolarHBondContact O-N 3.44Å; L241-F271 HydrophobicContact CB-CD2 4.18Å; L241-F271 HydrophobicContact CB-CE2 3.79Å; L241-F271 HydrophobicContact CB-CZ 4.38Å; L241-F271 HydrophobicContact CD1-CD2 4.06Å; L241-F271 HydrophobicContact CD1-CE2 4.44Å; L241-F271 HydrophobicContact CD1-CG 4.36Å; L241-F271 HydrophobicContact CD2-CD1 4Å; L241-F271 HydrophobicContact CD2-CD2 3.94Å; L241-F271 HydrophobicContact CD2-CE1 3.72Å; L241-F271 HydrophobicContact CD2-CE2 3.66Å; L241-F271 HydrophobicContact CD2-CG 4.1Å; L241-F271 HydrophobicContact CD2-CZ 3.54Å; L241-F271 HydrophobicContact CG-CD2 4.27Å; L241-F271 HydrophobicContact CG-CE2 4.15Å; L241-F271 HydrophobicContact CG-CZ 4.49Å
242	N	94	Very high	92.5	Very high	103 Å²	103	59.2 Å²	59.2	55%	0.551	29%	0.286	S	S	*	.	H	α-helix	trans	-60.9	-38.5	176.3	-77	-36.8	0	0	0	111.6	G239 F240 R246	G239-N242 PolarHBondContact O-N 3.49Å; F240-N242 VanDerWaalsContact C-N 3.32Å; F240-N242 PolarHBondContact O-N 3Å; N242-R246 VanDerWaalsContact O-CG 3.22Å; N242-R246 WeakPolarHBondContact O-CG 3.45Å; N242-R246 PolarHBondContact O-N 3.39Å; N242-R246 VanDerWaalsContact O-N 3.11Å
243	I	96	Very high	92.7	Very high	38 Å²	38	71 Å²	71	20%	0.195	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-49.4	176.2	-67.9	166.2	0	0	0	110.6	P203 A207 G239 F240 L241 M245 R246 V247	P203-I243 HydrophobicContact CB-CB 4.25Å; P203-I243 HydrophobicContact CB-CG2 3.79Å; P203-I243 VanDerWaalsContact O-CG2 3.32Å; P203-I243 WeakPolarHBondContact O-CG2 3.33Å; A207-I243 HydrophobicContact CB-CG2 3.42Å; A207-I243 VanDerWaalsContact CB-CG2 3.42Å; G239-I243 VanDerWaalsContact O-CG1 3.28Å; G239-I243 WeakPolarHBondContact O-CG1 3.44Å; G239-I243 PolarHBondContact O-N 3.13Å; F240-I243 CarbonylContact O-C 3.58Å; F240-I243 WeakPolarHBondContact O-CA 3.5Å; F240-I243 WeakPolarHBondContact O-CB 3.31Å; F240-I243 PolarHBondContact O-N 3.24Å; L241-I243 VanDerWaalsContact C-N 3.26Å; L241-I243 PolarHBondContact O-N 2.98Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 3.34Å; I243-R246 PolarHBondContact O-N 3.04Å; I243-R246 VanDerWaalsContact O-N 3.14Å; I243-V247 PolarHBondContact O-N 2.85Å
244	C	96.6	Very high	92.9	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-56.6	-44.8	177.9	-64.4	0	0	0	0	111.1	M151 L228 F240 L241 R246 V247 K248 F275	M151-C244 HydrophobicContact SD-CB 4.32Å; L228-C244 HydrophobicContact CD1-CB 4.26Å; L228-C244 VanDerWaalsContact CD1-SG 3.59Å; F240-C244 PolarHBondContact O-N 2.73Å; F240-C244 PolarHBondContact O-SG 3.35Å; L241-C244 PolarHBondContact O-N 3.22Å; C244-R246 PolarHBondContact O-N 2.67Å; C244-V247 PolarHBondContact O-N 2.72Å; C244-K248 WeakPolarHBondContact O-CB 3.41Å; C244-K248 PolarHBondContact O-N 3.46Å; C244-F275 HydrophobicContact CB-CE2 3.8Å; C244-F275 HydrophobicContact CB-CZ 4.37Å
245	M	95.8	Very high	93.2	Very high	24 Å²	24	77.9 Å²	77.9	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-39.5	176.6	-77	-65.7	-80.7	0	0	113.1	L241 I243 V247 K248 K249 F271 E274 F275	L241-M245 WeakPolarHBondContact O-CB 3.13Å; L241-M245 WeakPolarHBondContact O-CG 3.47Å; L241-M245 PolarHBondContact O-N 3.44Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 3.34Å; M245-V247 VanDerWaalsContact C-N 3.35Å; M245-K248 PolarHBondContact O-N 3.06Å; M245-K248 HydrophobicContact SD-CD 4.18Å; M245-K249 VanDerWaalsContact O-CG 3.3Å; M245-K249 WeakPolarHBondContact O-CG 3.34Å; M245-K249 PolarHBondContact O-N 3.32Å; M245-F271 HydrophobicContact CG-CE2 4.26Å; M245-E274 HydrophobicContact CE-CG 3.87Å; M245-E274 VanDerWaalsContact CE-OE1 3.23Å; M245-E274 WeakPolarHBondContact CE-OE1 3.26Å; M245-F275 HydrophobicContact CG-CD2 4.29Å; M245-F275 HydrophobicContact SD-CD2 3.6Å; M245-F275 HydrophobicContact SD-CE2 4.34Å; M245-F275 HydrophobicContact SD-CG 4.48Å
246	R	95.7	Very high	93.6	Very high	161 Å²	161	76 Å²	76	61%	0.608	36%	0.357	S	S	*	.	H	α-helix	trans	-66.2	-37.3	175.2	-73	171.1	-162	175.4	5.5	112.2	N242 I243 C244	N242-R246 VanDerWaalsContact O-CG 3.22Å; N242-R246 WeakPolarHBondContact O-CG 3.45Å; N242-R246 PolarHBondContact O-N 3.39Å; N242-R246 VanDerWaalsContact O-N 3.11Å; I243-R246 PolarHBondContact O-N 3.04Å; I243-R246 VanDerWaalsContact O-N 3.14Å; C244-R246 PolarHBondContact O-N 2.67Å
247	V	96.6	Very high	94.3	Very high	2 Å²	2	72 Å²	72	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-67.8	-48.1	175.2	171	0	0	0	0	110.3	L149 M151 I206 A207 F210 F226 I243 C244 M245 K249 K250	L149-V247 HydrophobicContact CD2-CG1 4.06Å; M151-V247 HydrophobicContact CE-CB 3.68Å; M151-V247 HydrophobicContact CE-CG1 3.57Å; M151-V247 HydrophobicContact CE-CG2 3.66Å; I206-V247 HydrophobicContact CG2-CG1 4.42Å; A207-V247 HydrophobicContact CB-CG2 4Å; F210-V247 HydrophobicContact CD1-CG1 3.84Å; F210-V247 HydrophobicContact CE1-CG1 3.68Å; F210-V247 HydrophobicContact CE2-CG1 4.38Å; F210-V247 HydrophobicContact CG-CG1 4.28Å; F210-V247 HydrophobicContact CG-CG2 4.49Å; F210-V247 HydrophobicContact CZ-CG1 3.98Å; F226-V247 HydrophobicContact CE1-CG1 4.5Å; F226-V247 HydrophobicContact CZ-CG1 4.34Å; I243-V247 PolarHBondContact O-N 2.85Å; C244-V247 PolarHBondContact O-N 2.72Å; M245-V247 VanDerWaalsContact C-N 3.35Å; V247-K249 VanDerWaalsContact C-N 3.27Å; V247-K249 PolarHBondContact O-N 3.5Å; V247-K250 WeakPolarHBondContact O-CB 3.45Å; V247-K250 PolarHBondContact O-N 3.37Å
248	K	96.6	Very high	94.8	Very high	40 Å²	40	68 Å²	68	17%	0.174	32%	0.32	C	S	.	.	H	α-helix	trans	-50	-46.9	173.7	176.5	-172.4	165.8	-171.2	0	111.9	F226 C244 M245 K250 L251 I257 E274 F275	F226-K248 HydrophobicContact CE1-CB 4.22Å; C244-K248 WeakPolarHBondContact O-CB 3.41Å; C244-K248 PolarHBondContact O-N 3.46Å; M245-K248 PolarHBondContact O-N 3.06Å; M245-K248 HydrophobicContact SD-CD 4.18Å; K248-K250 PolarHBondContact O-N 3.48Å; K248-K250 VanDerWaalsContact O-N 3.12Å; K248-L251 WeakPolarHBondContact O-CB 3.42Å; K248-L251 PolarHBondContact O-N 2.94Å; K248-L251 VanDerWaalsContact O-N 3.07Å; K248-I257 HydrophobicContact CD-CD1 4.11Å; K248-I257 HydrophobicContact CG-CD1 3.91Å; K248-E274 PolarHBondContact NZ-O 2.84Å; K248-F275 HydrophobicContact CB-CE2 4.13Å; K248-F275 HydrophobicContact CB-CZ 4.48Å; K248-F275 HydrophobicContact CD-CD2 4.12Å; K248-F275 HydrophobicContact CD-CE2 4.23Å; K248-F275 HydrophobicContact CD-CG 4.44Å; K248-F275 VanDerWaalsContact CD-O 3.24Å; K248-F275 WeakPolarHBondContact CD-O 3.11Å; K248-F275 WeakPolarHBondContact CE-O 3.27Å; K248-F275 PolarHBondContact NZ-O 2.98Å
249	K	96.2	Very high	95.4	Very high	167 Å²	167	58.8 Å²	58.8	73%	0.726	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-19.9	-179.8	-77.4	175.8	-178.5	-179.4	0	114.7	M245 V247	M245-K249 VanDerWaalsContact O-CG 3.3Å; M245-K249 WeakPolarHBondContact O-CG 3.34Å; M245-K249 PolarHBondContact O-N 3.32Å; V247-K249 VanDerWaalsContact C-N 3.27Å; V247-K249 PolarHBondContact O-N 3.5Å
250	K	96.4	Very high	95.5	Very high	98 Å²	98	57.3 Å²	57.3	43%	0.426	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-15.9	177.6	-69.7	179.1	170	-172.7	0	113.5	F210 P220 V247 K248	F210-K250 HydrophobicContact CB-CD 4.25Å; F210-K250 HydrophobicContact CD1-CB 4.21Å; F210-K250 HydrophobicContact CD1-CD 4.06Å; F210-K250 PolarHBondContact O-NZ 3.37Å; P220-K250 HydrophobicContact CB-CB 4.02Å; P220-K250 VanDerWaalsContact CB-O 3.24Å; P220-K250 WeakPolarHBondContact CB-O 3.39Å; P220-K250 HydrophobicContact CG-CB 4.15Å; V247-K250 WeakPolarHBondContact O-CB 3.45Å; V247-K250 PolarHBondContact O-N 3.37Å; K248-K250 PolarHBondContact O-N 3.48Å; K248-K250 VanDerWaalsContact O-N 3.12Å
251	L	96.7	Very high	95.4	Very high	21 Å²	21	55.4 Å²	55.4	11%	0.11	25%	0.253	C	S	.	.	S	Bend	trans	-73.7	157.9	-177.8	-59.9	172.6	0	0	0	111.1	F210 V223 F226 K248 C255	F210-L251 HydrophobicContact CE1-CD2 3.77Å; F210-L251 HydrophobicContact CZ-CD2 4.04Å; V223-L251 HydrophobicContact CB-CD2 3.78Å; V223-L251 HydrophobicContact CG1-CD2 3.88Å; V223-L251 HydrophobicContact CG2-CD2 4.26Å; F226-L251 HydrophobicContact CB-CD1 3.61Å; F226-L251 HydrophobicContact CD1-CD1 3.36Å; F226-L251 HydrophobicContact CE1-CD1 4.19Å; F226-L251 HydrophobicContact CG-CD1 3.71Å; K248-L251 WeakPolarHBondContact O-CB 3.42Å; K248-L251 PolarHBondContact O-N 2.94Å; K248-L251 VanDerWaalsContact O-N 3.07Å; L251-C255 HydrophobicContact CB-CB 4.05Å
252	S	94.9	Very high	94.9	Very high	47 Å²	47	54.9 Å²	54.9	33%	0.329	26%	0.255	S	S	.	.			trans	-63.7	152.7	171.3	77.1	0	0	0	0	110.9	N254 C255	S252-N254 PolarHBondContact O-N 2.87Å; S252-C255 VanDerWaalsContact O-CB 3.26Å; S252-C255 WeakPolarHBondContact O-CB 3.2Å; S252-C255 PolarHBondContact O-N 3.22Å; S252-C255 VanDerWaalsContact O-N 3.1Å; S252-C255 PolarHBondContact OG-N 3.47Å
253	R	92.7	Very high	94.1	Very high	255 Å²	255	51.8 Å²	51.8	96%	0.962	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.3	176.2	-69.6	-175.2	178.3	178.1	-0.7	113.5
254	N	92.9	Very high	93.1	Very high	145 Å²	145	52.9 Å²	52.9	78%	0.775	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-1.4	-180	-60.9	-10.9	0	0	0	112.3	S252 Q256	S252-N254 PolarHBondContact O-N 2.87Å; N254-Q256 PolarHBondContact O-N 2.96Å
255	C	96.7	Very high	92.4	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.034	26%	0.259	C	S	.	.			trans	-67.9	124.2	174.5	-176.3	0	0	0	0	109.3	L251 S252	L251-C255 HydrophobicContact CB-CB 4.05Å; S252-C255 VanDerWaalsContact O-CB 3.26Å; S252-C255 WeakPolarHBondContact O-CB 3.2Å; S252-C255 PolarHBondContact O-N 3.22Å; S252-C255 VanDerWaalsContact O-N 3.1Å; S252-C255 PolarHBondContact OG-N 3.47Å
256	Q	97.7	Very high	91.9	Very high	3 Å²	3	60.9 Å²	60.9	1%	0.014	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130	175.7	-177.8	-177.1	21.5	0	0	109.6	L109 P114 Q115 N116 V224 M225 F226 N254 L258	L109-Q256 PolarHBondContact O-NE2 3.34Å; L109-Q256 VanDerWaalsContact O-NE2 3.12Å; L109-Q256 PolarHBondContact O-OE1 3.31Å; P114-Q256 HydrophobicContact CB-CG 4.35Å; Q115-Q256 WeakPolarHBondContact O-CG 3.44Å; Q115-Q256 PolarHBondContact O-NE2 3.35Å; N116-Q256 WeakPolarHBondContact OD1-CA 3.47Å; V224-Q256 PolarHBondContact O-N 3.18Å; M225-Q256 CarbonylContact C-O 3.25Å; M225-Q256 WeakPolarHBondContact CA-O 3.49Å; F226-Q256 PolarHBondContact N-O 3.05Å; N254-Q256 PolarHBondContact O-N 2.96Å; Q256-L258 HydrophobicContact CG-CD2 3.8Å; Q256-L258 HydrophobicContact CG-CG 4.46Å
257	I	97.9	Very high	91.5	Very high	12 Å²	12	56 Å²	56	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122	-177.8	-55.6	175.7	0	0	0	109.1	N116 M117 F226 K248 F275 V276 P277	N116-I257 VanDerWaalsContact CA-O 3.3Å; N116-I257 WeakPolarHBondContact CA-O 3.3Å; N116-I257 WeakPolarHBondContact CB-O 3.45Å; N116-I257 PolarHBondContact OD1-N 3.26Å; M117-I257 PolarHBondContact N-O 2.93Å; M117-I257 VanDerWaalsContact N-O 3.1Å; F226-I257 WeakPolarHBondContact O-CA 3.4Å; K248-I257 HydrophobicContact CD-CD1 4.11Å; K248-I257 HydrophobicContact CG-CD1 3.91Å; I257-F275 HydrophobicContact CG2-CD1 3.94Å; I257-F275 HydrophobicContact CG2-CE1 3.67Å; I257-V276 HydrophobicContact CB-CG1 4.47Å; I257-V276 HydrophobicContact CG2-CG1 4.43Å; I257-V276 HydrophobicContact CG2-CG2 4.06Å; I257-P277 HydrophobicContact CD1-CG 4.43Å
258	L	97.8	Very high	91.1	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.6	175.9	-42.4	-178.2	0	0	0	109.9	L109 M117 F131 M225 F226 V227 L228 Q256 F260	L109-L258 HydrophobicContact CD1-CD1 4.45Å; L109-L258 HydrophobicContact CD2-CD1 4Å; L109-L258 HydrophobicContact CD2-CD2 3.41Å; L109-L258 VanDerWaalsContact CD2-CD2 3.41Å; L109-L258 HydrophobicContact CD2-CG 4.39Å; M117-L258 HydrophobicContact CB-CD2 3.78Å; M117-L258 CarbonylContact O-C 3.4Å; M117-L258 WeakPolarHBondContact O-CA 3.46Å; F131-L258 HydrophobicContact CB-CD1 4.28Å; M225-L258 HydrophobicContact CE-CD1 4.24Å; M225-L258 HydrophobicContact CG-CD1 4.48Å; M225-L258 HydrophobicContact SD-CD1 4.01Å; F226-L258 PolarHBondContact O-N 2.77Å; V227-L258 CarbonylContact C-O 3.51Å; V227-L258 WeakPolarHBondContact CA-O 3.37Å; V227-L258 HydrophobicContact CG2-CB 4.1Å; V227-L258 HydrophobicContact CG2-CD1 3.99Å; V227-L258 HydrophobicContact CG2-CG 4.23Å; L228-L258 PolarHBondContact N-O 3.47Å; Q256-L258 HydrophobicContact CG-CD2 3.8Å; Q256-L258 HydrophobicContact CG-CG 4.46Å; L258-F260 HydrophobicContact CB-CD2 4.43Å; L258-F260 HydrophobicContact CB-CE2 3.68Å; L258-F260 HydrophobicContact CB-CZ 4.42Å; L258-F260 HydrophobicContact CD1-CE2 4.28Å
259	L	97	Very high	90.8	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.4	174.7	-176	154.4	0	0	0	109.8	M117 I118 A119 L228 A231 F271 A272 F275 V276	M117-L259 PolarHBondContact O-N 3.22Å; I118-L259 CarbonylContact C-O 3.55Å; I118-L259 WeakPolarHBondContact CA-O 3.33Å; I118-L259 HydrophobicContact CG2-CD2 4.3Å; A119-L259 PolarHBondContact N-O 3.18Å; L228-L259 HydrophobicContact CB-CG 4.46Å; L228-L259 HydrophobicContact CD2-CD1 3.93Å; L228-L259 HydrophobicContact CD2-CG 4.35Å; L228-L259 WeakPolarHBondContact O-CA 3.25Å; A231-L259 HydrophobicContact CB-CD1 4.11Å; A231-L259 HydrophobicContact CB-CD2 3.69Å; A231-L259 HydrophobicContact CB-CG 3.86Å; L259-F271 HydrophobicContact CD1-CD1 4.26Å; L259-F271 HydrophobicContact CD1-CE1 3.96Å; L259-A272 HydrophobicContact CD1-CB 3.79Å; L259-A272 HydrophobicContact CD2-CB 3.79Å; L259-A272 HydrophobicContact CG-CB 4.43Å; L259-F275 HydrophobicContact CD1-CB 4.14Å; L259-F275 HydrophobicContact CD1-CD1 3.84Å; L259-F275 HydrophobicContact CD1-CG 4.24Å; L259-V276 HydrophobicContact CB-CG2 3.55Å; L259-V276 HydrophobicContact CD1-CG2 4.15Å
260	F	93.6	Very high	90.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.2	178.8	-64.6	-93.3	0	0	0	110.2	M117 A119 K127 F131 V227 L228 E230 A231 L258	M117-F260 HydrophobicContact CE-CD1 4.49Å; M117-F260 HydrophobicContact CE-CE1 3.42Å; M117-F260 VanDerWaalsContact CE-CE1 3.42Å; M117-F260 HydrophobicContact CE-CE2 4.09Å; M117-F260 HydrophobicContact CE-CZ 3.17Å; A119-F260 HydrophobicContact CB-CD1 3.4Å; A119-F260 HydrophobicContact CB-CE1 3.53Å; A119-F260 HydrophobicContact CB-CG 4.3Å; A119-F260 HydrophobicContact CB-CZ 4.48Å; A119-F260 WeakPolarHBondContact O-CA 3.46Å; K127-F260 HydrophobicContact CB-CD1 3.66Å; K127-F260 HydrophobicContact CB-CE1 4.2Å; K127-F260 HydrophobicContact CB-CG 4.42Å; K127-F260 HydrophobicContact CD-CB 4.22Å; K127-F260 HydrophobicContact CD-CD1 4Å; K127-F260 HydrophobicContact CG-CD1 3.95Å; F131-F260 HydrophobicContact CB-CD2 4.49Å; F131-F260 HydrophobicContact CB-CE2 3.55Å; F131-F260 HydrophobicContact CB-CZ 3.69Å; F131-F260 AromaticContact CD1-CD2 3.8Å; F131-F260 HydrophobicContact CD1-CD2 3.8Å; F131-F260 AromaticContact CD1-CE2 3.66Å; F131-F260 HydrophobicContact CD1-CE2 3.66Å; F131-F260 HydrophobicContact CD1-CG 4.31Å; F131-F260 HydrophobicContact CD1-CZ 4.03Å; F131-F260 HydrophobicContact CE1-CD2 4.49Å; F131-F260 HydrophobicContact CG-CE2 4.02Å; F131-F260 HydrophobicContact CG-CZ 4.37Å; V227-F260 HydrophobicContact CG1-CD2 3.87Å; V227-F260 HydrophobicContact CG1-CE2 3.94Å; L228-F260 PolarHBondContact O-N 2.95Å; E230-F260 PolarHBondContact N-O 3.15Å; E230-F260 VanDerWaalsContact N-O 3.08Å; A231-F260 PolarHBondContact N-O 3.48Å; L258-F260 HydrophobicContact CB-CD2 4.43Å; L258-F260 HydrophobicContact CB-CE2 3.68Å; L258-F260 HydrophobicContact CB-CZ 4.42Å; L258-F260 HydrophobicContact CD1-CE2 4.28Å
261	S	89.9	Confident	90.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	157.2	173	168.2	0	0	0	0	111.6	A119 Q120 S121 D232 T263	A119-S261 PolarHBondContact O-N 3.5Å; Q120-S261 PolarHBondContact OE1-O 2.92Å; Q120-S261 PolarHBondContact OE1-OG 2.9Å; S121-S261 PolarHBondContact N-O 3.32Å; D232-S261 VanDerWaalsContact CB-OG 3.25Å; D232-S261 WeakPolarHBondContact CB-OG 3.45Å; D232-S261 PolarHBondContact N-OG 2.83Å; D232-S261 WeakPolarHBondContact OD1-CA 3.45Å; D232-S261 VanDerWaalsContact OD1-CB 3.28Å; D232-S261 WeakPolarHBondContact OD1-CB 3.27Å; D232-S261 PolarHBondContact OD1-OG 3.41Å; S261-T263 PolarHBondContact OG-N 2.7Å; S261-T263 PolarHBondContact OG-O 3.17Å
262	A	81.3	Confident	90.3	Very high	31 Å²	31	47.3 Å²	47.3	26%	0.256	24%	0.241	S	C	.	.	S	Bend	trans	-87.6	-26.6	178.4	0	0	0	0	0	113.3	S121 D232	S121-A262 WeakPolarHBondContact O-CA 3.41Å; D232-A262 PolarHBondContact OD1-N 3.02Å; D232-A262 VanDerWaalsContact OD1-N 3.14Å
263	T	76.7	Confident	90.3	Very high	38 Å²	38	48.8 Å²	48.8	23%	0.233	24%	0.242	C	C	.	.			trans	-117.3	161.8	-172.3	72.7	0	0	0	0	112.4	Q120 D232 S261	Q120-T263 PolarHBondContact OE1-O 3.24Å; D232-T263 HydrophobicContact CB-CG2 4.35Å; D232-T263 WeakPolarHBondContact CB-OG1 3.36Å; S261-T263 PolarHBondContact OG-N 2.7Å; S261-T263 PolarHBondContact OG-O 3.17Å
264	Y	76.3	Confident	90.4	Very high	61 Å²	61	42.7 Å²	42.7	24%	0.239	23%	0.225	C	C	.	.			trans	-128.6	49.5	-174.5	-156	-108.8	0	0	0	110.3	Q120 I269 R283 R286	Q120-Y264 HydrophobicContact CB-CD2 4Å; Q120-Y264 HydrophobicContact CB-CE2 4.49Å; Q120-Y264 HydrophobicContact CG-CD2 3.79Å; Q120-Y264 HydrophobicContact CG-CE2 4.02Å; Y264-I269 HydrophobicContact CD1-CD1 3.57Å; Y264-I269 HydrophobicContact CD1-CG1 4.29Å; Y264-I269 HydrophobicContact CD2-CD1 4.07Å; Y264-I269 HydrophobicContact CD2-CG1 3.84Å; Y264-I269 HydrophobicContact CE1-CD1 3.22Å; Y264-I269 HydrophobicContact CE1-CG1 3.98Å; Y264-I269 HydrophobicContact CE2-CD1 3.76Å; Y264-I269 HydrophobicContact CE2-CG1 3.49Å; Y264-I269 VanDerWaalsContact CE2-CG1 3.49Å; Y264-I269 HydrophobicContact CG-CD1 3.94Å; Y264-I269 HydrophobicContact CG-CG1 4.18Å; Y264-I269 VanDerWaalsContact CZ-CG1 3.5Å; Y264-I269 WeakPolarHBondContact OH-CD1 3.44Å; Y264-R283 HydrophobicContact CE2-CG 4.13Å; Y264-R283 PolarHBondContact OH-NE 3.39Å; Y264-R283 VanDerWaalsContact OH-NE 3.16Å; Y264-R283 PolarHBondContact OH-NH1 2.67Å; Y264-R283 PolarHBondContact OH-NH2 2.9Å; Y264-R283 VanDerWaalsContact OH-NH2 3.09Å; Y264-R286 PolarHBondContact O-NH2 3.28Å
265	E	81.2	Confident	90.5	Very high	77 Å²	77	35.8 Å²	35.8	36%	0.36	19%	0.188	S	C	.	.			trans	-79.4	147.2	172.3	-61.5	174.9	-167.7	0	0	109.5	R38 S267 V268 I269	R38-E265 IonicContact CZ-OE1 2.7Å; R38-E265 IonicContact NH1-OE1 3.98Å; R38-E265 PolarHBondContact NH1-OE1 3.35Å; R38-E265 IonicContact NH2-OE1 3.02Å; R38-E265 PolarHBondContact NH2-OE1 3.29Å; E265-S267 VanDerWaalsContact C-N 3.26Å; E265-S267 PolarHBondContact O-N 2.82Å; E265-V268 HydrophobicContact CB-CG2 4.01Å; E265-V268 WeakPolarHBondContact O-CA 3.3Å; E265-V268 WeakPolarHBondContact O-CB 3.49Å; E265-V268 PolarHBondContact O-N 3.28Å; E265-I269 WeakPolarHBondContact O-CG1 3.49Å; E265-I269 PolarHBondContact O-N 2.97Å; E265-I269 VanDerWaalsContact O-N 3.09Å
266	D	84.9	Confident	90.5	Very high	116 Å²	116	35.6 Å²	35.6	62%	0.62	19%	0.187	S	C	*	.	H	α-helix	trans	-56.2	-39.3	-173	-63.6	-23	0	0	0	112.8	V268 I269 D270	D266-V268 VanDerWaalsContact C-N 3.28Å; D266-V268 PolarHBondContact O-N 3.03Å; D266-I269 PolarHBondContact O-N 2.94Å; D266-D270 WeakPolarHBondContact O-CB 3.1Å; D266-D270 VanDerWaalsContact O-CG 3.32Å; D266-D270 PolarHBondContact O-N 3.34Å
267	S	88.5	Confident	90.3	Very high	58 Å²	58	38.2 Å²	38.2	41%	0.406	20%	0.203	S	C	.	.	H	α-helix	trans	-60.1	-36	175.2	56	0	0	0	0	113.2	E265 F271	E265-S267 VanDerWaalsContact C-N 3.26Å; E265-S267 PolarHBondContact O-N 2.82Å; S267-F271 VanDerWaalsContact O-CB 3.32Å; S267-F271 WeakPolarHBondContact O-CB 3.43Å; S267-F271 PolarHBondContact O-N 3.2Å; S267-F271 VanDerWaalsContact O-N 3.15Å
268	V	88.3	Confident	90	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-71.8	-40.4	177.6	-172.3	0	0	0	0	110.7	D232 I235 E265 D266 A272	D232-V268 HydrophobicContact CB-CG2 4.09Å; I235-V268 HydrophobicContact CD1-CB 3.83Å; I235-V268 HydrophobicContact CD1-CG1 4.01Å; I235-V268 HydrophobicContact CD1-CG2 3.62Å; E265-V268 HydrophobicContact CB-CG2 4.01Å; E265-V268 WeakPolarHBondContact O-CA 3.3Å; E265-V268 WeakPolarHBondContact O-CB 3.49Å; E265-V268 PolarHBondContact O-N 3.28Å; D266-V268 VanDerWaalsContact C-N 3.28Å; D266-V268 PolarHBondContact O-N 3.03Å; V268-A272 WeakPolarHBondContact O-CB 2.98Å; V268-A272 PolarHBondContact O-N 2.89Å
269	I	89	Confident	89.8	Confident	20 Å²	20	44.3 Å²	44.3	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-51.6	178.8	-59.9	165.7	0	0	0	110.1	Y264 E265 D266 F271 A272 H273	Y264-I269 HydrophobicContact CD1-CD1 3.57Å; Y264-I269 HydrophobicContact CD1-CG1 4.29Å; Y264-I269 HydrophobicContact CD2-CD1 4.07Å; Y264-I269 HydrophobicContact CD2-CG1 3.84Å; Y264-I269 HydrophobicContact CE1-CD1 3.22Å; Y264-I269 HydrophobicContact CE1-CG1 3.98Å; Y264-I269 HydrophobicContact CE2-CD1 3.76Å; Y264-I269 HydrophobicContact CE2-CG1 3.49Å; Y264-I269 VanDerWaalsContact CE2-CG1 3.49Å; Y264-I269 HydrophobicContact CG-CD1 3.94Å; Y264-I269 HydrophobicContact CG-CG1 4.18Å; Y264-I269 VanDerWaalsContact CZ-CG1 3.5Å; Y264-I269 WeakPolarHBondContact OH-CD1 3.44Å; E265-I269 WeakPolarHBondContact O-CG1 3.49Å; E265-I269 PolarHBondContact O-N 2.97Å; E265-I269 VanDerWaalsContact O-N 3.09Å; D266-I269 PolarHBondContact O-N 2.94Å; I269-F271 VanDerWaalsContact C-N 3.34Å; I269-F271 PolarHBondContact O-N 3.06Å; I269-A272 PolarHBondContact O-N 3.21Å; I269-A272 VanDerWaalsContact O-N 3.09Å; I269-H273 PolarHBondContact O-N 2.85Å
270	D	92.2	Very high	89.5	Confident	110 Å²	110	44.4 Å²	44.4	59%	0.588	24%	0.237	S	C	*	.	H	α-helix	trans	-58.5	-47.5	-179.4	-72.8	-17.3	0	0	0	110.9	D266 A272 H273 E274	D266-D270 WeakPolarHBondContact O-CB 3.1Å; D266-D270 VanDerWaalsContact O-CG 3.32Å; D266-D270 PolarHBondContact O-N 3.34Å; D270-A272 VanDerWaalsContact C-N 3.35Å; D270-A272 PolarHBondContact O-N 3.39Å; D270-H273 PolarHBondContact O-N 3.05Å; D270-E274 PolarHBondContact O-N 3.45Å
271	F	93.3	Very high	89.4	Confident	13 Å²	13	45.4 Å²	45.4	6%	0.057	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-43.1	175.4	171.8	-105.2	0	0	0	111.8	L228 A231 I235 L241 M245 L259 S267 I269 H273 E274 F275	L228-F271 HydrophobicContact CD2-CE1 3.47Å; L228-F271 VanDerWaalsContact CD2-CE1 3.47Å; L228-F271 HydrophobicContact CD2-CZ 3.74Å; A231-F271 HydrophobicContact CB-CE1 4.49Å; I235-F271 HydrophobicContact CD1-CB 4.14Å; I235-F271 HydrophobicContact CD1-CD1 4.12Å; I235-F271 HydrophobicContact CD1-CG 4.38Å; I235-F271 HydrophobicContact CG1-CD1 4.32Å; I235-F271 HydrophobicContact CG1-CG 4.49Å; L241-F271 HydrophobicContact CB-CD2 4.18Å; L241-F271 HydrophobicContact CB-CE2 3.79Å; L241-F271 HydrophobicContact CB-CZ 4.38Å; L241-F271 HydrophobicContact CD1-CD2 4.06Å; L241-F271 HydrophobicContact CD1-CE2 4.44Å; L241-F271 HydrophobicContact CD1-CG 4.36Å; L241-F271 HydrophobicContact CD2-CD1 4Å; L241-F271 HydrophobicContact CD2-CD2 3.94Å; L241-F271 HydrophobicContact CD2-CE1 3.72Å; L241-F271 HydrophobicContact CD2-CE2 3.66Å; L241-F271 HydrophobicContact CD2-CG 4.1Å; L241-F271 HydrophobicContact CD2-CZ 3.54Å; L241-F271 HydrophobicContact CG-CD2 4.27Å; L241-F271 HydrophobicContact CG-CE2 4.15Å; L241-F271 HydrophobicContact CG-CZ 4.49Å; M245-F271 HydrophobicContact CG-CE2 4.26Å; L259-F271 HydrophobicContact CD1-CD1 4.26Å; L259-F271 HydrophobicContact CD1-CE1 3.96Å; S267-F271 VanDerWaalsContact O-CB 3.32Å; S267-F271 WeakPolarHBondContact O-CB 3.43Å; S267-F271 PolarHBondContact O-N 3.2Å; S267-F271 VanDerWaalsContact O-N 3.15Å; I269-F271 VanDerWaalsContact C-N 3.34Å; I269-F271 PolarHBondContact O-N 3.06Å; F271-H273 VanDerWaalsContact C-N 3.35Å; F271-H273 PolarHBondContact O-N 3.43Å; F271-E274 PolarHBondContact O-N 3.37Å; F271-F275 HydrophobicContact CE1-CB 4.25Å; F271-F275 HydrophobicContact CE1-CD2 4.44Å; F271-F275 HydrophobicContact CE1-CG 4.34Å; F271-F275 HydrophobicContact CE2-CB 4.23Å; F271-F275 HydrophobicContact CE2-CD2 4Å; F271-F275 HydrophobicContact CE2-CG 4.44Å; F271-F275 HydrophobicContact CZ-CB 4.03Å; F271-F275 AromaticContact CZ-CD2 3.61Å; F271-F275 HydrophobicContact CZ-CD2 3.61Å; F271-F275 HydrophobicContact CZ-CE2 4.26Å; F271-F275 AromaticContact CZ-CG 3.93Å; F271-F275 HydrophobicContact CZ-CG 3.93Å; F271-F275 WeakPolarHBondContact O-CB 3.32Å; F271-F275 PolarHBondContact O-N 3.46Å
272	A	94.2	Very high	89.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-39.9	-178.7	0	0	0	0	0	112.4	I118 L259 V268 I269 D270 F275 V276	I118-A272 HydrophobicContact CD1-CB 3.84Å; I118-A272 HydrophobicContact CG1-CB 4.29Å; I118-A272 HydrophobicContact CG2-CB 4.22Å; L259-A272 HydrophobicContact CD1-CB 3.79Å; L259-A272 HydrophobicContact CD2-CB 3.79Å; L259-A272 HydrophobicContact CG-CB 4.43Å; V268-A272 WeakPolarHBondContact O-CB 2.98Å; V268-A272 PolarHBondContact O-N 2.89Å; I269-A272 PolarHBondContact O-N 3.21Å; I269-A272 VanDerWaalsContact O-N 3.09Å; D270-A272 VanDerWaalsContact C-N 3.35Å; D270-A272 PolarHBondContact O-N 3.39Å; A272-F275 PolarHBondContact O-N 3.13Å; A272-V276 PolarHBondContact O-N 3.17Å
273	H	93.7	Very high	89.3	Confident	79 Å²	79	45.7 Å²	45.7	37%	0.366	24%	0.237	S	C	.	.	H	α-helix	trans	-69.3	-34.7	175.6	-72.3	167.9	0	0	0	113.1	I269 D270 F271 E281	I269-H273 PolarHBondContact O-N 2.85Å; D270-H273 PolarHBondContact O-N 3.05Å; F271-H273 VanDerWaalsContact C-N 3.35Å; F271-H273 PolarHBondContact O-N 3.43Å; H273-E281 IonicContact CD2-OE1 2.9Å; H273-E281 IonicContact CE1-OE1 3.46Å; H273-E281 VanDerWaalsContact NE2-CD 3.3Å; H273-E281 IonicContact NE2-OE1 2.67Å; H273-E281 PolarHBondContact NE2-OE1 2.97Å; H273-E281 IonicContact NE2-OE2 3.57Å; H273-E281 PolarHBondContact NE2-OE2 3.38Å
274	E	94.6	Very high	88.8	Confident	127 Å²	127	45.9 Å²	45.9	59%	0.593	24%	0.237	S	C	*	.	H	α-helix	trans	-68.5	-37.9	170.6	-168.7	-173.8	167.3	0	0	111.5	M245 K248 D270 F271	M245-E274 HydrophobicContact CE-CG 3.87Å; M245-E274 VanDerWaalsContact CE-OE1 3.23Å; M245-E274 WeakPolarHBondContact CE-OE1 3.26Å; K248-E274 PolarHBondContact NZ-O 2.84Å; D270-E274 PolarHBondContact O-N 3.45Å; F271-E274 PolarHBondContact O-N 3.37Å
275	F	95.4	Very high	88.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-80	-33.2	-173.6	-168.7	-94.4	0	0	0	113.7	F226 L228 C244 M245 K248 I257 L259 F271 A272	F226-F275 HydrophobicContact CD1-CE1 4.49Å; F226-F275 HydrophobicContact CD1-CZ 4.09Å; F226-F275 HydrophobicContact CE1-CE1 4.13Å; F226-F275 HydrophobicContact CE1-CE2 4.19Å; F226-F275 AromaticContact CE1-CZ 3.34Å; F226-F275 HydrophobicContact CE1-CZ 3.34Å; F226-F275 AromaticContact CZ-CZ 3.84Å; F226-F275 HydrophobicContact CZ-CZ 3.84Å; L228-F275 HydrophobicContact CB-CE1 3.88Å; L228-F275 HydrophobicContact CB-CZ 4.2Å; L228-F275 HydrophobicContact CD2-CD1 4.22Å; L228-F275 HydrophobicContact CD2-CE1 3.94Å; L228-F275 HydrophobicContact CD2-CE2 4.31Å; L228-F275 HydrophobicContact CD2-CG 4.49Å; L228-F275 HydrophobicContact CD2-CZ 3.95Å; L228-F275 HydrophobicContact CG-CE1 4.49Å; L228-F275 HydrophobicContact CG-CZ 4.49Å; C244-F275 HydrophobicContact CB-CE2 3.8Å; C244-F275 HydrophobicContact CB-CZ 4.37Å; M245-F275 HydrophobicContact CG-CD2 4.29Å; M245-F275 HydrophobicContact SD-CD2 3.6Å; M245-F275 HydrophobicContact SD-CE2 4.34Å; M245-F275 HydrophobicContact SD-CG 4.48Å; K248-F275 HydrophobicContact CB-CE2 4.13Å; K248-F275 HydrophobicContact CB-CZ 4.48Å; K248-F275 HydrophobicContact CD-CD2 4.12Å; K248-F275 HydrophobicContact CD-CE2 4.23Å; K248-F275 HydrophobicContact CD-CG 4.44Å; K248-F275 VanDerWaalsContact CD-O 3.24Å; K248-F275 WeakPolarHBondContact CD-O 3.11Å; K248-F275 WeakPolarHBondContact CE-O 3.27Å; K248-F275 PolarHBondContact NZ-O 2.98Å; I257-F275 HydrophobicContact CG2-CD1 3.94Å; I257-F275 HydrophobicContact CG2-CE1 3.67Å; L259-F275 HydrophobicContact CD1-CB 4.14Å; L259-F275 HydrophobicContact CD1-CD1 3.84Å; L259-F275 HydrophobicContact CD1-CG 4.24Å; F271-F275 HydrophobicContact CE1-CB 4.25Å; F271-F275 HydrophobicContact CE1-CD2 4.44Å; F271-F275 HydrophobicContact CE1-CG 4.34Å; F271-F275 HydrophobicContact CE2-CB 4.23Å; F271-F275 HydrophobicContact CE2-CD2 4Å; F271-F275 HydrophobicContact CE2-CG 4.44Å; F271-F275 HydrophobicContact CZ-CB 4.03Å; F271-F275 AromaticContact CZ-CD2 3.61Å; F271-F275 HydrophobicContact CZ-CD2 3.61Å; F271-F275 HydrophobicContact CZ-CE2 4.26Å; F271-F275 AromaticContact CZ-CG 3.93Å; F271-F275 HydrophobicContact CZ-CG 3.93Å; F271-F275 WeakPolarHBondContact O-CB 3.32Å; F271-F275 PolarHBondContact O-N 3.46Å; A272-F275 PolarHBondContact O-N 3.13Å
276	V	96.2	Very high	86.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	27%	0.267	C	S	.	.	S	Bend	trans	-115.9	109.6	-176	-169.6	0	0	0	0	110.6	N116 I118 I257 L259 A272 P279	N116-V276 HydrophobicContact CB-CG1 3.62Å; I118-V276 HydrophobicContact CD1-CB 4.1Å; I118-V276 HydrophobicContact CD1-CG2 4.38Å; I118-V276 HydrophobicContact CG1-CB 3.83Å; I118-V276 HydrophobicContact CG1-CG1 4.25Å; I118-V276 HydrophobicContact CG1-CG2 3.8Å; I257-V276 HydrophobicContact CB-CG1 4.47Å; I257-V276 HydrophobicContact CG2-CG1 4.43Å; I257-V276 HydrophobicContact CG2-CG2 4.06Å; L259-V276 HydrophobicContact CB-CG2 3.55Å; L259-V276 HydrophobicContact CD1-CG2 4.15Å; A272-V276 PolarHBondContact O-N 3.17Å; V276-P279 HydrophobicContact CB-CB 4.37Å; V276-P279 HydrophobicContact CG1-CB 3.82Å; V276-P279 WeakPolarHBondContact O-CD 3.43Å
277	P	93.5	Very high	85	Confident	57 Å²	57	51.9 Å²	51.9	37%	0.37	26%	0.259	S	S	.	.	S	Bend	trans	-76.5	135.4	178.5	29.6	-29.7	0	0	0	111.1	N116 I257	N116-P277 WeakPolarHBondContact CB-O 3.49Å; N116-P277 PolarHBondContact ND2-O 3.03Å; I257-P277 HydrophobicContact CD1-CG 4.43Å
278	N	92.3	Very high	83	Confident	128 Å²	128	57.9 Å²	57.9	68%	0.684	28%	0.281	S	S	*	.	S	Bend	trans	47.1	55.9	177.1	-55.2	-31.5	0	0	0	114.2	S65	S65-N278 PolarHBondContact OG-O 2.98Å
279	P	93.4	Very high	81.2	Confident	13 Å²	13	60.6 Å²	60.6	8%	0.084	29%	0.294	C	S	.	.			trans	-74.2	154.1	-176.3	31.1	-33.2	0	0	0	112.4	S65 N116 I118 V276 E281	S65-P279 PolarHBondContact N-O 3.46Å; S65-P279 PolarHBondContact OG-O 3.4Å; N116-P279 WeakPolarHBondContact O-CA 3.3Å; I118-P279 HydrophobicContact CB-CB 4.37Å; I118-P279 HydrophobicContact CD1-CB 3.92Å; I118-P279 HydrophobicContact CD1-CG 3.63Å; I118-P279 HydrophobicContact CG1-CB 3.82Å; I118-P279 HydrophobicContact CG1-CG 4.13Å; V276-P279 HydrophobicContact CB-CB 4.37Å; V276-P279 HydrophobicContact CG1-CB 3.82Å; V276-P279 WeakPolarHBondContact O-CD 3.43Å; P279-E281 HydrophobicContact CB-CG 4.15Å; P279-E281 HydrophobicContact CG-CG 3.88Å
280	I	91.7	Very high	79.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	132.9	143.5	-55.4	162.4	0	0	0	106.9	I62 R64 L71 S108 Q115 N116 M117 I118 F282	I62-I280 HydrophobicContact CG2-CG2 4.08Å; R64-I280 HydrophobicContact CG-CG2 4.5Å; L71-I280 HydrophobicContact CD1-CG2 4.44Å; L71-I280 HydrophobicContact CD2-CD1 3.68Å; L71-I280 HydrophobicContact CD2-CG1 4.38Å; S108-I280 VanDerWaalsContact CB-CD1 3.48Å; Q115-I280 HydrophobicContact CB-CD1 3.72Å; Q115-I280 HydrophobicContact CB-CG1 4.17Å; Q115-I280 HydrophobicContact CG-CD1 4.24Å; N116-I280 PolarHBondContact O-N 3.01Å; M117-I280 CarbonylContact C-O 3.53Å; M117-I280 VanDerWaalsContact CA-O 3.24Å; M117-I280 WeakPolarHBondContact CA-O 2.88Å; M117-I280 WeakPolarHBondContact CG-O 3.35Å; I118-I280 PolarHBondContact N-O 2.96Å; I280-F282 HydrophobicContact CB-CE2 4.23Å; I280-F282 HydrophobicContact CG2-CD2 4.16Å; I280-F282 HydrophobicContact CG2-CE1 4.5Å; I280-F282 HydrophobicContact CG2-CE2 3.48Å; I280-F282 VanDerWaalsContact CG2-CE2 3.48Å; I280-F282 HydrophobicContact CG2-CZ 3.69Å
281	E	90.9	Very high	77.9	Confident	21 Å²	21	60.2 Å²	60.2	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.6	178	-47.9	-169.8	-143.3	0	0	111.3	I62 L63 I118 H273 P279 R283	I62-E281 CarbonylContact C-O 3.52Å; I62-E281 VanDerWaalsContact CA-O 3.29Å; I62-E281 WeakPolarHBondContact CA-O 3.3Å; L63-E281 HydrophobicContact CB-CB 4.11Å; L63-E281 PolarHBondContact N-O 3.11Å; L63-E281 PolarHBondContact O-N 3.38Å; I118-E281 HydrophobicContact CB-CG 4.24Å; I118-E281 HydrophobicContact CD1-CG 4.45Å; I118-E281 CarbonylContact O-C 3.38Å; I118-E281 VanDerWaalsContact O-CA 3.27Å; I118-E281 WeakPolarHBondContact O-CA 3.48Å; H273-E281 IonicContact CD2-OE1 2.9Å; H273-E281 IonicContact CE1-OE1 3.46Å; H273-E281 VanDerWaalsContact NE2-CD 3.3Å; H273-E281 IonicContact NE2-OE1 2.67Å; H273-E281 PolarHBondContact NE2-OE1 2.97Å; H273-E281 IonicContact NE2-OE2 3.57Å; H273-E281 PolarHBondContact NE2-OE2 3.38Å; P279-E281 HydrophobicContact CB-CG 4.15Å; P279-E281 HydrophobicContact CG-CG 3.88Å; E281-R283 IonicContact OE1-NH2 2.62Å; E281-R283 IonicContact OE2-CZ 2.78Å; E281-R283 IonicContact OE2-NE 3.76Å; E281-R283 PolarHBondContact OE2-NE 3.15Å; E281-R283 IonicContact OE2-NH2 3.82Å; E281-R283 PolarHBondContact OE2-NH2 3.09Å
282	F	86.6	Confident	76.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.5	169.6	-64.3	-83.2	0	0	0	107.9	I62 Q104 A105 M117 I118 Q120 I280	I62-F282 HydrophobicContact CD1-CD1 4.45Å; I62-F282 HydrophobicContact CD1-CE1 3.98Å; I62-F282 HydrophobicContact CG1-CD1 3.93Å; I62-F282 HydrophobicContact CG1-CE1 3.91Å; I62-F282 HydrophobicContact CG2-CD1 4.32Å; I62-F282 HydrophobicContact CG2-CE1 3.95Å; I62-F282 HydrophobicContact CG2-CZ 4.45Å; Q104-F282 HydrophobicContact CB-CD1 4.28Å; Q104-F282 HydrophobicContact CB-CE1 3.46Å; Q104-F282 VanDerWaalsContact CB-CE1 3.46Å; Q104-F282 HydrophobicContact CB-CZ 4.1Å; A105-F282 HydrophobicContact CB-CD2 4.32Å; A105-F282 HydrophobicContact CB-CE2 3.7Å; A105-F282 HydrophobicContact CB-CZ 3.9Å; M117-F282 HydrophobicContact CG-CD2 3.77Å; M117-F282 HydrophobicContact CG-CE2 3.91Å; M117-F282 HydrophobicContact SD-CD2 3.52Å; M117-F282 VanDerWaalsContact SD-CD2 3.52Å; M117-F282 HydrophobicContact SD-CE2 3.49Å; M117-F282 WeakPolarHBondContact SD-CE2 3.37Å; I118-F282 PolarHBondContact O-N 2.68Å; Q120-F282 PolarHBondContact N-O 3.5Å; I280-F282 HydrophobicContact CB-CE2 4.23Å; I280-F282 HydrophobicContact CG2-CD2 4.16Å; I280-F282 HydrophobicContact CG2-CE1 4.5Å; I280-F282 HydrophobicContact CG2-CE2 3.48Å; I280-F282 VanDerWaalsContact CG2-CE2 3.48Å; I280-F282 HydrophobicContact CG2-CZ 3.69Å
283	R	81.5	Confident	75.4	Confident	38 Å²	38	72.8 Å²	72.8	14%	0.143	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.7	-177.9	-60.6	177.9	-177.5	-178.1	-3.7	109.6	F60 E61 Q120 Y264 E281 K285	F60-R283 CarbonylContact C-O 3.59Å; F60-R283 WeakPolarHBondContact CA-O 3.42Å; E61-R283 PolarHBondContact N-O 3.31Å; E61-R283 PolarHBondContact O-N 3.45Å; Q120-R283 HydrophobicContact CB-CG 4.49Å; Q120-R283 CarbonylContact O-C 3.55Å; Y264-R283 HydrophobicContact CE2-CG 4.13Å; Y264-R283 PolarHBondContact OH-NE 3.39Å; Y264-R283 VanDerWaalsContact OH-NE 3.16Å; Y264-R283 PolarHBondContact OH-NH1 2.67Å; Y264-R283 PolarHBondContact OH-NH2 2.9Å; Y264-R283 VanDerWaalsContact OH-NH2 3.09Å; E281-R283 IonicContact OE1-NH2 2.62Å; E281-R283 IonicContact OE2-CZ 2.78Å; E281-R283 IonicContact OE2-NE 3.76Å; E281-R283 PolarHBondContact OE2-NE 3.15Å; E281-R283 IonicContact OE2-NH2 3.82Å; E281-R283 PolarHBondContact OE2-NH2 3.09Å; R283-K285 PolarHBondContact O-N 3.05Å
284	V	67.8	Low	74.7	Confident	41 Å²	41	69.7 Å²	69.7	25%	0.248	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.7	165.3	175.9	0	0	0	0	107.3	D59 F60 Q120 S121	D59-V284 CarbonylContact O-C 3.54Å; D59-V284 VanDerWaalsContact O-CA 3.28Å; D59-V284 WeakPolarHBondContact O-CA 3.45Å; F60-V284 HydrophobicContact CD1-CG2 3.79Å; F60-V284 HydrophobicContact CE1-CG2 3.33Å; F60-V284 HydrophobicContact CE2-CG2 4.47Å; F60-V284 HydrophobicContact CZ-CG2 3.72Å; Q120-V284 PolarHBondContact O-N 3.17Å; S121-V284 VanDerWaalsContact CB-CG2 3.4Å
285	K	62.8	Low	74.3	Confident	98 Å²	98	67.6 Å²	67.6	43%	0.426	33%	0.331	S	S	.	.			trans	-53.4	144.1	169.1	-70.9	178.9	-176.2	163.9	0	107.5	D59 E61 R283 T287	D59-K285 PolarHBondContact O-N 3.42Å; E61-K285 HydrophobicContact CB-CG 4.26Å; R283-K285 PolarHBondContact O-N 3.05Å; K285-T287 HydrophobicContact CB-CG2 4.26Å; K285-T287 PolarHBondContact O-N 2.66Å; K285-T287 PolarHBondContact O-OG1 3.32Å
286	R	53.4	Low	74.1	Confident	208 Å²	208	68.3 Å²	68.3	79%	0.785	34%	0.335	S	S	*	.			trans	-65.8	72.6	168.5	-68.9	-177.1	179.2	177.2	1.7	108.4	Y264	Y264-R286 PolarHBondContact O-NH2 3.28Å
287	T	45.7	Very low	74	Confident	74 Å²	74	69 Å²	69	45%	0.454	34%	0.338	S	S	.	.			trans	-79.7	124.2	171.3	37.3	0	0	0	0	106.8	D59 K285 L289	D59-T287 PolarHBondContact OD1-OG1 2.9Å; K285-T287 HydrophobicContact CB-CG2 4.26Å; K285-T287 PolarHBondContact O-N 2.66Å; K285-T287 PolarHBondContact O-OG1 3.32Å; T287-L289 PolarHBondContact O-N 2.91Å; T287-L289 VanDerWaalsContact O-N 3.16Å
288	Q	47.3	Very low	74.1	Confident	185 Å²	185	67.8 Å²	67.8	86%	0.864	33%	0.326	S	S	*	.			trans	-54	122.3	169.6	-68.1	174.4	-13.8	0	0	107.1	P290	Q288-P290 VanDerWaalsContact O-N 3.15Å
289	L	50.7	Low	74.3	Confident	57 Å²	57	63.2 Å²	63.2	30%	0.298	30%	0.301	S	S	.	.			trans	-45.3	124.4	172.9	-89.1	138.6	0	0	0	108.2	T287 L291 L411	T287-L289 PolarHBondContact O-N 2.91Å; T287-L289 VanDerWaalsContact O-N 3.16Å; L289-L291 PolarHBondContact O-N 3.45Å; L289-L411 HydrophobicContact CB-CD1 3.97Å; L289-L411 HydrophobicContact CB-CD2 4.24Å; L289-L411 HydrophobicContact CB-CG 4.23Å; L289-L411 HydrophobicContact CD1-CD1 4.39Å; L289-L411 HydrophobicContact CD1-CD2 3.72Å; L289-L411 HydrophobicContact CD1-CG 3.74Å
290	P	49	Very low	74.3	Confident	97 Å²	97	64.4 Å²	64.4	63%	0.63	31%	0.309	S	S	*	.			trans	-69.7	97.6	-177.9	24	-30.1	0	0	0	109.3	Q288 K292	Q288-P290 VanDerWaalsContact O-N 3.15Å; P290-K292 PolarHBondContact O-N 2.94Å; P290-K292 VanDerWaalsContact O-N 3.1Å
291	L	61.4	Low	74.4	Confident	26 Å²	26	64.9 Å²	64.9	14%	0.136	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-63	-7.2	170.6	-71.6	176.2	0	0	0	113.2	L289 N293 I294 L411 I414 F445 I447	L289-L291 PolarHBondContact O-N 3.45Å; L291-N293 PolarHBondContact O-N 3.33Å; L291-N293 VanDerWaalsContact O-N 3.09Å; L291-I294 HydrophobicContact CD2-CD1 4.41Å; L291-I294 PolarHBondContact O-N 2.93Å; L291-I294 VanDerWaalsContact O-N 3.16Å; L291-L411 HydrophobicContact CD1-CD1 4.18Å; L291-L411 HydrophobicContact CD2-CD1 3.44Å; L291-L411 VanDerWaalsContact CD2-CD1 3.44Å; L291-L411 HydrophobicContact CG-CD1 3.86Å; L291-I414 HydrophobicContact CD2-CD1 3.32Å; L291-I414 HydrophobicContact CD2-CG1 3.94Å; L291-F445 HydrophobicContact CD1-CB 4.11Å; L291-F445 HydrophobicContact CD1-CD1 3.87Å; L291-F445 HydrophobicContact CD1-CE1 4.46Å; L291-F445 HydrophobicContact CD1-CG 3.94Å; L291-I447 HydrophobicContact CD1-CD1 4.39Å
292	K	65.9	Low	74.4	Confident	195 Å²	195	67.6 Å²	67.6	85%	0.848	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-61	-23.3	-170.5	-64.4	-172.4	177.8	-176.8	0	114.7	P290	P290-K292 PolarHBondContact O-N 2.94Å; P290-K292 VanDerWaalsContact O-N 3.1Å
293	N	68.9	Low	74.5	Confident	82 Å²	82	70.9 Å²	70.9	44%	0.439	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-99.3	4.6	-176.7	-64.5	-7.8	0	0	0	113.8	L291 G418 G424	L291-N293 PolarHBondContact O-N 3.33Å; L291-N293 VanDerWaalsContact O-N 3.09Å; N293-G418 WeakPolarHBondContact CB-O 3.19Å; N293-G418 PolarHBondContact ND2-O 2.9Å; N293-G424 PolarHBondContact O-N 3.36Å; N293-G424 VanDerWaalsContact O-N 3.13Å
294	I	79.1	Confident	74.7	Confident	15 Å²	15	72.4 Å²	72.4	8%	0.077	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	115	-178.6	-56	156.5	0	0	0	108.1	L291 Q296 I414 S417 G424 A426	L291-I294 HydrophobicContact CD2-CD1 4.41Å; L291-I294 PolarHBondContact O-N 2.93Å; L291-I294 VanDerWaalsContact O-N 3.16Å; I294-Q296 HydrophobicContact CG2-CG 4.08Å; I294-I414 HydrophobicContact CD1-CB 4.36Å; I294-I414 HydrophobicContact CD1-CG1 4.27Å; I294-I414 WeakPolarHBondContact CD1-O 3.27Å; I294-I414 HydrophobicContact CG2-CB 4.46Å; I294-S417 WeakPolarHBondContact CG1-O 3.42Å; I294-G424 CarbonylContact C-O 3.54Å; I294-G424 WeakPolarHBondContact CA-O 3.3Å; I294-A426 HydrophobicContact CG2-CB 3.99Å
295	K	86.8	Confident	75.6	Confident	82 Å²	82	76.3 Å²	76.3	36%	0.357	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.1	169.4	-65.5	176.6	174.9	163.1	0	108	F297 E423 G424 V425 A426 F460	K295-F297 HydrophobicContact CB-CE2 3.67Å; K295-F297 HydrophobicContact CB-CZ 4.2Å; K295-E423 WeakPolarHBondContact CE-OE2 3.36Å; K295-E423 IonicContact NZ-OE1 3.59Å; K295-E423 PolarHBondContact NZ-OE1 2.55Å; K295-E423 IonicContact NZ-OE2 3.65Å; K295-E423 PolarHBondContact NZ-OE2 3.43Å; K295-G424 PolarHBondContact N-O 2.87Å; K295-V425 CarbonylContact O-C 3.47Å; K295-V425 WeakPolarHBondContact O-CA 3.33Å; K295-A426 PolarHBondContact O-N 2.86Å; K295-F460 HydrophobicContact CD-CE1 3.81Å
296	Q	91.1	Very high	77	Confident	16 Å²	16	75.9 Å²	75.9	8%	0.075	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.6	-174.2	-66.5	170.2	74.9	0	0	108.7	I294 Y410 I414 A426 I449 P450	I294-Q296 HydrophobicContact CG2-CG 4.08Å; Q296-Y410 PolarHBondContact OE1-OH 2.89Å; Q296-I414 HydrophobicContact CG-CD1 4.2Å; Q296-A426 CarbonylContact C-O 3.51Å; Q296-A426 WeakPolarHBondContact CA-O 3.16Å; Q296-A426 HydrophobicContact CG-CB 4.34Å; Q296-I449 HydrophobicContact CB-CG1 4.29Å; Q296-I449 HydrophobicContact CB-CG2 4.27Å; Q296-P450 WeakPolarHBondContact O-CD 3.35Å
297	F	94.3	Very high	78.8	Confident	16 Å²	16	66 Å²	66	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	160.1	177.1	-58	-88.1	0	0	0	110.9	K295 V425 A426 V427 N428 P450 L452 D456 F460	K295-F297 HydrophobicContact CB-CE2 3.67Å; K295-F297 HydrophobicContact CB-CZ 4.2Å; F297-V425 HydrophobicContact CD2-CG1 4.11Å; F297-V425 HydrophobicContact CE2-CG1 4.28Å; F297-A426 PolarHBondContact N-O 3.48Å; F297-V427 WeakPolarHBondContact O-CA 3.5Å; F297-N428 WeakPolarHBondContact O-CB 3.48Å; F297-N428 PolarHBondContact O-N 3.37Å; F297-N428 PolarHBondContact O-ND2 3.06Å; F297-P450 CarbonylContact C-O 3.58Å; F297-P450 WeakPolarHBondContact CA-O 3.41Å; F297-P450 HydrophobicContact CD1-CG 3.85Å; F297-P450 HydrophobicContact CE1-CG 3.89Å; F297-L452 HydrophobicContact CB-CB 3.79Å; F297-L452 HydrophobicContact CB-CD1 3.95Å; F297-L452 HydrophobicContact CB-CG 4.4Å; F297-L452 HydrophobicContact CD1-CB 4.39Å; F297-L452 HydrophobicContact CD1-CD1 3.79Å; F297-L452 HydrophobicContact CD2-CD1 3.86Å; F297-L452 HydrophobicContact CE1-CD1 4.28Å; F297-L452 HydrophobicContact CE2-CD1 4.34Å; F297-L452 HydrophobicContact CG-CB 4.25Å; F297-L452 HydrophobicContact CG-CD1 3.58Å; F297-L452 HydrophobicContact CG-CG 4.5Å; F297-D456 HydrophobicContact CE1-CB 4.42Å; F297-F460 HydrophobicContact CD2-CZ 4.24Å; F297-F460 HydrophobicContact CE2-CE1 4.04Å; F297-F460 HydrophobicContact CE2-CE2 4.12Å; F297-F460 AromaticContact CE2-CZ 3.3Å; F297-F460 HydrophobicContact CE2-CZ 3.3Å; F297-F460 HydrophobicContact CZ-CE1 4.35Å; F297-F460 HydrophobicContact CZ-CE2 4.38Å; F297-F460 AromaticContact CZ-CZ 3.5Å; F297-F460 HydrophobicContact CZ-CZ 3.5Å
298	Y	96.1	Very high	81	Confident	31 Å²	31	63.4 Å²	63.4	12%	0.122	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	157.7	163.6	74.9	-95.4	0	0	0	111.5	C300 N428 I430 M435 I438 I449 P450 E451 L452	Y298-C300 HydrophobicContact CD2-CB 4.44Å; Y298-C300 HydrophobicContact CE2-CB 4.32Å; Y298-N428 CarbonylContact C-O 3.57Å; Y298-N428 WeakPolarHBondContact CA-O 3.36Å; Y298-I430 HydrophobicContact CD2-CD1 3.96Å; Y298-I430 HydrophobicContact CD2-CG1 4.32Å; Y298-I430 HydrophobicContact CG-CD1 4.47Å; Y298-M435 HydrophobicContact CD2-CE 4.37Å; Y298-M435 HydrophobicContact CE2-CE 3.73Å; Y298-I438 HydrophobicContact CD1-CG2 4.04Å; Y298-I438 HydrophobicContact CG-CG1 4.34Å; Y298-I449 HydrophobicContact CD1-CG2 4.21Å; Y298-I449 WeakPolarHBondContact CD1-O 3.38Å; Y298-I449 VanDerWaalsContact CE1-O 3.23Å; Y298-I449 WeakPolarHBondContact CE1-O 3.35Å; Y298-P450 PolarHBondContact N-O 2.66Å; Y298-E451 HydrophobicContact CD2-CG 4.3Å; Y298-E451 HydrophobicContact CE1-CB 4.04Å; Y298-E451 HydrophobicContact CE2-CB 3.84Å; Y298-E451 HydrophobicContact CE2-CG 3.68Å; Y298-E451 CarbonylContact O-C 3.49Å; Y298-E451 WeakPolarHBondContact O-CA 3.29Å; Y298-E451 PolarHBondContact OH-OE2 3.24Å; Y298-L452 PolarHBondContact O-N 2.79Å
299	M	95.3	Very high	83	Confident	32 Å²	32	58.6 Å²	58.6	16%	0.158	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	165.5	-65.7	-177.6	78.3	0	0	108.4	F301 A310 I314 V427 N428 F429 I430 L452	M299-F301 HydrophobicContact CB-CE1 4.1Å; M299-F301 HydrophobicContact CB-CE2 3.55Å; M299-F301 HydrophobicContact CB-CZ 3.29Å; M299-F301 HydrophobicContact CE-CE1 4.15Å; M299-F301 HydrophobicContact CE-CZ 4.03Å; M299-F301 HydrophobicContact CG-CZ 4.24Å; M299-F301 WeakPolarHBondContact O-CE2 3.37Å; M299-F301 HydrophobicContact SD-CZ 4.03Å; M299-A310 HydrophobicContact CE-CB 3.61Å; M299-A310 HydrophobicContact SD-CB 4.22Å; M299-I314 HydrophobicContact SD-CD1 4Å; M299-V427 HydrophobicContact CG-CG1 4.02Å; M299-V427 HydrophobicContact SD-CG1 4.14Å; M299-N428 PolarHBondContact N-O 2.87Å; M299-F429 HydrophobicContact CB-CD1 4.2Å; M299-F429 HydrophobicContact CB-CE1 4.35Å; M299-F429 HydrophobicContact CG-CE1 4.39Å; M299-F429 HydrophobicContact SD-CD1 4.5Å; M299-F429 HydrophobicContact SD-CE1 3.75Å; M299-F429 HydrophobicContact SD-CZ 4.42Å; M299-I430 WeakPolarHBondContact O-CG1 2.97Å; M299-I430 PolarHBondContact O-N 3.38Å; M299-L452 HydrophobicContact CG-CB 3.73Å; M299-L452 HydrophobicContact CG-CD2 4.11Å; M299-L452 HydrophobicContact SD-CB 4.42Å; M299-L452 HydrophobicContact SD-CD2 3.76Å
300	C	94.1	Very high	84.9	Confident	37 Å²	37	56.2 Å²	56.2	25%	0.25	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.5	-177.5	-161	0	0	0	0	110.5	Y298 I430 N432	Y298-C300 HydrophobicContact CD2-CB 4.44Å; Y298-C300 HydrophobicContact CE2-CB 4.32Å; C300-I430 WeakPolarHBondContact CA-O 3.46Å; C300-I430 HydrophobicContact CB-CD1 4.37Å; C300-I430 HydrophobicContact CB-CG1 4.25Å; C300-N432 PolarHBondContact SG-OD1 2.89Å
301	F	94.1	Very high	86.9	Confident	11 Å²	11	51.7 Å²	51.7	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.7	-174.1	-55.4	-71.9	0	0	0	112	M299 E306 K307 A310 F429 I430 L431 N432	M299-F301 HydrophobicContact CB-CE1 4.1Å; M299-F301 HydrophobicContact CB-CE2 3.55Å; M299-F301 HydrophobicContact CB-CZ 3.29Å; M299-F301 HydrophobicContact CE-CE1 4.15Å; M299-F301 HydrophobicContact CE-CZ 4.03Å; M299-F301 HydrophobicContact CG-CZ 4.24Å; M299-F301 WeakPolarHBondContact O-CE2 3.37Å; M299-F301 HydrophobicContact SD-CZ 4.03Å; F301-E306 HydrophobicContact CB-CB 4.46Å; F301-E306 HydrophobicContact CD1-CB 4.04Å; F301-K307 HydrophobicContact CB-CB 4.31Å; F301-K307 HydrophobicContact CD1-CB 4.31Å; F301-K307 HydrophobicContact CD2-CB 3.93Å; F301-K307 HydrophobicContact CD2-CD 4.35Å; F301-K307 HydrophobicContact CD2-CG 3.79Å; F301-K307 HydrophobicContact CE2-CB 4.32Å; F301-K307 HydrophobicContact CE2-CG 3.93Å; F301-K307 HydrophobicContact CG-CB 3.9Å; F301-K307 HydrophobicContact CG-CG 4.29Å; F301-A310 HydrophobicContact CE1-CB 3.34Å; F301-A310 HydrophobicContact CZ-CB 3.53Å; F301-F429 HydrophobicContact CD2-CB 4.22Å; F301-F429 HydrophobicContact CD2-CG 4.44Å; F301-F429 HydrophobicContact CE2-CB 3.68Å; F301-F429 AromaticContact CE2-CD1 3.65Å; F301-F429 HydrophobicContact CE2-CD1 3.65Å; F301-F429 AromaticContact CE2-CD2 3.92Å; F301-F429 HydrophobicContact CE2-CD2 3.92Å; F301-F429 HydrophobicContact CE2-CE1 4.16Å; F301-F429 HydrophobicContact CE2-CE2 4.37Å; F301-F429 AromaticContact CE2-CG 3.5Å; F301-F429 HydrophobicContact CE2-CG 3.5Å; F301-F429 HydrophobicContact CE2-CZ 4.48Å; F301-F429 HydrophobicContact CZ-CD1 4.01Å; F301-F429 HydrophobicContact CZ-CD2 4.37Å; F301-F429 HydrophobicContact CZ-CE1 4.04Å; F301-F429 HydrophobicContact CZ-CE2 4.37Å; F301-F429 HydrophobicContact CZ-CG 4.17Å; F301-F429 HydrophobicContact CZ-CZ 4.21Å; F301-I430 WeakPolarHBondContact CD2-O 3.47Å; F301-I430 PolarHBondContact N-O 3.24Å; F301-L431 HydrophobicContact CB-CD2 4.42Å; F301-L431 WeakPolarHBondContact O-CA 3.14Å; F301-N432 PolarHBondContact O-N 2.91Å
302	S	90.6	Very high	88.2	Confident	79 Å²	79	53.7 Å²	53.7	55%	0.552	26%	0.262	S	S	*	.	S	Bend	trans	-79.5	-35.3	172.5	-50.8	0	0	0	0	111.6	E306	S302-E306 VanDerWaalsContact CB-OE2 3.28Å; S302-E306 WeakPolarHBondContact CB-OE2 3.41Å; S302-E306 PolarHBondContact N-OE2 3.37Å; S302-E306 PolarHBondContact OG-OE2 3.27Å
303	D	88.9	Confident	89.1	Confident	69 Å²	69	48.3 Å²	48.3	37%	0.369	24%	0.243	S	C	.	.	S	Bend	trans	-149.8	176.9	179.5	69.7	34.4	0	0	0	113	I305 E306 K307	D303-I305 VanDerWaalsContact C-N 3.3Å; D303-I305 PolarHBondContact O-N 3.3Å; D303-I305 WeakPolarHBondContact OD1-CA 3.31Å; D303-I305 VanDerWaalsContact OD1-CB 3.31Å; D303-I305 WeakPolarHBondContact OD1-CB 3.44Å; D303-I305 PolarHBondContact OD1-N 3.04Å; D303-E306 PolarHBondContact OD1-N 3.26Å; D303-K307 PolarHBondContact O-N 2.78Å
304	W	85.6	Confident	89.8	Confident	70 Å²	70	44.5 Å²	44.5	27%	0.265	22%	0.222	S	C	.	.	H	α-helix	trans	-71.8	-19.7	179.5	-79.7	15.6	0	0	0	114.6	I19 Y308 E332	I19-W304 HydrophobicContact CG2-CH2 3.97Å; I19-W304 HydrophobicContact CG2-CZ3 3.9Å; W304-Y308 PolarHBondContact O-N 3.5Å; W304-E332 HydrophobicContact CH2-CG 3.37Å; W304-E332 WeakPolarHBondContact CH2-OE1 3.4Å; W304-E332 HydrophobicContact CZ2-CG 4.12Å; W304-E332 WeakPolarHBondContact CZ2-OE1 3.38Å; W304-E332 HydrophobicContact CZ3-CG 3.85Å
305	I	87.5	Confident	89.9	Confident	123 Å²	123	45 Å²	45	63%	0.631	22%	0.224	S	C	*	.	H	α-helix	trans	-73	-46.7	179	-59.7	174.6	0	0	0	108.7	D303 K307 Y308 Q309	D303-I305 VanDerWaalsContact C-N 3.3Å; D303-I305 PolarHBondContact O-N 3.3Å; D303-I305 WeakPolarHBondContact OD1-CA 3.31Å; D303-I305 VanDerWaalsContact OD1-CB 3.31Å; D303-I305 WeakPolarHBondContact OD1-CB 3.44Å; D303-I305 PolarHBondContact OD1-N 3.04Å; I305-K307 VanDerWaalsContact C-N 3.28Å; I305-K307 PolarHBondContact O-N 3.29Å; I305-Y308 PolarHBondContact O-N 2.94Å; I305-Q309 PolarHBondContact O-N 3.41Å
306	E	90.7	Very high	89.3	Confident	89 Å²	89	44.5 Å²	44.5	42%	0.416	24%	0.241	S	C	.	.	H	α-helix	trans	-58.4	-43.1	173	-69.3	-177.7	168.6	0	0	111.1	F301 S302 D303 Y308 Q309 A310	F301-E306 HydrophobicContact CB-CB 4.46Å; F301-E306 HydrophobicContact CD1-CB 4.04Å; S302-E306 VanDerWaalsContact CB-OE2 3.28Å; S302-E306 WeakPolarHBondContact CB-OE2 3.41Å; S302-E306 PolarHBondContact N-OE2 3.37Å; S302-E306 PolarHBondContact OG-OE2 3.27Å; D303-E306 PolarHBondContact OD1-N 3.26Å; E306-Y308 PolarHBondContact O-N 3.36Å; E306-Q309 WeakPolarHBondContact O-CB 3.36Å; E306-Q309 PolarHBondContact O-N 2.96Å; E306-Q309 VanDerWaalsContact O-N 3.14Å; E306-A310 PolarHBondContact O-N 3.25Å
307	K	92	Very high	88	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-43.1	176.8	-169	176.6	174.7	170.4	0	112.9	F301 D303 I305 L311 W395 F429	F301-K307 HydrophobicContact CB-CB 4.31Å; F301-K307 HydrophobicContact CD1-CB 4.31Å; F301-K307 HydrophobicContact CD2-CB 3.93Å; F301-K307 HydrophobicContact CD2-CD 4.35Å; F301-K307 HydrophobicContact CD2-CG 3.79Å; F301-K307 HydrophobicContact CE2-CB 4.32Å; F301-K307 HydrophobicContact CE2-CG 3.93Å; F301-K307 HydrophobicContact CG-CB 3.9Å; F301-K307 HydrophobicContact CG-CG 4.29Å; D303-K307 PolarHBondContact O-N 2.78Å; I305-K307 VanDerWaalsContact C-N 3.28Å; I305-K307 PolarHBondContact O-N 3.29Å; K307-L311 PolarHBondContact O-N 3.41Å; K307-L311 VanDerWaalsContact O-N 3.11Å; K307-W395 HydrophobicContact CB-CH2 4.08Å; K307-W395 HydrophobicContact CB-CZ3 4.43Å; K307-W395 HydrophobicContact CD-CD2 4.31Å; K307-W395 HydrophobicContact CD-CE3 4.45Å; K307-W395 HydrophobicContact CD-CH2 4.06Å; K307-W395 HydrophobicContact CD-CZ2 3.9Å; K307-W395 HydrophobicContact CD-CZ3 4.34Å; K307-W395 WeakPolarHBondContact CE-O 3.24Å; K307-W395 HydrophobicContact CG-CD2 4.47Å; K307-W395 HydrophobicContact CG-CE3 4.12Å; K307-W395 HydrophobicContact CG-CH2 3.69Å; K307-W395 HydrophobicContact CG-CZ2 4.08Å; K307-W395 HydrophobicContact CG-CZ3 3.72Å; K307-W395 PolarHBondContact NZ-O 3.2Å; K307-F429 HydrophobicContact CD-CB 4.3Å; K307-F429 HydrophobicContact CD-CD2 4.19Å; K307-F429 HydrophobicContact CG-CB 4.17Å; K307-F429 HydrophobicContact CG-CD2 3.37Å; K307-F429 HydrophobicContact CG-CE2 3.98Å; K307-F429 HydrophobicContact CG-CG 4.13Å; K307-F429 WeakPolarHBondContact O-CE2 3.43Å
308	Y	92.2	Very high	86.4	Confident	19 Å²	19	46.7 Å²	46.7	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-70.6	-36.1	175.1	-173.4	-108.5	0	0	0	112.5	W304 I305 E306 L311 K312 W335 L336 K339 M340 D343 W395	W304-Y308 PolarHBondContact O-N 3.5Å; I305-Y308 PolarHBondContact O-N 2.94Å; E306-Y308 PolarHBondContact O-N 3.36Å; Y308-L311 HydrophobicContact CD2-CD2 4.19Å; Y308-L311 HydrophobicContact CE2-CD2 4.23Å; Y308-L311 WeakPolarHBondContact O-CB 3.47Å; Y308-L311 PolarHBondContact O-N 3.08Å; Y308-K312 HydrophobicContact CD1-CD 4.24Å; Y308-K312 HydrophobicContact CD1-CG 4.48Å; Y308-K312 HydrophobicContact CE1-CD 3.69Å; Y308-K312 HydrophobicContact CE1-CG 4.01Å; Y308-K312 PolarHBondContact O-N 3.26Å; Y308-K312 VanDerWaalsContact O-N 3.11Å; Y308-W335 HydrophobicContact CD2-CH2 4.04Å; Y308-W335 HydrophobicContact CD2-CZ3 4.02Å; Y308-W335 AromaticContact CG-CH2 3.95Å; Y308-W335 HydrophobicContact CG-CH2 3.95Å; Y308-W335 HydrophobicContact CG-CZ3 4.38Å; Y308-L336 HydrophobicContact CD2-CD1 3.74Å; Y308-L336 HydrophobicContact CE2-CD1 3.74Å; Y308-K339 HydrophobicContact CE1-CB 4.26Å; Y308-K339 HydrophobicContact CE2-CB 3.79Å; Y308-K339 WeakPolarHBondContact OH-CB 3.49Å; Y308-K339 PolarHBondContact OH-O 2.97Å; Y308-M340 HydrophobicContact CE2-CG 4.13Å; Y308-M340 PolarHBondContact OH-N 3.06Å; Y308-D343 WeakPolarHBondContact CE1-OD2 3.4Å; Y308-D343 PolarHBondContact OH-OD2 2.81Å; Y308-W395 HydrophobicContact CD2-CH2 4.31Å
309	Q	89.9	Confident	84.8	Confident	84 Å²	84	54.5 Å²	54.5	39%	0.393	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-46	175.1	-175.5	58.2	48.6	0	0	111.2	I305 E306 L311 K312 D313	I305-Q309 PolarHBondContact O-N 3.41Å; E306-Q309 WeakPolarHBondContact O-CB 3.36Å; E306-Q309 PolarHBondContact O-N 2.96Å; E306-Q309 VanDerWaalsContact O-N 3.14Å; Q309-L311 VanDerWaalsContact C-N 3.3Å; Q309-L311 PolarHBondContact O-N 3.42Å; Q309-K312 WeakPolarHBondContact O-CB 3.35Å; Q309-K312 PolarHBondContact O-N 2.89Å; Q309-K312 VanDerWaalsContact O-N 3.09Å; Q309-D313 PolarHBondContact NE2-OD1 3.37Å; Q309-D313 VanDerWaalsContact O-CG 3.23Å; Q309-D313 PolarHBondContact O-N 3.37Å
310	A	90.2	Very high	83.2	Confident	7 Å²	7	53.4 Å²	53.4	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-61.6	-37.1	175.4	0	0	0	0	0	112.9	M299 F301 E306 K312 D313 I314 F429	M299-A310 HydrophobicContact CE-CB 3.61Å; M299-A310 HydrophobicContact SD-CB 4.22Å; F301-A310 HydrophobicContact CE1-CB 3.34Å; F301-A310 HydrophobicContact CZ-CB 3.53Å; E306-A310 PolarHBondContact O-N 3.25Å; A310-K312 VanDerWaalsContact C-N 3.32Å; A310-K312 PolarHBondContact O-N 2.94Å; A310-D313 PolarHBondContact O-N 3.45Å; A310-I314 VanDerWaalsContact O-CG1 3.32Å; A310-I314 WeakPolarHBondContact O-CG1 3.24Å; A310-I314 PolarHBondContact O-N 3.49Å; A310-F429 HydrophobicContact CB-CZ 4.44Å
311	L	91.3	Very high	82.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-57.9	-46.3	172.5	-174.7	65.7	0	0	0	111.5	K307 Y308 Q309 D313 I314 Y315 I325 L336 M340 I393 W395 F429	K307-L311 PolarHBondContact O-N 3.41Å; K307-L311 VanDerWaalsContact O-N 3.11Å; Y308-L311 HydrophobicContact CD2-CD2 4.19Å; Y308-L311 HydrophobicContact CE2-CD2 4.23Å; Y308-L311 WeakPolarHBondContact O-CB 3.47Å; Y308-L311 PolarHBondContact O-N 3.08Å; Q309-L311 VanDerWaalsContact C-N 3.3Å; Q309-L311 PolarHBondContact O-N 3.42Å; L311-D313 VanDerWaalsContact C-N 3.32Å; L311-D313 PolarHBondContact O-N 2.99Å; L311-I314 PolarHBondContact O-N 3.42Å; L311-Y315 HydrophobicContact CD1-CD2 4.03Å; L311-Y315 HydrophobicContact CD1-CE2 3.75Å; L311-Y315 HydrophobicContact CG-CD2 4.14Å; L311-Y315 HydrophobicContact CG-CE2 4.2Å; L311-Y315 WeakPolarHBondContact O-CD2 3.33Å; L311-Y315 PolarHBondContact O-N 3.17Å; L311-I325 HydrophobicContact CD1-CD1 4.07Å; L311-I325 HydrophobicContact CD2-CD1 4.14Å; L311-L336 HydrophobicContact CD2-CD1 3.59Å; L311-L336 HydrophobicContact CD2-CD2 4.33Å; L311-L336 HydrophobicContact CD2-CG 4.42Å; L311-M340 HydrophobicContact CD2-CE 4.42Å; L311-M340 HydrophobicContact CD2-CG 4.48Å; L311-M340 HydrophobicContact CD2-SD 3.95Å; L311-I393 HydrophobicContact CD1-CD1 3.22Å; L311-I393 HydrophobicContact CD1-CG2 4.26Å; L311-W395 HydrophobicContact CB-CZ3 4.2Å; L311-W395 HydrophobicContact CD2-CE3 4.28Å; L311-W395 HydrophobicContact CD2-CZ3 3.97Å; L311-F429 HydrophobicContact CB-CE2 4.13Å; L311-F429 HydrophobicContact CB-CZ 4.42Å; L311-F429 HydrophobicContact CD1-CE2 4.37Å; L311-F429 HydrophobicContact CD1-CZ 4.46Å
312	K	87.3	Confident	81.7	Confident	69 Å²	69	53.8 Å²	53.8	30%	0.3	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-40.5	176.2	-68	-176.7	-64.2	175.6	0	111.8	Y308 Q309 A310 I314 Y315 G316 D343	Y308-K312 HydrophobicContact CD1-CD 4.24Å; Y308-K312 HydrophobicContact CD1-CG 4.48Å; Y308-K312 HydrophobicContact CE1-CD 3.69Å; Y308-K312 HydrophobicContact CE1-CG 4.01Å; Y308-K312 PolarHBondContact O-N 3.26Å; Y308-K312 VanDerWaalsContact O-N 3.11Å; Q309-K312 WeakPolarHBondContact O-CB 3.35Å; Q309-K312 PolarHBondContact O-N 2.89Å; Q309-K312 VanDerWaalsContact O-N 3.09Å; A310-K312 VanDerWaalsContact C-N 3.32Å; A310-K312 PolarHBondContact O-N 2.94Å; K312-I314 VanDerWaalsContact C-N 3.33Å; K312-I314 PolarHBondContact O-N 3Å; K312-Y315 CarbonylContact O-C 3.48Å; K312-Y315 PolarHBondContact O-N 3.14Å; K312-G316 PolarHBondContact O-N 3.48Å; K312-D343 WeakPolarHBondContact CD-OD2 3.32Å
313	D	85	Confident	81.6	Confident	82 Å²	82	50 Å²	50	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-39.5	179.3	-60.5	-20.4	0	0	0	111	Q309 A310 L311 G316 G317	Q309-D313 PolarHBondContact NE2-OD1 3.37Å; Q309-D313 VanDerWaalsContact O-CG 3.23Å; Q309-D313 PolarHBondContact O-N 3.37Å; A310-D313 PolarHBondContact O-N 3.45Å; L311-D313 VanDerWaalsContact C-N 3.32Å; L311-D313 PolarHBondContact O-N 2.99Å; D313-G316 PolarHBondContact O-N 2.95Å; D313-G317 PolarHBondContact O-N 2.97Å
314	I	84.8	Confident	81.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-49.3	172.1	-68.2	168.6	0	0	0	110.5	M299 A310 L311 K312 G316 G317 F318 L391 V427 F429 L457	M299-I314 HydrophobicContact SD-CD1 4Å; A310-I314 VanDerWaalsContact O-CG1 3.32Å; A310-I314 WeakPolarHBondContact O-CG1 3.24Å; A310-I314 PolarHBondContact O-N 3.49Å; L311-I314 PolarHBondContact O-N 3.42Å; K312-I314 VanDerWaalsContact C-N 3.33Å; K312-I314 PolarHBondContact O-N 3Å; I314-G316 VanDerWaalsContact C-N 3.29Å; I314-G316 PolarHBondContact O-N 2.91Å; I314-G317 PolarHBondContact O-N 3.37Å; I314-F318 HydrophobicContact CG2-CD2 4.22Å; I314-F318 WeakPolarHBondContact O-CB 3.28Å; I314-F318 PolarHBondContact O-N 3.09Å; I314-L391 HydrophobicContact CG2-CD2 3.66Å; I314-V427 HydrophobicContact CD1-CG1 4.33Å; I314-F429 HydrophobicContact CD1-CE1 3.8Å; I314-F429 HydrophobicContact CD1-CZ 3.72Å; I314-L457 HydrophobicContact CG1-CD2 4.05Å
315	Y	80.3	Confident	82	Confident	27 Å²	27	43.4 Å²	43.4	11%	0.106	25%	0.246	C	C	.	.	H	α-helix	trans	-69.8	-23.2	178.6	-84.8	-80.5	0	0	0	114.1	L311 K312 V320 A323 I325 M340 V373 I393	L311-Y315 HydrophobicContact CD1-CD2 4.03Å; L311-Y315 HydrophobicContact CD1-CE2 3.75Å; L311-Y315 HydrophobicContact CG-CD2 4.14Å; L311-Y315 HydrophobicContact CG-CE2 4.2Å; L311-Y315 WeakPolarHBondContact O-CD2 3.33Å; L311-Y315 PolarHBondContact O-N 3.17Å; K312-Y315 CarbonylContact O-C 3.48Å; K312-Y315 PolarHBondContact O-N 3.14Å; Y315-V320 HydrophobicContact CD1-CB 4.1Å; Y315-V320 HydrophobicContact CD1-CG1 4.44Å; Y315-V320 HydrophobicContact CD1-CG2 3.77Å; Y315-V320 HydrophobicContact CE1-CB 4.07Å; Y315-V320 HydrophobicContact CE1-CG1 3.92Å; Y315-V320 HydrophobicContact CE1-CG2 4.06Å; Y315-V320 HydrophobicContact CG-CG2 4.37Å; Y315-A323 WeakPolarHBondContact OH-CB 3.47Å; Y315-I325 HydrophobicContact CE2-CD1 4.27Å; Y315-M340 HydrophobicContact CD2-CE 4.02Å; Y315-M340 HydrophobicContact CE2-CE 3.65Å; Y315-V373 HydrophobicContact CE1-CG2 3.42Å; Y315-V373 VanDerWaalsContact CE1-CG2 3.42Å; Y315-V373 VanDerWaalsContact OH-CG1 3.24Å; Y315-V373 WeakPolarHBondContact OH-CG1 3.3Å; Y315-V373 WeakPolarHBondContact OH-CG2 3.44Å; Y315-I393 HydrophobicContact CE2-CD1 4.11Å
316	G	73.7	Confident	82.2	Confident	70 Å²	70	37.7 Å²	37.7	72%	0.722	22%	0.216	S	C	*	.	H	α-helix	trans	-82.8	-30.2	175.7	0	0	0	0	0	113.6	K312 D313 I314	K312-G316 PolarHBondContact O-N 3.48Å; D313-G316 PolarHBondContact O-N 2.95Å; I314-G316 VanDerWaalsContact C-N 3.29Å; I314-G316 PolarHBondContact O-N 2.91Å
317	G	63.5	Low	82.3	Confident	50 Å²	50	33.4 Å²	33.4	52%	0.515	20%	0.196	S	C	.	.	H	α-helix	trans	-90.3	-30	-179.2	0	0	0	0	0	114.6	D313 I314	D313-G317 PolarHBondContact O-N 2.97Å; I314-G317 PolarHBondContact O-N 3.37Å
318	F	62.1	Low	82.1	Confident	29 Å²	29	35.3 Å²	35.3	13%	0.127	21%	0.212	C	C	.	.	S	Bend	trans	-91.2	142.9	179.7	-96.2	-109.4	0	0	0	112.3	I314 V320 V425 L457 F460	I314-F318 HydrophobicContact CG2-CD2 4.22Å; I314-F318 WeakPolarHBondContact O-CB 3.28Å; I314-F318 PolarHBondContact O-N 3.09Å; F318-V320 HydrophobicContact CB-CB 4.22Å; F318-V320 HydrophobicContact CB-CG2 3.2Å; F318-V320 HydrophobicContact CD1-CG2 4.37Å; F318-V320 HydrophobicContact CG-CG2 4.02Å; F318-V320 PolarHBondContact O-N 2.87Å; F318-V425 HydrophobicContact CZ-CG2 4.48Å; F318-L457 HydrophobicContact CD2-CD2 4.42Å; F318-L457 HydrophobicContact CE2-CD2 4.1Å; F318-F460 HydrophobicContact CD1-CB 4.08Å; F318-F460 HydrophobicContact CD2-CB 4.42Å; F318-F460 HydrophobicContact CE1-CB 3.32Å; F318-F460 HydrophobicContact CE1-CD2 4.37Å; F318-F460 AromaticContact CE1-CG 3.93Å; F318-F460 HydrophobicContact CE1-CG 3.93Å; F318-F460 HydrophobicContact CE2-CB 3.71Å; F318-F460 AromaticContact CE2-CD2 3.55Å; F318-F460 HydrophobicContact CE2-CD2 3.55Å; F318-F460 AromaticContact CE2-CG 3.93Å; F318-F460 HydrophobicContact CE2-CG 3.93Å; F318-F460 HydrophobicContact CZ-CB 3.12Å; F318-F460 HydrophobicContact CZ-CD1 4.23Å; F318-F460 AromaticContact CZ-CD2 3.33Å; F318-F460 HydrophobicContact CZ-CD2 3.33Å; F318-F460 HydrophobicContact CZ-CE2 4.32Å; F318-F460 AromaticContact CZ-CG 3.29Å; F318-F460 HydrophobicContact CZ-CG 3.29Å
319	E	61	Low	81.7	Confident	195 Å²	195	37.3 Å²	37.3	91%	0.911	23%	0.227	S	C	*	.			trans	-70.4	70.6	146.1	-74.7	-166.4	168.6	0	0	108.8	G321	E319-G321 PolarHBondContact O-N 2.85Å
320	V	62.8	Low	81.4	Confident	9 Å²	9	38.6 Å²	38.6	6%	0.055	23%	0.228	C	C	.	.			trans	-64.6	118.5	179.8	-169.7	0	0	0	0	107	Y315 F318 A323 R372 L391	Y315-V320 HydrophobicContact CD1-CB 4.1Å; Y315-V320 HydrophobicContact CD1-CG1 4.44Å; Y315-V320 HydrophobicContact CD1-CG2 3.77Å; Y315-V320 HydrophobicContact CE1-CB 4.07Å; Y315-V320 HydrophobicContact CE1-CG1 3.92Å; Y315-V320 HydrophobicContact CE1-CG2 4.06Å; Y315-V320 HydrophobicContact CG-CG2 4.37Å; F318-V320 HydrophobicContact CB-CB 4.22Å; F318-V320 HydrophobicContact CB-CG2 3.2Å; F318-V320 HydrophobicContact CD1-CG2 4.37Å; F318-V320 HydrophobicContact CG-CG2 4.02Å; F318-V320 PolarHBondContact O-N 2.87Å; V320-A323 HydrophobicContact CG1-CB 3.78Å; V320-R372 PolarHBondContact O-NH1 2.86Å; V320-L391 HydrophobicContact CG1-CB 4.18Å; V320-L391 HydrophobicContact CG1-CD2 3.88Å; V320-L391 HydrophobicContact CG2-CD2 4.12Å
321	G	73.7	Confident	81.3	Confident	25 Å²	25	44.5 Å²	44.5	26%	0.258	25%	0.254	S	S	.	.			trans	-66.6	-119.5	167.1	0	0	0	0	0	110	E319 R372	E319-G321 PolarHBondContact O-N 2.85Å; G321-R372 WeakPolarHBondContact O-CB 3.41Å
322	Q	83.4	Confident	81.2	Confident	30 Å²	30	45 Å²	45	14%	0.14	26%	0.257	C	S	.	.	S	Bend	trans	-93.3	142.2	169.9	-71.4	161.7	-50.9	0	0	109.7	F366 S369 R372 V389 N390	Q322-F366 HydrophobicContact CB-CE2 4.08Å; Q322-F366 HydrophobicContact CB-CZ 3.82Å; Q322-F366 HydrophobicContact CG-CE2 4.26Å; Q322-F366 HydrophobicContact CG-CZ 4.37Å; Q322-F366 PolarHBondContact NE2-O 3.48Å; Q322-S369 PolarHBondContact NE2-OG 3.13Å; Q322-R372 CarbonylContact C-O 3.54Å; Q322-R372 VanDerWaalsContact CA-O 3.31Å; Q322-R372 WeakPolarHBondContact CA-O 3.42Å; Q322-V389 HydrophobicContact CB-CG1 3.91Å; Q322-V389 WeakPolarHBondContact O-CB 3.37Å; Q322-N390 PolarHBondContact O-N 3.45Å; Q322-N390 VanDerWaalsContact O-N 3.09Å
323	A	88.4	Confident	81.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.8	179.7	0	0	0	0	0	112.2	Y315 V320 R372 V373 L374 L391	Y315-A323 WeakPolarHBondContact OH-CB 3.47Å; V320-A323 HydrophobicContact CG1-CB 3.78Å; A323-R372 PolarHBondContact N-O 3.28Å; A323-V373 WeakPolarHBondContact O-CA 3.3Å; A323-L374 PolarHBondContact O-N 3.29Å; A323-L391 WeakPolarHBondContact CA-O 3.27Å; A323-L391 HydrophobicContact CB-CB 4.02Å; A323-L391 HydrophobicContact CB-CD2 4.35Å; A323-L391 HydrophobicContact CB-CG 4.37Å
324	I	90.1	Very high	81.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.4	171.7	-54.5	170.3	0	0	0	108.9	F326 F366 L374 T376 I386 V389 L391 I393	I324-F326 HydrophobicContact CB-CE2 4.02Å; I324-F326 HydrophobicContact CB-CZ 4.16Å; I324-F326 HydrophobicContact CD1-CZ 4.48Å; I324-F326 HydrophobicContact CG2-CD1 4.3Å; I324-F326 HydrophobicContact CG2-CD2 4.09Å; I324-F326 HydrophobicContact CG2-CE1 3.79Å; I324-F326 HydrophobicContact CG2-CE2 3.58Å; I324-F326 HydrophobicContact CG2-CG 4.43Å; I324-F326 HydrophobicContact CG2-CZ 3.41Å; I324-F326 VanDerWaalsContact CG2-CZ 3.41Å; I324-F366 HydrophobicContact CG1-CE1 4.32Å; I324-F366 HydrophobicContact CG1-CZ 4.18Å; I324-L374 CarbonylContact C-O 3.58Å; I324-L374 VanDerWaalsContact CA-O 3.3Å; I324-L374 WeakPolarHBondContact CA-O 3.47Å; I324-L374 HydrophobicContact CG1-CB 4.43Å; I324-T376 HydrophobicContact CG2-CG2 3.83Å; I324-I386 HydrophobicContact CD1-CB 3.93Å; I324-I386 HydrophobicContact CD1-CD1 4.02Å; I324-I386 HydrophobicContact CD1-CG2 3.51Å; I324-I386 HydrophobicContact CG1-CG2 4.33Å; I324-V389 HydrophobicContact CD1-CG1 3.92Å; I324-V389 HydrophobicContact CD1-CG2 3.87Å; I324-V389 HydrophobicContact CG1-CB 4.37Å; I324-V389 HydrophobicContact CG1-CG1 3.7Å; I324-V389 HydrophobicContact CG1-CG2 3.99Å; I324-L391 PolarHBondContact N-O 3.31Å; I324-L391 VanDerWaalsContact N-O 3.1Å; I324-I393 PolarHBondContact O-N 2.81Å
325	I	92.5	Very high	82	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.9	174	-50	179.7	0	0	0	109	L311 Y315 L336 M340 V373 L374 I375 T376 I393 W395	L311-I325 HydrophobicContact CD1-CD1 4.07Å; L311-I325 HydrophobicContact CD2-CD1 4.14Å; Y315-I325 HydrophobicContact CE2-CD1 4.27Å; I325-L336 HydrophobicContact CB-CD2 4.33Å; I325-L336 HydrophobicContact CD1-CD2 3.98Å; I325-L336 HydrophobicContact CG2-CD2 3.66Å; I325-M340 HydrophobicContact CD1-CE 4.13Å; I325-M340 HydrophobicContact CD1-SD 3.71Å; I325-V373 HydrophobicContact CD1-CG1 3.65Å; I325-V373 HydrophobicContact CG1-CG1 3.95Å; I325-L374 PolarHBondContact N-O 3.4Å; I325-I375 HydrophobicContact CB-CG1 4.36Å; I325-I375 HydrophobicContact CD1-CG1 4.45Å; I325-I375 WeakPolarHBondContact O-CA 3.36Å; I325-T376 PolarHBondContact O-N 2.79Å; I325-I393 CarbonylContact C-O 3.58Å; I325-I393 WeakPolarHBondContact CA-O 3.42Å; I325-I393 HydrophobicContact CG1-CB 4.19Å; I325-I393 HydrophobicContact CG1-CD1 4.39Å; I325-I393 HydrophobicContact CG2-CB 4.3Å; I325-I393 HydrophobicContact CG2-CG2 4.31Å; I325-W395 HydrophobicContact CG2-CB 3.58Å; I325-W395 HydrophobicContact CG2-CG 4.46Å
326	F	92.3	Very high	82.6	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.013	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	114	-179.5	-64.1	-81	0	0	0	111.6	I324 T376 S381 I392 I393 W395 N396 R413	I324-F326 HydrophobicContact CB-CE2 4.02Å; I324-F326 HydrophobicContact CB-CZ 4.16Å; I324-F326 HydrophobicContact CD1-CZ 4.48Å; I324-F326 HydrophobicContact CG2-CD1 4.3Å; I324-F326 HydrophobicContact CG2-CD2 4.09Å; I324-F326 HydrophobicContact CG2-CE1 3.79Å; I324-F326 HydrophobicContact CG2-CE2 3.58Å; I324-F326 HydrophobicContact CG2-CG 4.43Å; I324-F326 HydrophobicContact CG2-CZ 3.41Å; I324-F326 VanDerWaalsContact CG2-CZ 3.41Å; F326-T376 WeakPolarHBondContact CA-O 3.21Å; F326-T376 HydrophobicContact CD1-CG2 3.5Å; F326-T376 HydrophobicContact CE1-CG2 3.54Å; F326-T376 HydrophobicContact CG-CG2 4.44Å; F326-S381 WeakPolarHBondContact CD1-OG 3.39Å; F326-S381 VanDerWaalsContact CE1-CB 3.47Å; F326-S381 VanDerWaalsContact CE1-OG 3.29Å; F326-S381 WeakPolarHBondContact CE1-OG 3.36Å; F326-I392 HydrophobicContact CD2-CG2 3.92Å; F326-I392 HydrophobicContact CE2-CG2 3.66Å; F326-I393 PolarHBondContact N-O 3.39Å; F326-W395 WeakPolarHBondContact O-CA 3.46Å; F326-W395 VanDerWaalsContact O-CB 3.31Å; F326-W395 WeakPolarHBondContact O-CB 3.3Å; F326-W395 PolarHBondContact O-N 2.89Å; F326-N396 PolarHBondContact O-N 2.78Å; F326-R413 VanDerWaalsContact CB-NH1 3.32Å; F326-R413 HydrophobicContact CD1-CG 3.96Å; F326-R413 HydrophobicContact CD2-CB 4.25Å; F326-R413 HydrophobicContact CD2-CG 3.99Å; F326-R413 HydrophobicContact CE1-CG 3.75Å; F326-R413 HydrophobicContact CE2-CB 3.76Å; F326-R413 HydrophobicContact CE2-CG 3.76Å; F326-R413 HydrophobicContact CG-CG 4.08Å; F326-R413 HydrophobicContact CZ-CB 3.93Å; F326-R413 HydrophobicContact CZ-CG 3.64Å
327	C	91.8	Very high	83.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	149	176.9	-58	0	0	0	0	111.3	E332 A333 T376 T377 N378 N396	C327-E332 HydrophobicContact CB-CB 4.18Å; C327-A333 HydrophobicContact CB-CB 4.15Å; C327-T376 PolarHBondContact N-O 3.23Å; C327-T377 VanDerWaalsContact O-CA 3.3Å; C327-T377 WeakPolarHBondContact O-CA 3.45Å; C327-N378 PolarHBondContact O-N 3.21Å; C327-N378 PolarHBondContact O-OD1 3.26Å; C327-N396 WeakPolarHBondContact CA-OD1 3.36Å
328	A	87	Confident	84.9	Confident	41 Å²	41	40.5 Å²	40.5	34%	0.339	22%	0.215	S	C	.	.	S	Bend	trans	-70.5	-43.8	176	0	0	0	0	0	111.1	N396	A328-N396 HydrophobicContact CB-CB 3.68Å; A328-N396 PolarHBondContact N-OD1 3.07Å
329	T	85.4	Confident	86.3	Confident	61 Å²	61	41.7 Å²	41.7	37%	0.374	22%	0.22	S	C	.	.	S	Bend	trans	-118.4	155.1	-175.8	70.3	0	0	0	0	112.9	Q331 E332 A333	T329-Q331 VanDerWaalsContact C-N 3.28Å; T329-Q331 PolarHBondContact O-N 3.12Å; T329-E332 WeakPolarHBondContact CB-OE2 3.06Å; T329-E332 PolarHBondContact N-OE2 3.19Å; T329-E332 PolarHBondContact O-N 2.81Å; T329-E332 WeakPolarHBondContact OG1-CB 3.4Å; T329-E332 VanDerWaalsContact OG1-CG 3.26Å; T329-E332 WeakPolarHBondContact OG1-CG 3.35Å; T329-E332 PolarHBondContact OG1-N 2.79Å; T329-E332 VanDerWaalsContact OG1-N 3.15Å; T329-E332 PolarHBondContact OG1-OE2 3.49Å; T329-A333 PolarHBondContact O-N 2.83Å; T329-A333 VanDerWaalsContact O-N 3.07Å
330	R	83.9	Confident	87.7	Confident	110 Å²	110	32.5 Å²	32.5	42%	0.415	18%	0.178	S	C	.	.	H	α-helix	trans	-62.6	-35.4	171.5	-177.2	179.7	169.8	178.1	2.9	112.3	A333 S334 D353 T377	R330-A333 PolarHBondContact O-N 2.93Å; R330-S334 WeakPolarHBondContact O-CB 3.48Å; R330-S334 PolarHBondContact O-N 2.87Å; R330-S334 PolarHBondContact O-OG 2.81Å; R330-D353 VanDerWaalsContact CZ-CG 3.4Å; R330-D353 IonicContact CZ-OD1 3.75Å; R330-D353 IonicContact CZ-OD2 3.36Å; R330-D353 VanDerWaalsContact NH1-CG 3.33Å; R330-D353 IonicContact NH1-OD1 3.73Å; R330-D353 IonicContact NH1-OD2 2.63Å; R330-D353 PolarHBondContact NH1-OD2 3.18Å; R330-D353 VanDerWaalsContact NH2-CG 3.3Å; R330-D353 IonicContact NH2-OD1 3.85Å; R330-D353 IonicContact NH2-OD2 3.62Å; R330-D353 PolarHBondContact NH2-OD2 3.27Å; R330-T377 HydrophobicContact CB-CG2 4.49Å
331	Q	87.7	Confident	89	Confident	132 Å²	132	35.6 Å²	35.6	62%	0.617	19%	0.194	S	C	*	.	H	α-helix	trans	-63.3	-43.5	179	-65	-177.2	30.6	0	0	111	T329 S334 W335	T329-Q331 VanDerWaalsContact C-N 3.28Å; T329-Q331 PolarHBondContact O-N 3.12Å; Q331-S334 PolarHBondContact O-N 3.24Å; Q331-W335 VanDerWaalsContact O-CB 3.32Å; Q331-W335 WeakPolarHBondContact O-CB 3.29Å; Q331-W335 PolarHBondContact O-N 3.1Å
332	E	89.3	Confident	89.8	Confident	12 Å²	12	41 Å²	41	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-44.2	172.7	-73.4	165.8	125.1	0	0	111.9	W304 C327 T329 S334 W335 L336 N396	W304-E332 HydrophobicContact CH2-CG 3.37Å; W304-E332 WeakPolarHBondContact CH2-OE1 3.4Å; W304-E332 HydrophobicContact CZ2-CG 4.12Å; W304-E332 WeakPolarHBondContact CZ2-OE1 3.38Å; W304-E332 HydrophobicContact CZ3-CG 3.85Å; C327-E332 HydrophobicContact CB-CB 4.18Å; T329-E332 WeakPolarHBondContact CB-OE2 3.06Å; T329-E332 PolarHBondContact N-OE2 3.19Å; T329-E332 PolarHBondContact O-N 2.81Å; T329-E332 WeakPolarHBondContact OG1-CB 3.4Å; T329-E332 VanDerWaalsContact OG1-CG 3.26Å; T329-E332 WeakPolarHBondContact OG1-CG 3.35Å; T329-E332 PolarHBondContact OG1-N 2.79Å; T329-E332 VanDerWaalsContact OG1-N 3.15Å; T329-E332 PolarHBondContact OG1-OE2 3.49Å; E332-S334 PolarHBondContact O-N 3.48Å; E332-W335 PolarHBondContact O-N 2.84Å; E332-L336 VanDerWaalsContact O-CB 3.27Å; E332-L336 WeakPolarHBondContact O-CB 3.11Å; E332-L336 PolarHBondContact O-N 3Å; E332-N396 PolarHBondContact OE1-ND2 3.01Å; E332-N396 PolarHBondContact OE1-OD1 3.4Å; E332-N396 PolarHBondContact OE2-OD1 3.44Å
333	A	90.6	Very high	90	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-47	177.1	0	0	0	0	0	112.1	C327 T329 R330 L336 D337 I349 I375 T377	C327-A333 HydrophobicContact CB-CB 4.15Å; T329-A333 PolarHBondContact O-N 2.83Å; T329-A333 VanDerWaalsContact O-N 3.07Å; R330-A333 PolarHBondContact O-N 2.93Å; A333-L336 PolarHBondContact O-N 3.43Å; A333-D337 WeakPolarHBondContact O-CB 3.41Å; A333-D337 PolarHBondContact O-N 3.11Å; A333-I349 HydrophobicContact CB-CD1 4.48Å; A333-I349 HydrophobicContact CB-CG2 4.4Å; A333-I375 HydrophobicContact CB-CG2 3.7Å; A333-T377 HydrophobicContact CB-CG2 4.37Å
334	S	91.3	Very high	89.9	Confident	54 Å²	54	46.7 Å²	46.7	38%	0.378	26%	0.263	S	S	.	.	H	α-helix	trans	-63.2	-40.9	175.6	-68.8	0	0	0	0	112.9	R330 Q331 E332 L336 G338	R330-S334 WeakPolarHBondContact O-CB 3.48Å; R330-S334 PolarHBondContact O-N 2.87Å; R330-S334 PolarHBondContact O-OG 2.81Å; Q331-S334 PolarHBondContact O-N 3.24Å; E332-S334 PolarHBondContact O-N 3.48Å; S334-L336 VanDerWaalsContact C-N 3.34Å; S334-G338 PolarHBondContact O-N 2.58Å
335	W	92.3	Very high	89.7	Confident	75 Å²	75	49.4 Å²	49.4	28%	0.284	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-44.8	175.7	176.8	89.7	0	0	0	111.1	Y308 Q331 E332 G338 K339 W395	Y308-W335 HydrophobicContact CD2-CH2 4.04Å; Y308-W335 HydrophobicContact CD2-CZ3 4.02Å; Y308-W335 AromaticContact CG-CH2 3.95Å; Y308-W335 HydrophobicContact CG-CH2 3.95Å; Y308-W335 HydrophobicContact CG-CZ3 4.38Å; Q331-W335 VanDerWaalsContact O-CB 3.32Å; Q331-W335 WeakPolarHBondContact O-CB 3.29Å; Q331-W335 PolarHBondContact O-N 3.1Å; E332-W335 PolarHBondContact O-N 2.84Å; W335-G338 PolarHBondContact O-N 2.94Å; W335-K339 HydrophobicContact CD2-CG 4.15Å; W335-K339 HydrophobicContact CE3-CG 4.49Å; W335-K339 HydrophobicContact CH2-CG 4.24Å; W335-K339 HydrophobicContact CZ2-CG 3.88Å; W335-K339 WeakPolarHBondContact O-CG 3.49Å; W335-K339 PolarHBondContact O-N 2.82Å; W335-W395 HydrophobicContact CZ3-CH2 4.14Å; W335-W395 AromaticContact CZ3-CZ2 3.94Å; W335-W395 HydrophobicContact CZ3-CZ2 3.94Å
336	L	92.8	Very high	89.4	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-43.3	-179.2	-171.7	66	0	0	0	111.6	Y308 L311 I325 E332 A333 S334 G338 K339 M340 I375 W395	Y308-L336 HydrophobicContact CD2-CD1 3.74Å; Y308-L336 HydrophobicContact CE2-CD1 3.74Å; L311-L336 HydrophobicContact CD2-CD1 3.59Å; L311-L336 HydrophobicContact CD2-CD2 4.33Å; L311-L336 HydrophobicContact CD2-CG 4.42Å; I325-L336 HydrophobicContact CB-CD2 4.33Å; I325-L336 HydrophobicContact CD1-CD2 3.98Å; I325-L336 HydrophobicContact CG2-CD2 3.66Å; E332-L336 VanDerWaalsContact O-CB 3.27Å; E332-L336 WeakPolarHBondContact O-CB 3.11Å; E332-L336 PolarHBondContact O-N 3Å; A333-L336 PolarHBondContact O-N 3.43Å; S334-L336 VanDerWaalsContact C-N 3.34Å; L336-G338 PolarHBondContact O-N 3.33Å; L336-K339 PolarHBondContact O-N 3.47Å; L336-M340 HydrophobicContact CD1-CG 4.16Å; L336-M340 HydrophobicContact CD1-SD 4.23Å; L336-M340 HydrophobicContact CD2-SD 4.34Å; L336-M340 HydrophobicContact CG-CG 4.23Å; L336-M340 HydrophobicContact CG-SD 3.95Å; L336-M340 WeakPolarHBondContact O-CB 3.45Å; L336-M340 VanDerWaalsContact O-CG 3.3Å; L336-M340 WeakPolarHBondContact O-CG 3.05Å; L336-M340 PolarHBondContact O-N 2.98Å; L336-I375 HydrophobicContact CB-CD1 4.16Å; L336-I375 HydrophobicContact CD2-CD1 4.01Å; L336-I375 HydrophobicContact CD2-CG1 4.32Å; L336-I375 HydrophobicContact CD2-CG2 4.46Å; L336-I375 HydrophobicContact CG-CD1 3.94Å; L336-W395 HydrophobicContact CD1-CE3 4.47Å; L336-W395 HydrophobicContact CD1-CH2 4.32Å; L336-W395 HydrophobicContact CD1-CZ3 4.22Å; L336-W395 HydrophobicContact CD2-CD2 4.46Å; L336-W395 HydrophobicContact CD2-CE3 4.47Å
337	D	92.4	Very high	89.2	Confident	42 Å²	42	55 Å²	55	23%	0.225	30%	0.301	C	S	.	.	H	α-helix	trans	-55.3	-49.7	172.9	172.8	77.1	0	0	0	111.8	A333 K339 M340 N341 V347 I349 I375	A333-D337 WeakPolarHBondContact O-CB 3.41Å; A333-D337 PolarHBondContact O-N 3.11Å; D337-K339 PolarHBondContact O-N 3.49Å; D337-M340 PolarHBondContact O-N 2.93Å; D337-N341 VanDerWaalsContact O-CB 3.31Å; D337-N341 WeakPolarHBondContact O-CB 3.48Å; D337-N341 PolarHBondContact O-N 3.12Å; D337-N341 PolarHBondContact O-ND2 3.18Å; D337-N341 PolarHBondContact OD1-ND2 2.85Å; D337-V347 HydrophobicContact CB-CG2 4.25Å; D337-V347 VanDerWaalsContact OD1-CG2 3.28Å; D337-V347 WeakPolarHBondContact OD1-CG2 2.91Å; D337-I349 HydrophobicContact CB-CD1 3.53Å; D337-I349 HydrophobicContact CB-CG1 3.74Å; D337-I375 HydrophobicContact CB-CD1 4.05Å
338	G	92.4	Very high	89.2	Confident	32 Å²	32	59.8 Å²	59.8	33%	0.33	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-44.3	177.9	0	0	0	0	0	112.6	S334 W335 L336 L342	S334-G338 PolarHBondContact O-N 2.58Å; W335-G338 PolarHBondContact O-N 2.94Å; L336-G338 PolarHBondContact O-N 3.33Å; G338-L342 VanDerWaalsContact O-CG 3.24Å; G338-L342 WeakPolarHBondContact O-CG 3.37Å; G338-L342 PolarHBondContact O-N 2.72Å; G338-L342 VanDerWaalsContact O-N 3.1Å
339	K	91.5	Very high	89.4	Confident	54 Å²	54	59.2 Å²	59.2	24%	0.235	31%	0.31	C	S	.	.	H	α-helix	trans	-67.3	-46.7	179.5	-74.3	-65.9	-174.7	-177	0	112.8	Y308 W335 L336 D337 N341 L342 D343	Y308-K339 HydrophobicContact CE1-CB 4.26Å; Y308-K339 HydrophobicContact CE2-CB 3.79Å; Y308-K339 WeakPolarHBondContact OH-CB 3.49Å; Y308-K339 PolarHBondContact OH-O 2.97Å; W335-K339 HydrophobicContact CD2-CG 4.15Å; W335-K339 HydrophobicContact CE3-CG 4.49Å; W335-K339 HydrophobicContact CH2-CG 4.24Å; W335-K339 HydrophobicContact CZ2-CG 3.88Å; W335-K339 WeakPolarHBondContact O-CG 3.49Å; W335-K339 PolarHBondContact O-N 2.82Å; L336-K339 PolarHBondContact O-N 3.47Å; D337-K339 PolarHBondContact O-N 3.49Å; K339-N341 PolarHBondContact O-N 3.03Å; K339-L342 WeakPolarHBondContact O-CB 3.24Å; K339-L342 PolarHBondContact O-N 2.85Å; K339-D343 PolarHBondContact O-N 3.3Å
340	M	91.2	Very high	89.4	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-38.8	179.6	-70.1	-170.7	78.5	0	0	111.9	Y308 L311 Y315 I325 L336 D337 D343 G344 H345 V347 V373 I375	Y308-M340 HydrophobicContact CE2-CG 4.13Å; Y308-M340 PolarHBondContact OH-N 3.06Å; L311-M340 HydrophobicContact CD2-CE 4.42Å; L311-M340 HydrophobicContact CD2-CG 4.48Å; L311-M340 HydrophobicContact CD2-SD 3.95Å; Y315-M340 HydrophobicContact CD2-CE 4.02Å; Y315-M340 HydrophobicContact CE2-CE 3.65Å; I325-M340 HydrophobicContact CD1-CE 4.13Å; I325-M340 HydrophobicContact CD1-SD 3.71Å; L336-M340 HydrophobicContact CD1-CG 4.16Å; L336-M340 HydrophobicContact CD1-SD 4.23Å; L336-M340 HydrophobicContact CD2-SD 4.34Å; L336-M340 HydrophobicContact CG-CG 4.23Å; L336-M340 HydrophobicContact CG-SD 3.95Å; L336-M340 WeakPolarHBondContact O-CB 3.45Å; L336-M340 VanDerWaalsContact O-CG 3.3Å; L336-M340 WeakPolarHBondContact O-CG 3.05Å; L336-M340 PolarHBondContact O-N 2.98Å; D337-M340 PolarHBondContact O-N 2.93Å; M340-D343 CarbonylContact O-C 3.59Å; M340-D343 PolarHBondContact O-N 2.97Å; M340-G344 PolarHBondContact O-N 3.16Å; M340-H345 HydrophobicContact CB-CB 4.2Å; M340-H345 HydrophobicContact CE-CB 4.25Å; M340-H345 WeakPolarHBondContact O-CB 3.28Å; M340-H345 PolarHBondContact O-N 2.84Å; M340-V347 HydrophobicContact CB-CG1 3.77Å; M340-V347 HydrophobicContact CB-CG2 4.03Å; M340-V347 HydrophobicContact CE-CG1 3.91Å; M340-V347 HydrophobicContact SD-CG1 4.04Å; M340-V373 HydrophobicContact CE-CG1 4.09Å; M340-V373 HydrophobicContact CE-CG2 4.26Å; M340-V373 HydrophobicContact SD-CG1 4.41Å; M340-I375 HydrophobicContact SD-CD1 4.23Å
341	N	89.6	Confident	89.3	Confident	73 Å²	73	51.3 Å²	51.3	39%	0.39	28%	0.275	S	S	.	.	H	α-helix	trans	-63.3	-39.6	173.4	-82.4	-67.9	0	0	0	112.2	D337 K339 D343 G344 H345	D337-N341 VanDerWaalsContact O-CB 3.31Å; D337-N341 WeakPolarHBondContact O-CB 3.48Å; D337-N341 PolarHBondContact O-N 3.12Å; D337-N341 PolarHBondContact O-ND2 3.18Å; D337-N341 PolarHBondContact OD1-ND2 2.85Å; K339-N341 PolarHBondContact O-N 3.03Å; N341-D343 VanDerWaalsContact C-N 3.3Å; N341-D343 PolarHBondContact O-N 2.9Å; N341-G344 PolarHBondContact O-N 3.11Å; N341-G344 VanDerWaalsContact O-N 3.09Å; N341-H345 WeakPolarHBondContact CA-O 2.84Å; N341-H345 PolarHBondContact OD1-O 3.44Å
342	L	90.7	Very high	88.6	Confident	140 Å²	140	45.7 Å²	45.7	73%	0.733	25%	0.252	S	S	*	.	H	α-helix	trans	-63.6	-35.8	175.2	-76	169.5	0	0	0	112.5	G338 K339 G344	G338-L342 VanDerWaalsContact O-CG 3.24Å; G338-L342 WeakPolarHBondContact O-CG 3.37Å; G338-L342 PolarHBondContact O-N 2.72Å; G338-L342 VanDerWaalsContact O-N 3.1Å; K339-L342 WeakPolarHBondContact O-CB 3.24Å; K339-L342 PolarHBondContact O-N 2.85Å; L342-G344 PolarHBondContact O-N 3.41Å
343	D	87.5	Confident	88.1	Confident	80 Å²	80	49.1 Å²	49.1	43%	0.428	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	4.2	175.6	-68.1	-19.7	0	0	0	112.8	Y308 K312 K339 M340 N341	Y308-D343 WeakPolarHBondContact CE1-OD2 3.4Å; Y308-D343 PolarHBondContact OH-OD2 2.81Å; K312-D343 WeakPolarHBondContact CD-OD2 3.32Å; K339-D343 PolarHBondContact O-N 3.3Å; M340-D343 CarbonylContact O-C 3.59Å; M340-D343 PolarHBondContact O-N 2.97Å; N341-D343 VanDerWaalsContact C-N 3.3Å; N341-D343 PolarHBondContact O-N 2.9Å
344	G	85.6	Confident	87.7	Confident	68 Å²	68	50.6 Å²	50.6	70%	0.701	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	5.8	173.7	0	0	0	0	0	115.1	M340 N341 L342	M340-G344 PolarHBondContact O-N 3.16Å; N341-G344 PolarHBondContact O-N 3.11Å; N341-G344 VanDerWaalsContact O-N 3.09Å; L342-G344 PolarHBondContact O-N 3.41Å
345	H	85.4	Confident	87.3	Confident	58 Å²	58	51.7 Å²	51.7	27%	0.269	28%	0.28	S	S	.	.			trans	-83.3	123.9	174.1	-59.5	-76.8	0	0	0	110.4	M340 N341 V347	M340-H345 HydrophobicContact CB-CB 4.2Å; M340-H345 HydrophobicContact CE-CB 4.25Å; M340-H345 WeakPolarHBondContact O-CB 3.28Å; M340-H345 PolarHBondContact O-N 2.84Å; N341-H345 WeakPolarHBondContact CA-O 2.84Å; N341-H345 PolarHBondContact OD1-O 3.44Å; H345-V347 HydrophobicContact CB-CG1 3.87Å; H345-V347 PolarHBondContact O-N 3.25Å
346	K	86	Confident	86.6	Confident	117 Å²	117	50 Å²	50	51%	0.509	28%	0.278	S	S	.	.			trans	-77.7	107.4	172.7	-162.2	-179.4	-179.3	-164.9	0	109.2	Y348 N370 F371	K346-Y348 HydrophobicContact CG-CE2 4.36Å; K346-N370 WeakPolarHBondContact CD-O 3.06Å; K346-N370 PolarHBondContact NZ-O 2.85Å; K346-F371 HydrophobicContact CB-CB 4.44Å; K346-F371 HydrophobicContact CD-CB 4.29Å; K346-F371 HydrophobicContact CG-CB 4.12Å
347	V	90.1	Very high	86.1	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.024	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.5	-177	-45.5	0	0	0	0	110.2	D337 M340 H345 V373 I375	D337-V347 HydrophobicContact CB-CG2 4.25Å; D337-V347 VanDerWaalsContact OD1-CG2 3.28Å; D337-V347 WeakPolarHBondContact OD1-CG2 2.91Å; M340-V347 HydrophobicContact CB-CG1 3.77Å; M340-V347 HydrophobicContact CB-CG2 4.03Å; M340-V347 HydrophobicContact CE-CG1 3.91Å; M340-V347 HydrophobicContact SD-CG1 4.04Å; H345-V347 HydrophobicContact CB-CG1 3.87Å; H345-V347 PolarHBondContact O-N 3.25Å; V347-V373 WeakPolarHBondContact CA-O 3.23Å; V347-V373 HydrophobicContact CB-CB 4.03Å; V347-V373 HydrophobicContact CB-CG1 4.34Å; V347-V373 HydrophobicContact CG1-CB 3.59Å; V347-V373 HydrophobicContact CG1-CG1 3.99Å; V347-V373 HydrophobicContact CG1-CG2 4.02Å; V347-I375 HydrophobicContact CB-CD1 4.23Å; V347-I375 HydrophobicContact CG2-CD1 3.84Å
348	Y	91.1	Very high	85.8	Confident	99 Å²	99	55.8 Å²	55.8	39%	0.388	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.5	175.2	-80.8	-95.7	0	0	0	110.8	K346 F371 V373 I375	K346-Y348 HydrophobicContact CG-CE2 4.36Å; Y348-F371 HydrophobicContact CD2-CB 3.97Å; Y348-F371 AromaticContact CD2-CD1 3.43Å; Y348-F371 HydrophobicContact CD2-CD1 3.43Å; Y348-F371 VanDerWaalsContact CD2-CD1 3.43Å; Y348-F371 AromaticContact CD2-CD2 3.96Å; Y348-F371 HydrophobicContact CD2-CD2 3.96Å; Y348-F371 AromaticContact CD2-CE1 3.74Å; Y348-F371 HydrophobicContact CD2-CE1 3.74Å; Y348-F371 HydrophobicContact CD2-CE2 4.24Å; Y348-F371 AromaticContact CD2-CG 3.53Å; Y348-F371 HydrophobicContact CD2-CG 3.53Å; Y348-F371 HydrophobicContact CD2-CZ 4.13Å; Y348-F371 HydrophobicContact CE2-CB 4.25Å; Y348-F371 AromaticContact CE2-CD1 3.89Å; Y348-F371 HydrophobicContact CE2-CD1 3.89Å; Y348-F371 HydrophobicContact CE2-CE1 4.44Å; Y348-F371 HydrophobicContact CE2-CG 4.16Å; Y348-F371 HydrophobicContact CG-CD1 4.22Å; Y348-F371 HydrophobicContact CG-CE1 4.06Å; Y348-F371 HydrophobicContact CG-CE2 4.45Å; Y348-F371 HydrophobicContact CG-CG 4.47Å; Y348-F371 HydrophobicContact CG-CZ 4.17Å; Y348-V373 PolarHBondContact N-O 3.42Å; Y348-I375 PolarHBondContact O-N 2.78Å
349	I	90.3	Very high	85.3	Confident	29 Å²	29	54.9 Å²	54.9	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134	175.4	-59.7	170.4	0	0	0	110.2	A333 D337 I375	A333-I349 HydrophobicContact CB-CD1 4.48Å; A333-I349 HydrophobicContact CB-CG2 4.4Å; D337-I349 HydrophobicContact CB-CD1 3.53Å; D337-I349 HydrophobicContact CB-CG1 3.74Å; I349-I375 CarbonylContact C-O 3.59Å; I349-I375 VanDerWaalsContact CA-O 3.27Å; I349-I375 WeakPolarHBondContact CA-O 3.14Å; I349-I375 HydrophobicContact CG1-CB 4.28Å; I349-I375 HydrophobicContact CG1-CG2 4.49Å
350	L	86.7	Confident	84.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	103.1	163.3	-176.9	68.9	0	0	0	109.6	L354 R359 V362 I363 L374 I375 T376 L384	L350-L354 HydrophobicContact CD1-CD1 4.41Å; L350-R359 HydrophobicContact CD1-CB 3.92Å; L350-R359 HydrophobicContact CD1-CG 3.88Å; L350-V362 HydrophobicContact CD1-CG1 4.45Å; L350-I363 HydrophobicContact CD2-CD1 4.43Å; L350-I363 HydrophobicContact CD2-CG1 4.42Å; L350-L374 HydrophobicContact CB-CD1 3.99Å; L350-L374 HydrophobicContact CB-CG 4.49Å; L350-L374 HydrophobicContact CD2-CD2 4.43Å; L350-I375 PolarHBondContact N-O 3.24Å; L350-T376 PolarHBondContact O-OG1 3.23Å; L350-L384 HydrophobicContact CD2-CD1 3.64Å
351	S	81.3	Confident	84.6	Confident	6 Å²	6	61.4 Å²	61.4	4%	0.042	33%	0.328	C	S	.	.			trans	-129.6	168.8	-173.9	51	0	0	0	0	113.5	E33 D353 L354 C380	E33-S351 WeakPolarHBondContact OE1-CA 3.49Å; E33-S351 WeakPolarHBondContact OE1-CB 3.37Å; S351-D353 VanDerWaalsContact C-N 3.29Å; S351-D353 VanDerWaalsContact CB-OD1 3.25Å; S351-D353 WeakPolarHBondContact CB-OD1 2.92Å; S351-D353 PolarHBondContact O-N 3.22Å; S351-D353 PolarHBondContact OG-OD1 2.84Å; S351-L354 PolarHBondContact O-N 3.39Å; S351-C380 WeakPolarHBondContact CA-SG 3.48Å
352	G	73.8	Confident	84.5	Confident	14 Å²	14	58.7 Å²	58.7	14%	0.144	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.2	-173.4	0	0	0	0	0	114.6	E33 R359 C380	E33-G352 PolarHBondContact OE1-N 2.63Å; G352-R359 PolarHBondContact O-NH2 3.18Å; G352-C380 PolarHBondContact N-SG 3.05Å
353	D	78.8	Confident	84.1	Confident	84 Å²	84	52.5 Å²	52.5	45%	0.449	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-16.4	-176.2	66.3	-49.2	0	0	0	114.2	R330 S351	R330-D353 VanDerWaalsContact CZ-CG 3.4Å; R330-D353 IonicContact CZ-OD1 3.75Å; R330-D353 IonicContact CZ-OD2 3.36Å; R330-D353 VanDerWaalsContact NH1-CG 3.33Å; R330-D353 IonicContact NH1-OD1 3.73Å; R330-D353 IonicContact NH1-OD2 2.63Å; R330-D353 PolarHBondContact NH1-OD2 3.18Å; R330-D353 VanDerWaalsContact NH2-CG 3.3Å; R330-D353 IonicContact NH2-OD1 3.85Å; R330-D353 IonicContact NH2-OD2 3.62Å; R330-D353 PolarHBondContact NH2-OD2 3.27Å; S351-D353 VanDerWaalsContact C-N 3.29Å; S351-D353 VanDerWaalsContact CB-OD1 3.25Å; S351-D353 WeakPolarHBondContact CB-OD1 2.92Å; S351-D353 PolarHBondContact O-N 3.22Å; S351-D353 PolarHBondContact OG-OD1 2.84Å
354	L	80.9	Confident	83.8	Confident	31 Å²	31	54.3 Å²	54.3	16%	0.162	29%	0.288	C	S	.	.	S	Bend	trans	-67.4	136.2	171	-62.4	-179.5	0	0	0	109.3	L350 S351 Q358 R359 V362	L350-L354 HydrophobicContact CD1-CD1 4.41Å; S351-L354 PolarHBondContact O-N 3.39Å; L354-Q358 HydrophobicContact CB-CB 4.01Å; L354-Q358 HydrophobicContact CD2-CB 4.22Å; L354-R359 HydrophobicContact CB-CG 3.69Å; L354-R359 HydrophobicContact CD1-CG 4.48Å; L354-R359 PolarHBondContact O-NE 3.26Å; L354-R359 PolarHBondContact O-NH2 2.62Å; L354-V362 HydrophobicContact CD1-CG2 4.2Å
355	D	82.5	Confident	83.9	Confident	76 Å²	76	52.9 Å²	52.9	41%	0.406	26%	0.264	S	S	.	.			trans	-69.3	165.6	169.3	73.2	46.9	0	0	0	111.1	S357 Q358 R359	D355-S357 PolarHBondContact O-N 2.82Å; D355-S357 WeakPolarHBondContact OD1-CA 3.2Å; D355-S357 WeakPolarHBondContact OD1-CB 3.2Å; D355-S357 PolarHBondContact OD1-N 2.77Å; D355-S357 PolarHBondContact OD1-OG 2.81Å; D355-Q358 PolarHBondContact O-N 2.98Å; D355-Q358 VanDerWaalsContact O-N 3.12Å; D355-Q358 WeakPolarHBondContact OD1-CG 3.3Å; D355-Q358 PolarHBondContact OD1-N 2.83Å; D355-R359 WeakPolarHBondContact O-CG 3.47Å; D355-R359 PolarHBondContact O-N 3.33Å
356	V	77.6	Confident	83.9	Confident	41 Å²	41	50.1 Å²	50.1	25%	0.248	25%	0.251	C	S	.	.	H	α-helix	trans	-56.6	-35.9	-177	176.4	0	0	0	0	112.5	E40 Y43 R359 E360	E40-V356 HydrophobicContact CG-CG2 4.38Å; Y43-V356 HydrophobicContact CD1-CG1 3.67Å; Y43-V356 HydrophobicContact CE1-CG1 3.4Å; Y43-V356 VanDerWaalsContact CE1-CG1 3.4Å; V356-R359 PolarHBondContact O-N 2.58Å; V356-E360 WeakPolarHBondContact O-CB 3.34Å; V356-E360 PolarHBondContact O-N 2.94Å
357	S	82	Confident	83.5	Confident	74 Å²	74	49.1 Å²	49.1	52%	0.517	24%	0.244	S	C	.	.	H	α-helix	trans	-73.4	-35.1	179.9	73.8	0	0	0	0	112.6	D355 K361	D355-S357 PolarHBondContact O-N 2.82Å; D355-S357 WeakPolarHBondContact OD1-CA 3.2Å; D355-S357 WeakPolarHBondContact OD1-CB 3.2Å; D355-S357 PolarHBondContact OD1-N 2.77Å; D355-S357 PolarHBondContact OD1-OG 2.81Å; S357-K361 PolarHBondContact O-N 3.14Å
358	Q	87.2	Confident	83.2	Confident	88 Å²	88	52.3 Å²	52.3	41%	0.411	27%	0.267	S	S	.	.	H	α-helix	trans	-68	-42.9	173.1	-69.2	173.5	-30.5	0	0	111	L354 D355 K361 V362	L354-Q358 HydrophobicContact CB-CB 4.01Å; L354-Q358 HydrophobicContact CD2-CB 4.22Å; D355-Q358 PolarHBondContact O-N 2.98Å; D355-Q358 VanDerWaalsContact O-N 3.12Å; D355-Q358 WeakPolarHBondContact OD1-CG 3.3Å; D355-Q358 PolarHBondContact OD1-N 2.83Å; Q358-K361 PolarHBondContact O-N 2.9Å; Q358-V362 WeakPolarHBondContact O-CG2 3.35Å; Q358-V362 PolarHBondContact O-N 2.88Å
359	R	82.6	Confident	82.8	Confident	13 Å²	13	50.9 Å²	50.9	5%	0.049	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-46.1	174.6	-65.8	173.7	-165.8	164.7	3.8	111.2	F36 E40 L44 L350 G352 L354 D355 V356 K361 V362 I363	F36-R359 VanDerWaalsContact CE1-NH1 3.26Å; F36-R359 VanDerWaalsContact CE1-NH2 3.32Å; F36-R359 HydrophobicContact CZ-CG 4.34Å; E40-R359 IonicContact OE1-CZ 2.75Å; E40-R359 IonicContact OE1-NH1 2.72Å; E40-R359 PolarHBondContact OE1-NH1 3.22Å; E40-R359 IonicContact OE1-NH2 2.72Å; L44-R359 HydrophobicContact CD1-CB 4.36Å; L44-R359 HydrophobicContact CD2-CB 4.22Å; L350-R359 HydrophobicContact CD1-CB 3.92Å; L350-R359 HydrophobicContact CD1-CG 3.88Å; G352-R359 PolarHBondContact O-NH2 3.18Å; L354-R359 HydrophobicContact CB-CG 3.69Å; L354-R359 HydrophobicContact CD1-CG 4.48Å; L354-R359 PolarHBondContact O-NE 3.26Å; L354-R359 PolarHBondContact O-NH2 2.62Å; D355-R359 WeakPolarHBondContact O-CG 3.47Å; D355-R359 PolarHBondContact O-N 3.33Å; V356-R359 PolarHBondContact O-N 2.58Å; R359-K361 VanDerWaalsContact C-N 3.35Å; R359-K361 PolarHBondContact O-N 2.9Å; R359-V362 PolarHBondContact O-N 3.04Å; R359-I363 WeakPolarHBondContact O-CB 3.46Å; R359-I363 WeakPolarHBondContact O-CG1 3.46Å; R359-I363 PolarHBondContact O-N 2.94Å
360	E	80.3	Confident	82.6	Confident	65 Å²	65	53.3 Å²	53.3	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-56.1	-48.3	175.4	176.5	173.5	-179.7	0	0	111.4	L47 V356 V362 I363 E364	L47-E360 HydrophobicContact CD1-CB 4.29Å; L47-E360 HydrophobicContact CD1-CG 3.86Å; V356-E360 WeakPolarHBondContact O-CB 3.34Å; V356-E360 PolarHBondContact O-N 2.94Å; E360-V362 PolarHBondContact O-N 3.36Å; E360-I363 WeakPolarHBondContact O-CB 3.35Å; E360-I363 PolarHBondContact O-N 3.28Å; E360-E364 WeakPolarHBondContact O-CB 3.39Å; E360-E364 PolarHBondContact O-N 2.9Å
361	K	86.9	Confident	82.6	Confident	130 Å²	130	53.5 Å²	53.5	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-61	-46.5	177.7	-175.5	179.8	178.4	-176.4	0	112.8	S357 Q358 R359 I363 E364 D365	S357-K361 PolarHBondContact O-N 3.14Å; Q358-K361 PolarHBondContact O-N 2.9Å; R359-K361 VanDerWaalsContact C-N 3.35Å; R359-K361 PolarHBondContact O-N 2.9Å; K361-I363 VanDerWaalsContact C-N 3.26Å; K361-I363 PolarHBondContact O-N 3.03Å; K361-E364 PolarHBondContact O-N 2.89Å; K361-D365 WeakPolarHBondContact O-CB 3.37Å; K361-D365 PolarHBondContact O-N 3.31Å
362	V	87.9	Confident	82.8	Confident	16 Å²	16	60.7 Å²	60.7	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-59	-42.5	178.2	170.2	0	0	0	0	110.5	L350 L354 Q358 R359 E360 F366 F371 L374	L350-V362 HydrophobicContact CD1-CG1 4.45Å; L354-V362 HydrophobicContact CD1-CG2 4.2Å; Q358-V362 WeakPolarHBondContact O-CG2 3.35Å; Q358-V362 PolarHBondContact O-N 2.88Å; R359-V362 PolarHBondContact O-N 3.04Å; E360-V362 PolarHBondContact O-N 3.36Å; V362-F366 WeakPolarHBondContact O-CB 3.42Å; V362-F366 PolarHBondContact O-N 3.33Å; V362-F371 HydrophobicContact CG1-CZ 4.02Å; V362-F371 WeakPolarHBondContact O-CE1 3.11Å; V362-F371 WeakPolarHBondContact O-CZ 3.35Å; V362-L374 HydrophobicContact CG1-CD1 3.74Å
363	I	81.2	Confident	83.6	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-64.8	-44.6	177.2	-80	165.9	0	0	0	111.9	L44 L48 L350 R359 E360 K361 F366 R367	L44-I363 HydrophobicContact CD2-CD1 4.18Å; L48-I363 HydrophobicContact CD1-CD1 4.15Å; L48-I363 HydrophobicContact CD1-CG2 4.34Å; L48-I363 HydrophobicContact CD2-CB 4.39Å; L48-I363 HydrophobicContact CD2-CG2 3.09Å; L48-I363 HydrophobicContact CG-CG2 3.66Å; L350-I363 HydrophobicContact CD2-CD1 4.43Å; L350-I363 HydrophobicContact CD2-CG1 4.42Å; R359-I363 WeakPolarHBondContact O-CB 3.46Å; R359-I363 WeakPolarHBondContact O-CG1 3.46Å; R359-I363 PolarHBondContact O-N 2.94Å; E360-I363 WeakPolarHBondContact O-CB 3.35Å; E360-I363 PolarHBondContact O-N 3.28Å; K361-I363 VanDerWaalsContact C-N 3.26Å; K361-I363 PolarHBondContact O-N 3.03Å; I363-F366 WeakPolarHBondContact O-CB 3.16Å; I363-F366 PolarHBondContact O-N 3.07Å; I363-R367 WeakPolarHBondContact O-CB 3.48Å; I363-R367 PolarHBondContact O-N 3.35Å
364	E	81.9	Confident	84.2	Confident	118 Å²	118	56.1 Å²	56.1	55%	0.551	28%	0.284	S	S	*	.	H	α-helix	trans	-65.7	-43	178.8	-175.6	175.5	-156.1	0	0	111.7	E360 K361 F366 R367 S368	E360-E364 WeakPolarHBondContact O-CB 3.39Å; E360-E364 PolarHBondContact O-N 2.9Å; K361-E364 PolarHBondContact O-N 2.89Å; E364-F366 VanDerWaalsContact C-N 3.33Å; E364-R367 PolarHBondContact O-N 2.8Å; E364-S368 WeakPolarHBondContact O-CB 3.33Å; E364-S368 PolarHBondContact O-N 3.43Å; E364-S368 PolarHBondContact O-OG 2.93Å
365	D	87.7	Confident	84.7	Confident	38 Å²	38	54.7 Å²	54.7	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-41.9	174.7	-80.6	-28.9	0	0	0	110.9	K361 S368 S369 N370 F371	K361-D365 WeakPolarHBondContact O-CB 3.37Å; K361-D365 PolarHBondContact O-N 3.31Å; D365-S368 PolarHBondContact O-N 2.85Å; D365-S369 PolarHBondContact O-N 2.91Å; D365-N370 HydrophobicContact CB-CB 4.11Å; D365-N370 WeakPolarHBondContact O-CB 3.39Å; D365-N370 PolarHBondContact O-N 2.83Å; D365-N370 PolarHBondContact OD1-ND2 2.87Å; D365-F371 HydrophobicContact CB-CD1 3.99Å; D365-F371 HydrophobicContact CB-CE1 3.61Å
366	F	85.1	Confident	85	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-52	175.4	-174	-125.1	0	0	0	110.2	Q322 I324 V362 I363 E364 S368 S369 F371 L374 I386 V389	Q322-F366 HydrophobicContact CB-CE2 4.08Å; Q322-F366 HydrophobicContact CB-CZ 3.82Å; Q322-F366 HydrophobicContact CG-CE2 4.26Å; Q322-F366 HydrophobicContact CG-CZ 4.37Å; Q322-F366 PolarHBondContact NE2-O 3.48Å; I324-F366 HydrophobicContact CG1-CE1 4.32Å; I324-F366 HydrophobicContact CG1-CZ 4.18Å; V362-F366 WeakPolarHBondContact O-CB 3.42Å; V362-F366 PolarHBondContact O-N 3.33Å; I363-F366 WeakPolarHBondContact O-CB 3.16Å; I363-F366 PolarHBondContact O-N 3.07Å; E364-F366 VanDerWaalsContact C-N 3.33Å; F366-S368 VanDerWaalsContact C-N 3.29Å; F366-S368 PolarHBondContact O-N 3.35Å; F366-S369 WeakPolarHBondContact O-CA 3.36Å; F366-S369 PolarHBondContact O-N 2.71Å; F366-F371 HydrophobicContact CB-CE1 3.94Å; F366-F371 HydrophobicContact CB-CE2 3.89Å; F366-F371 HydrophobicContact CB-CZ 3.43Å; F366-F371 VanDerWaalsContact CB-CZ 3.43Å; F366-F371 AromaticContact CD2-CD2 3.8Å; F366-F371 HydrophobicContact CD2-CD2 3.8Å; F366-F371 AromaticContact CD2-CE2 3.35Å; F366-F371 HydrophobicContact CD2-CE2 3.35Å; F366-F371 AromaticContact CD2-CZ 3.87Å; F366-F371 HydrophobicContact CD2-CZ 3.87Å; F366-F371 HydrophobicContact CE2-CE2 4.21Å; F366-F371 AromaticContact CG-CE2 3.99Å; F366-F371 HydrophobicContact CG-CE2 3.99Å; F366-F371 HydrophobicContact CG-CZ 4.06Å; F366-F371 VanDerWaalsContact N-CE1 3.26Å; F366-L374 HydrophobicContact CD1-CB 4.46Å; F366-L374 HydrophobicContact CD1-CD2 4.21Å; F366-L374 HydrophobicContact CD2-CB 3.96Å; F366-L374 HydrophobicContact CE1-CB 4.29Å; F366-L374 HydrophobicContact CE1-CD2 4.35Å; F366-L374 HydrophobicContact CE2-CB 3.74Å; F366-L374 HydrophobicContact CG-CB 4.29Å; F366-L374 HydrophobicContact CZ-CB 3.9Å; F366-I386 HydrophobicContact CD1-CG2 3.86Å; F366-I386 HydrophobicContact CE1-CG2 3.64Å; F366-V389 HydrophobicContact CE1-CG1 3.75Å; F366-V389 HydrophobicContact CZ-CG1 3.59Å
367	R	78.6	Confident	85.3	Confident	96 Å²	96	49.1 Å²	49.1	36%	0.362	25%	0.245	S	C	.	.	H	α-helix	trans	-58.4	-40.8	-178.9	-172.5	-177.8	-174.4	158.5	14.4	112.8	L48 S50 I363 E364 S369 P387	L48-R367 PolarHBondContact O-NH1 2.82Å; S50-R367 VanDerWaalsContact CB-NH2 3.35Å; S50-R367 PolarHBondContact OG-NH2 3.34Å; I363-R367 WeakPolarHBondContact O-CB 3.48Å; I363-R367 PolarHBondContact O-N 3.35Å; E364-R367 PolarHBondContact O-N 2.8Å; R367-S369 PolarHBondContact O-N 3.03Å; R367-P387 HydrophobicContact CB-CG 3.85Å; R367-P387 HydrophobicContact CG-CB 4.45Å; R367-P387 HydrophobicContact CG-CG 3.82Å
368	S	82.2	Confident	84.8	Confident	71 Å²	71	47 Å²	47	50%	0.497	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	1.9	178.1	-56.3	0	0	0	0	112.9	E364 D365 F366 N370	E364-S368 WeakPolarHBondContact O-CB 3.33Å; E364-S368 PolarHBondContact O-N 3.43Å; E364-S368 PolarHBondContact O-OG 2.93Å; D365-S368 PolarHBondContact O-N 2.85Å; F366-S368 VanDerWaalsContact C-N 3.29Å; F366-S368 PolarHBondContact O-N 3.35Å; S368-N370 PolarHBondContact O-N 2.81Å
369	S	83.1	Confident	83.6	Confident	68 Å²	68	44.9 Å²	44.9	48%	0.476	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	27.1	-175.3	-56.7	0	0	0	0	113.2	Q322 D365 F366 R367 F371	Q322-S369 PolarHBondContact NE2-OG 3.13Å; D365-S369 PolarHBondContact O-N 2.91Å; F366-S369 WeakPolarHBondContact O-CA 3.36Å; F366-S369 PolarHBondContact O-N 2.71Å; R367-S369 PolarHBondContact O-N 3.03Å; S369-F371 PolarHBondContact O-N 3.49Å
370	N	86.2	Confident	82.7	Confident	80 Å²	80	44.2 Å²	44.2	43%	0.428	22%	0.218	S	C	.	.	S	Bend	trans	-66.1	-20.2	173.9	-70.1	-19.9	0	0	0	111.8	K346 D365 S368	K346-N370 WeakPolarHBondContact CD-O 3.06Å; K346-N370 PolarHBondContact NZ-O 2.85Å; D365-N370 HydrophobicContact CB-CB 4.11Å; D365-N370 WeakPolarHBondContact O-CB 3.39Å; D365-N370 PolarHBondContact O-N 2.83Å; D365-N370 PolarHBondContact OD1-ND2 2.87Å; S368-N370 PolarHBondContact O-N 2.81Å
371	F	87.5	Confident	81.8	Confident	5 Å²	5	41.7 Å²	41.7	2%	0.022	21%	0.207	C	C	.	.	S	Bend	trans	-146.7	160.3	164.6	64.3	-89	0	0	0	108.9	K346 Y348 V362 D365 F366 S369 V373 L374	K346-F371 HydrophobicContact CB-CB 4.44Å; K346-F371 HydrophobicContact CD-CB 4.29Å; K346-F371 HydrophobicContact CG-CB 4.12Å; Y348-F371 HydrophobicContact CD2-CB 3.97Å; Y348-F371 AromaticContact CD2-CD1 3.43Å; Y348-F371 HydrophobicContact CD2-CD1 3.43Å; Y348-F371 VanDerWaalsContact CD2-CD1 3.43Å; Y348-F371 AromaticContact CD2-CD2 3.96Å; Y348-F371 HydrophobicContact CD2-CD2 3.96Å; Y348-F371 AromaticContact CD2-CE1 3.74Å; Y348-F371 HydrophobicContact CD2-CE1 3.74Å; Y348-F371 HydrophobicContact CD2-CE2 4.24Å; Y348-F371 AromaticContact CD2-CG 3.53Å; Y348-F371 HydrophobicContact CD2-CG 3.53Å; Y348-F371 HydrophobicContact CD2-CZ 4.13Å; Y348-F371 HydrophobicContact CE2-CB 4.25Å; Y348-F371 AromaticContact CE2-CD1 3.89Å; Y348-F371 HydrophobicContact CE2-CD1 3.89Å; Y348-F371 HydrophobicContact CE2-CE1 4.44Å; Y348-F371 HydrophobicContact CE2-CG 4.16Å; Y348-F371 HydrophobicContact CG-CD1 4.22Å; Y348-F371 HydrophobicContact CG-CE1 4.06Å; Y348-F371 HydrophobicContact CG-CE2 4.45Å; Y348-F371 HydrophobicContact CG-CG 4.47Å; Y348-F371 HydrophobicContact CG-CZ 4.17Å; V362-F371 HydrophobicContact CG1-CZ 4.02Å; V362-F371 WeakPolarHBondContact O-CE1 3.11Å; V362-F371 WeakPolarHBondContact O-CZ 3.35Å; D365-F371 HydrophobicContact CB-CD1 3.99Å; D365-F371 HydrophobicContact CB-CE1 3.61Å; F366-F371 HydrophobicContact CB-CE1 3.94Å; F366-F371 HydrophobicContact CB-CE2 3.89Å; F366-F371 HydrophobicContact CB-CZ 3.43Å; F366-F371 VanDerWaalsContact CB-CZ 3.43Å; F366-F371 AromaticContact CD2-CD2 3.8Å; F366-F371 HydrophobicContact CD2-CD2 3.8Å; F366-F371 AromaticContact CD2-CE2 3.35Å; F366-F371 HydrophobicContact CD2-CE2 3.35Å; F366-F371 AromaticContact CD2-CZ 3.87Å; F366-F371 HydrophobicContact CD2-CZ 3.87Å; F366-F371 HydrophobicContact CE2-CE2 4.21Å; F366-F371 AromaticContact CG-CE2 3.99Å; F366-F371 HydrophobicContact CG-CE2 3.99Å; F366-F371 HydrophobicContact CG-CZ 4.06Å; F366-F371 VanDerWaalsContact N-CE1 3.26Å; S369-F371 PolarHBondContact O-N 3.49Å; F371-V373 WeakPolarHBondContact CD2-O 3.49Å; F371-V373 WeakPolarHBondContact CE2-O 3.38Å; F371-L374 HydrophobicContact CE2-CB 4.19Å; F371-L374 HydrophobicContact CE2-CD1 3.95Å; F371-L374 HydrophobicContact CZ-CD1 4Å
372	R	85.6	Confident	80.8	Confident	156 Å²	156	39.9 Å²	39.9	59%	0.589	20%	0.197	S	C	*	.	S	Bend	trans	-104.8	-17	-172.9	-69.9	-170	-175.7	-170.1	4.2	114.1	V320 G321 Q322 A323	V320-R372 PolarHBondContact O-NH1 2.86Å; G321-R372 WeakPolarHBondContact O-CB 3.41Å; Q322-R372 CarbonylContact C-O 3.54Å; Q322-R372 VanDerWaalsContact CA-O 3.31Å; Q322-R372 WeakPolarHBondContact CA-O 3.42Å; A323-R372 PolarHBondContact N-O 3.28Å
373	V	89.8	Confident	79.4	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	119.7	-174.3	-173.2	0	0	0	0	110.8	Y315 A323 I325 M340 V347 Y348 F371 I375	Y315-V373 HydrophobicContact CE1-CG2 3.42Å; Y315-V373 VanDerWaalsContact CE1-CG2 3.42Å; Y315-V373 VanDerWaalsContact OH-CG1 3.24Å; Y315-V373 WeakPolarHBondContact OH-CG1 3.3Å; Y315-V373 WeakPolarHBondContact OH-CG2 3.44Å; A323-V373 WeakPolarHBondContact O-CA 3.3Å; I325-V373 HydrophobicContact CD1-CG1 3.65Å; I325-V373 HydrophobicContact CG1-CG1 3.95Å; M340-V373 HydrophobicContact CE-CG1 4.09Å; M340-V373 HydrophobicContact CE-CG2 4.26Å; M340-V373 HydrophobicContact SD-CG1 4.41Å; V347-V373 WeakPolarHBondContact CA-O 3.23Å; V347-V373 HydrophobicContact CB-CB 4.03Å; V347-V373 HydrophobicContact CB-CG1 4.34Å; V347-V373 HydrophobicContact CG1-CB 3.59Å; V347-V373 HydrophobicContact CG1-CG1 3.99Å; V347-V373 HydrophobicContact CG1-CG2 4.02Å; Y348-V373 PolarHBondContact N-O 3.42Å; F371-V373 WeakPolarHBondContact CD2-O 3.49Å; F371-V373 WeakPolarHBondContact CE2-O 3.38Å; V373-I375 HydrophobicContact CG1-CG1 4.37Å
374	L	90.8	Very high	78.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120.1	171.3	-173.9	68.7	0	0	0	109.3	A323 I324 I325 L350 V362 F366 F371 I386	A323-L374 PolarHBondContact O-N 3.29Å; I324-L374 CarbonylContact C-O 3.58Å; I324-L374 VanDerWaalsContact CA-O 3.3Å; I324-L374 WeakPolarHBondContact CA-O 3.47Å; I324-L374 HydrophobicContact CG1-CB 4.43Å; I325-L374 PolarHBondContact N-O 3.4Å; L350-L374 HydrophobicContact CB-CD1 3.99Å; L350-L374 HydrophobicContact CB-CG 4.49Å; L350-L374 HydrophobicContact CD2-CD2 4.43Å; V362-L374 HydrophobicContact CG1-CD1 3.74Å; F366-L374 HydrophobicContact CD1-CB 4.46Å; F366-L374 HydrophobicContact CD1-CD2 4.21Å; F366-L374 HydrophobicContact CD2-CB 3.96Å; F366-L374 HydrophobicContact CE1-CB 4.29Å; F366-L374 HydrophobicContact CE1-CD2 4.35Å; F366-L374 HydrophobicContact CE2-CB 3.74Å; F366-L374 HydrophobicContact CG-CB 4.29Å; F366-L374 HydrophobicContact CZ-CB 3.9Å; F371-L374 HydrophobicContact CE2-CB 4.19Å; F371-L374 HydrophobicContact CE2-CD1 3.95Å; F371-L374 HydrophobicContact CZ-CD1 4Å; L374-I386 HydrophobicContact CD2-CD1 3.98Å; L374-I386 HydrophobicContact CD2-CG2 4.01Å
375	I	92	Very high	77.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.9	171.5	-58.2	172.1	0	0	0	107.4	I325 A333 L336 D337 M340 V347 Y348 I349 L350 V373	I325-I375 HydrophobicContact CB-CG1 4.36Å; I325-I375 HydrophobicContact CD1-CG1 4.45Å; I325-I375 WeakPolarHBondContact O-CA 3.36Å; A333-I375 HydrophobicContact CB-CG2 3.7Å; L336-I375 HydrophobicContact CB-CD1 4.16Å; L336-I375 HydrophobicContact CD2-CD1 4.01Å; L336-I375 HydrophobicContact CD2-CG1 4.32Å; L336-I375 HydrophobicContact CD2-CG2 4.46Å; L336-I375 HydrophobicContact CG-CD1 3.94Å; D337-I375 HydrophobicContact CB-CD1 4.05Å; M340-I375 HydrophobicContact SD-CD1 4.23Å; V347-I375 HydrophobicContact CB-CD1 4.23Å; V347-I375 HydrophobicContact CG2-CD1 3.84Å; Y348-I375 PolarHBondContact O-N 2.78Å; I349-I375 CarbonylContact C-O 3.59Å; I349-I375 VanDerWaalsContact CA-O 3.27Å; I349-I375 WeakPolarHBondContact CA-O 3.14Å; I349-I375 HydrophobicContact CG1-CB 4.28Å; I349-I375 HydrophobicContact CG1-CG2 4.49Å; L350-I375 PolarHBondContact N-O 3.24Å; V373-I375 HydrophobicContact CG1-CG1 4.37Å
376	T	89.5	Confident	76.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.1	-179.7	-169.9	0	0	0	0	111.5	I324 I325 F326 C327 L350	I324-T376 HydrophobicContact CG2-CG2 3.83Å; I325-T376 PolarHBondContact O-N 2.79Å; F326-T376 WeakPolarHBondContact CA-O 3.21Å; F326-T376 HydrophobicContact CD1-CG2 3.5Å; F326-T376 HydrophobicContact CE1-CG2 3.54Å; F326-T376 HydrophobicContact CG-CG2 4.44Å; C327-T376 PolarHBondContact N-O 3.23Å; L350-T376 PolarHBondContact O-OG1 3.23Å
377	T	83.5	Confident	75.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	159.1	174.2	65.3	0	0	0	0	111.4	E33 C327 R330 A333 V379 C380 S381	E33-T377 VanDerWaalsContact CD-OG1 3.3Å; E33-T377 PolarHBondContact OE1-OG1 3.35Å; E33-T377 WeakPolarHBondContact OE2-CB 3.43Å; E33-T377 WeakPolarHBondContact OE2-CG2 3.21Å; E33-T377 PolarHBondContact OE2-OG1 2.96Å; C327-T377 VanDerWaalsContact O-CA 3.3Å; C327-T377 WeakPolarHBondContact O-CA 3.45Å; R330-T377 HydrophobicContact CB-CG2 4.49Å; A333-T377 HydrophobicContact CB-CG2 4.37Å; T377-V379 PolarHBondContact O-N 2.83Å; T377-C380 PolarHBondContact O-N 2.88Å; T377-C380 PolarHBondContact OG1-SG 3.28Å; T377-S381 PolarHBondContact O-N 2.77Å; T377-S381 VanDerWaalsContact O-N 3.13Å; T377-S381 PolarHBondContact O-OG 3.4Å
378	N	70.9	Confident	75.3	Confident	30 Å²	30	32.7 Å²	32.7	16%	0.16	17%	0.174	C	C	.	.	H	α-helix	trans	-52	-39.3	175.7	-56.8	-2.5	0	0	0	111.7	C327 R382 R413	C327-N378 PolarHBondContact O-N 3.21Å; C327-N378 PolarHBondContact O-OD1 3.26Å; N378-R382 PolarHBondContact O-N 3.19Å; N378-R413 PolarHBondContact ND2-NH2 3.26Å; N378-R413 PolarHBondContact OD1-NH2 3.15Å
379	V	61.7	Low	75	Confident	43 Å²	43	29.6 Å²	29.6	26%	0.261	15%	0.152	S	C	.	.	H	α-helix	trans	-69.9	-37.9	-174.3	173	0	0	0	0	111.8	E33 P35 T377	E33-V379 HydrophobicContact CG-CG1 4.35Å; P35-V379 HydrophobicContact CB-CG1 3.71Å; T377-V379 PolarHBondContact O-N 2.83Å
380	C	64.4	Low	74.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-85.3	-31.7	-176.8	-65.2	0	0	0	0	112.9	E33 F36 S351 G352 T377 L384	E33-C380 PolarHBondContact OE1-SG 2.89Å; E33-C380 VanDerWaalsContact OE1-SG 3.33Å; F36-C380 HydrophobicContact CD2-CB 4.36Å; F36-C380 WeakPolarHBondContact CD2-O 3.41Å; F36-C380 HydrophobicContact CE1-CB 4.09Å; F36-C380 HydrophobicContact CE2-CB 3.62Å; F36-C380 WeakPolarHBondContact CE2-O 3.22Å; F36-C380 HydrophobicContact CZ-CB 3.47Å; F36-C380 VanDerWaalsContact CZ-CB 3.47Å; S351-C380 WeakPolarHBondContact CA-SG 3.48Å; G352-C380 PolarHBondContact N-SG 3.05Å; T377-C380 PolarHBondContact O-N 2.88Å; T377-C380 PolarHBondContact OG1-SG 3.28Å; C380-L384 VanDerWaalsContact O-CD1 3.28Å; C380-L384 WeakPolarHBondContact O-CD1 3.44Å
381	S	62.1	Low	74.8	Confident	11 Å²	11	26 Å²	26	8%	0.077	13%	0.128	C	C	.	.	H	α-helix	trans	-87.4	-16.4	-173.7	53.6	0	0	0	0	114.8	F326 T377 G383 L384	F326-S381 WeakPolarHBondContact CD1-OG 3.39Å; F326-S381 VanDerWaalsContact CE1-CB 3.47Å; F326-S381 VanDerWaalsContact CE1-OG 3.29Å; F326-S381 WeakPolarHBondContact CE1-OG 3.36Å; T377-S381 PolarHBondContact O-N 2.77Å; T377-S381 VanDerWaalsContact O-N 3.13Å; T377-S381 PolarHBondContact O-OG 3.4Å; S381-G383 PolarHBondContact O-N 2.91Å; S381-G383 VanDerWaalsContact O-N 3.13Å; S381-L384 PolarHBondContact O-N 3.31Å
382	R	64.3	Low	74.9	Confident	92 Å²	92	25.7 Å²	25.7	35%	0.347	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	121.5	-176.4	-166.6	170.3	-179.6	151.7	0.4	109.8	I41 N378 L384 D406 E408 T409	I41-R382 WeakPolarHBondContact CD1-O 3.45Å; N378-R382 PolarHBondContact O-N 3.19Å; R382-L384 VanDerWaalsContact C-N 3.29Å; R382-L384 PolarHBondContact O-N 2.87Å; R382-D406 IonicContact NH1-OD2 3.19Å; R382-D406 PolarHBondContact NH1-OD2 3.43Å; R382-E408 IonicContact CZ-OE1 3.41Å; R382-E408 IonicContact NH2-OE1 2.83Å; R382-E408 PolarHBondContact NH2-OE1 2.9Å; R382-E408 IonicContact NH2-OE2 3.91Å; R382-E408 PolarHBondContact NH2-OE2 3.32Å; R382-E408 VanDerWaalsContact NH2-OE2 3.08Å; R382-T409 PolarHBondContact NH1-OG1 3.38Å; R382-T409 VanDerWaalsContact NH1-OG1 3.09Å
383	G	59.5	Low	75.3	Confident	23 Å²	23	18.3 Å²	18.3	24%	0.237	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-8.3	179.7	0	0	0	0	0	115.4	I41 N45 S381	I41-G383 VanDerWaalsContact CG2-O 3.27Å; I41-G383 WeakPolarHBondContact CG2-O 3.34Å; N45-G383 PolarHBondContact ND2-O 3.32Å; N45-G383 PolarHBondContact OD1-O 3.38Å; S381-G383 PolarHBondContact O-N 2.91Å; S381-G383 VanDerWaalsContact O-N 3.13Å
384	L	66.1	Low	75.5	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.005	10%	0.098	C	C	.	.			trans	-72.7	136.6	176.9	-72.2	-174.1	0	0	0	113.1	F36 I41 L44 N45 L350 C380 S381 R382 I386 R416	F36-L384 HydrophobicContact CD2-CD1 4.1Å; F36-L384 HydrophobicContact CD2-CG 4.37Å; F36-L384 HydrophobicContact CE2-CD1 3.72Å; F36-L384 HydrophobicContact CE2-CG 4.47Å; I41-L384 HydrophobicContact CG2-CD2 4.39Å; L44-L384 HydrophobicContact CB-CD2 3.47Å; L44-L384 VanDerWaalsContact CB-CD2 3.47Å; L44-L384 HydrophobicContact CD1-CD1 4.42Å; L44-L384 HydrophobicContact CD1-CD2 3.71Å; L44-L384 HydrophobicContact CG-CD2 4.24Å; N45-L384 WeakPolarHBondContact OD1-CA 3.37Å; L350-L384 HydrophobicContact CD2-CD1 3.64Å; C380-L384 VanDerWaalsContact O-CD1 3.28Å; C380-L384 WeakPolarHBondContact O-CD1 3.44Å; S381-L384 PolarHBondContact O-N 3.31Å; R382-L384 VanDerWaalsContact C-N 3.29Å; R382-L384 PolarHBondContact O-N 2.87Å; L384-I386 VanDerWaalsContact C-N 3.25Å; L384-I386 HydrophobicContact CB-CD1 4.29Å; L384-I386 HydrophobicContact CB-CG1 3.91Å; L384-I386 PolarHBondContact O-N 2.96Å; L384-I386 VanDerWaalsContact O-N 3.15Å; L384-R416 VanDerWaalsContact O-CZ 3.27Å; L384-R416 PolarHBondContact O-NE 3.14Å
385	D	63.6	Low	75.7	Confident	16 Å²	16	18.1 Å²	18.1	9%	0.086	10%	0.098	C	C	.	.			trans	-92.5	53.7	-177.5	-152.8	-3.8	0	0	0	111.9	N45 L48 N49 F53 R416	N45-D385 HydrophobicContact CB-CB 4.19Å; N45-D385 WeakPolarHBondContact OD1-CB 3.5Å; N45-D385 PolarHBondContact OD1-N 3.01Å; L48-D385 HydrophobicContact CB-CB 4.4Å; L48-D385 WeakPolarHBondContact CB-O 3.48Å; L48-D385 HydrophobicContact CD1-CB 4.4Å; L48-D385 WeakPolarHBondContact CD1-O 3.32Å; L48-D385 WeakPolarHBondContact CD2-O 3.14Å; N49-D385 VanDerWaalsContact CG-OD2 3.3Å; N49-D385 PolarHBondContact ND2-OD2 3.33Å; N49-D385 PolarHBondContact OD1-OD2 3.31Å; F53-D385 WeakPolarHBondContact CE2-OD2 3.49Å; F53-D385 WeakPolarHBondContact CZ-OD2 3.24Å; D385-R416 IonicContact OD1-CZ 3.2Å; D385-R416 IonicContact OD1-NH1 2.77Å; D385-R416 PolarHBondContact OD1-NH1 2.97Å
386	I	66.9	Low	75.8	Confident	6 Å²	6	18.9 Å²	18.9	3%	0.031	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-59.4	140.3	-176.1	-55.8	171.4	0	0	0	108.4	I324 F366 L374 L384	I324-I386 HydrophobicContact CD1-CB 3.93Å; I324-I386 HydrophobicContact CD1-CD1 4.02Å; I324-I386 HydrophobicContact CD1-CG2 3.51Å; I324-I386 HydrophobicContact CG1-CG2 4.33Å; F366-I386 HydrophobicContact CD1-CG2 3.86Å; F366-I386 HydrophobicContact CE1-CG2 3.64Å; L374-I386 HydrophobicContact CD2-CD1 3.98Å; L374-I386 HydrophobicContact CD2-CG2 4.01Å; L384-I386 VanDerWaalsContact C-N 3.25Å; L384-I386 HydrophobicContact CB-CD1 4.29Å; L384-I386 HydrophobicContact CB-CG1 3.91Å; L384-I386 PolarHBondContact O-N 2.96Å; L384-I386 VanDerWaalsContact O-N 3.15Å
387	P	63.9	Low	76	Confident	26 Å²	26	19.1 Å²	19.1	17%	0.169	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-53.1	152.3	-178.7	-25	35.4	0	0	0	111.9	L48 R367 V389	L48-P387 HydrophobicContact CD2-CG 4.17Å; R367-P387 HydrophobicContact CB-CG 3.85Å; R367-P387 HydrophobicContact CG-CB 4.45Å; R367-P387 HydrophobicContact CG-CG 3.82Å; P387-V389 WeakPolarHBondContact O-CG1 3.24Å; P387-V389 PolarHBondContact O-N 2.6Å
388	Q	66.8	Low	76.3	Confident	56 Å²	56	19.2 Å²	19.2	26%	0.262	10%	0.103	S	C	.	.	P	Polyproline II helix	trans	-56.4	124.2	-178.1	-78.6	169.8	21.3	0	0	111.7	R416 R419	Q388-R416 WeakPolarHBondContact CA-O 3.36Å; Q388-R419 VanDerWaalsContact CD-CB 3.41Å; Q388-R419 HydrophobicContact CG-CB 4.05Å; Q388-R419 PolarHBondContact OE1-O 2.85Å; Q388-R419 VanDerWaalsContact OE1-O 3.1Å
389	V	76	Confident	77.2	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.03	11%	0.113	C	C	.	.			trans	-107.6	148.5	176.5	-69	0	0	0	0	110.7	Q322 I324 F366 P387 L391 I392 R416 S417	Q322-V389 HydrophobicContact CB-CG1 3.91Å; Q322-V389 WeakPolarHBondContact O-CB 3.37Å; I324-V389 HydrophobicContact CD1-CG1 3.92Å; I324-V389 HydrophobicContact CD1-CG2 3.87Å; I324-V389 HydrophobicContact CG1-CB 4.37Å; I324-V389 HydrophobicContact CG1-CG1 3.7Å; I324-V389 HydrophobicContact CG1-CG2 3.99Å; F366-V389 HydrophobicContact CE1-CG1 3.75Å; F366-V389 HydrophobicContact CZ-CG1 3.59Å; P387-V389 WeakPolarHBondContact O-CG1 3.24Å; P387-V389 PolarHBondContact O-N 2.6Å; V389-L391 VanDerWaalsContact C-N 3.35Å; V389-I392 HydrophobicContact CG2-CD1 4.08Å; V389-I392 HydrophobicContact CG2-CG1 3.59Å; V389-R416 PolarHBondContact N-O 3.09Å; V389-S417 WeakPolarHBondContact O-CA 3.25Å; V389-S417 WeakPolarHBondContact O-CB 3.28Å; V389-S417 PolarHBondContact O-OG 3.11Å
390	N	79.3	Confident	78.4	Confident	72 Å²	72	20.6 Å²	20.6	39%	0.385	11%	0.113	S	C	.	.	S	Bend	trans	-75.7	-32.2	176	-65.2	89.3	0	0	0	111.1	Q322 S417 V425	Q322-N390 PolarHBondContact O-N 3.45Å; Q322-N390 VanDerWaalsContact O-N 3.09Å; N390-S417 PolarHBondContact O-OG 3.41Å; N390-V425 PolarHBondContact O-N 3.21Å
391	L	87	Confident	79.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.2	-172.3	179.5	62.4	0	0	0	111	I314 V320 A323 I324 V389 I393 V425 V427	I314-L391 HydrophobicContact CG2-CD2 3.66Å; V320-L391 HydrophobicContact CG1-CB 4.18Å; V320-L391 HydrophobicContact CG1-CD2 3.88Å; V320-L391 HydrophobicContact CG2-CD2 4.12Å; A323-L391 WeakPolarHBondContact CA-O 3.27Å; A323-L391 HydrophobicContact CB-CB 4.02Å; A323-L391 HydrophobicContact CB-CD2 4.35Å; A323-L391 HydrophobicContact CB-CG 4.37Å; I324-L391 PolarHBondContact N-O 3.31Å; I324-L391 VanDerWaalsContact N-O 3.1Å; V389-L391 VanDerWaalsContact C-N 3.35Å; L391-I393 HydrophobicContact CD1-CG1 4.27Å; L391-I393 HydrophobicContact CD2-CD1 3.96Å; L391-I393 HydrophobicContact CD2-CG1 4.14Å; L391-I393 HydrophobicContact CG-CD1 4.33Å; L391-I393 HydrophobicContact CG-CG1 3.94Å; L391-V425 CarbonylContact C-O 3.59Å; L391-V425 WeakPolarHBondContact CA-O 3.39Å; L391-V425 HydrophobicContact CD1-CB 4.14Å; L391-V425 HydrophobicContact CD1-CG1 4.07Å; L391-V427 HydrophobicContact CD1-CG2 3.97Å
392	I	90	Very high	80.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.9	171	-69.6	171	0	0	0	107.7	F326 V389 R413 I414 R416 V425 A426 V427	F326-I392 HydrophobicContact CD2-CG2 3.92Å; F326-I392 HydrophobicContact CE2-CG2 3.66Å; V389-I392 HydrophobicContact CG2-CD1 4.08Å; V389-I392 HydrophobicContact CG2-CG1 3.59Å; I392-R413 WeakPolarHBondContact CD1-O 3.34Å; I392-I414 HydrophobicContact CG2-CG2 4.43Å; I392-R416 HydrophobicContact CD1-CB 4.18Å; I392-V425 PolarHBondContact N-O 3.22Å; I392-A426 HydrophobicContact CB-CB 4.31Å; I392-A426 CarbonylContact O-C 3.59Å; I392-A426 WeakPolarHBondContact O-CA 3.27Å; I392-V427 PolarHBondContact O-N 3.05Å
393	I	92.9	Very high	81.7	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	110.4	174.8	-54.9	-176.7	0	0	0	107.1	L311 Y315 I324 I325 F326 L391 W395 V427 F429	L311-I393 HydrophobicContact CD1-CD1 3.22Å; L311-I393 HydrophobicContact CD1-CG2 4.26Å; Y315-I393 HydrophobicContact CE2-CD1 4.11Å; I324-I393 PolarHBondContact O-N 2.81Å; I325-I393 CarbonylContact C-O 3.58Å; I325-I393 WeakPolarHBondContact CA-O 3.42Å; I325-I393 HydrophobicContact CG1-CB 4.19Å; I325-I393 HydrophobicContact CG1-CD1 4.39Å; I325-I393 HydrophobicContact CG2-CB 4.3Å; I325-I393 HydrophobicContact CG2-CG2 4.31Å; F326-I393 PolarHBondContact N-O 3.39Å; L391-I393 HydrophobicContact CD1-CG1 4.27Å; L391-I393 HydrophobicContact CD2-CD1 3.96Å; L391-I393 HydrophobicContact CD2-CG1 4.14Å; L391-I393 HydrophobicContact CG-CD1 4.33Å; L391-I393 HydrophobicContact CG-CG1 3.94Å; I393-W395 VanDerWaalsContact C-N 3.25Å; I393-W395 PolarHBondContact O-N 2.79Å; I393-V427 WeakPolarHBondContact CA-O 3.41Å; I393-F429 HydrophobicContact CG2-CD1 4.39Å; I393-F429 HydrophobicContact CG2-CD2 4.2Å; I393-F429 HydrophobicContact CG2-CE1 4.23Å; I393-F429 HydrophobicContact CG2-CE2 4.07Å; I393-F429 HydrophobicContact CG2-CG 4.39Å; I393-F429 HydrophobicContact CG2-CZ 4.09Å
394	N	94.3	Very high	83.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	87.5	165	-71.6	-48.3	0	0	0	106.8	N396 M397 R413 V427 N428 F429	N394-N396 PolarHBondContact O-N 3.01Å; N394-M397 HydrophobicContact CB-SD 4.35Å; N394-R413 WeakPolarHBondContact OD1-CD 3.39Å; N394-R413 PolarHBondContact OD1-NH1 3.43Å; N394-V427 PolarHBondContact N-O 3Å; N394-N428 PolarHBondContact ND2-OD1 3.1Å; N394-F429 WeakPolarHBondContact O-CB 3.4Å; N394-F429 PolarHBondContact O-N 3.36Å
395	W	94.9	Very high	84.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-58.2	-44.4	174.1	178.2	-97.6	0	0	0	108.6	K307 Y308 L311 I325 F326 W335 L336 I393 F429	K307-W395 HydrophobicContact CB-CH2 4.08Å; K307-W395 HydrophobicContact CB-CZ3 4.43Å; K307-W395 HydrophobicContact CD-CD2 4.31Å; K307-W395 HydrophobicContact CD-CE3 4.45Å; K307-W395 HydrophobicContact CD-CH2 4.06Å; K307-W395 HydrophobicContact CD-CZ2 3.9Å; K307-W395 HydrophobicContact CD-CZ3 4.34Å; K307-W395 WeakPolarHBondContact CE-O 3.24Å; K307-W395 HydrophobicContact CG-CD2 4.47Å; K307-W395 HydrophobicContact CG-CE3 4.12Å; K307-W395 HydrophobicContact CG-CH2 3.69Å; K307-W395 HydrophobicContact CG-CZ2 4.08Å; K307-W395 HydrophobicContact CG-CZ3 3.72Å; K307-W395 PolarHBondContact NZ-O 3.2Å; Y308-W395 HydrophobicContact CD2-CH2 4.31Å; L311-W395 HydrophobicContact CB-CZ3 4.2Å; L311-W395 HydrophobicContact CD2-CE3 4.28Å; L311-W395 HydrophobicContact CD2-CZ3 3.97Å; I325-W395 HydrophobicContact CG2-CB 3.58Å; I325-W395 HydrophobicContact CG2-CG 4.46Å; F326-W395 WeakPolarHBondContact O-CA 3.46Å; F326-W395 VanDerWaalsContact O-CB 3.31Å; F326-W395 WeakPolarHBondContact O-CB 3.3Å; F326-W395 PolarHBondContact O-N 2.89Å; W335-W395 HydrophobicContact CZ3-CH2 4.14Å; W335-W395 AromaticContact CZ3-CZ2 3.94Å; W335-W395 HydrophobicContact CZ3-CZ2 3.94Å; L336-W395 HydrophobicContact CD1-CE3 4.47Å; L336-W395 HydrophobicContact CD1-CH2 4.32Å; L336-W395 HydrophobicContact CD1-CZ3 4.22Å; L336-W395 HydrophobicContact CD2-CD2 4.46Å; L336-W395 HydrophobicContact CD2-CE3 4.47Å; I393-W395 VanDerWaalsContact C-N 3.25Å; I393-W395 PolarHBondContact O-N 2.79Å; W395-F429 HydrophobicContact CD2-CD2 4.44Å; W395-F429 AromaticContact CE3-CD2 3.66Å; W395-F429 HydrophobicContact CE3-CD2 3.66Å; W395-F429 AromaticContact CE3-CE2 3.83Å; W395-F429 HydrophobicContact CE3-CE2 3.83Å; W395-F429 HydrophobicContact CZ3-CD2 4.02Å; W395-F429 AromaticContact CZ3-CE2 3.91Å; W395-F429 HydrophobicContact CZ3-CE2 3.91Å
396	N	93.7	Very high	85.6	Confident	16 Å²	16	37.5 Å²	37.5	9%	0.086	20%	0.199	C	C	.	.	S	Bend	trans	-117.3	145.1	162.4	-50.5	91.1	0	0	0	110.2	F326 C327 A328 E332 N394 R413	F326-N396 PolarHBondContact O-N 2.78Å; C327-N396 WeakPolarHBondContact CA-OD1 3.36Å; A328-N396 HydrophobicContact CB-CB 3.68Å; A328-N396 PolarHBondContact N-OD1 3.07Å; E332-N396 PolarHBondContact OE1-ND2 3.01Å; E332-N396 PolarHBondContact OE1-OD1 3.4Å; E332-N396 PolarHBondContact OE2-OD1 3.44Å; N394-N396 PolarHBondContact O-N 3.01Å; N396-R413 PolarHBondContact O-NH1 3.05Å
397	M	93.4	Very high	86.5	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.025	22%	0.216	C	C	.	.			trans	-62.7	139.7	172.3	-68.8	-57.6	-72.8	0	0	110.8	N394 T399 Y410 N428 I430 L437 I438 L441	N394-M397 HydrophobicContact CB-SD 4.35Å; M397-T399 PolarHBondContact O-N 3.48Å; M397-Y410 HydrophobicContact CE-CD2 4.33Å; M397-Y410 HydrophobicContact CE-CE2 4.12Å; M397-N428 HydrophobicContact CE-CB 4.44Å; M397-N428 HydrophobicContact SD-CB 3.69Å; M397-I430 HydrophobicContact CG-CG2 3.53Å; M397-I430 HydrophobicContact SD-CG2 4.04Å; M397-L437 HydrophobicContact CB-CD1 3.69Å; M397-L437 HydrophobicContact CG-CD1 4.11Å; M397-I438 HydrophobicContact CE-CD1 3.79Å; M397-I438 HydrophobicContact SD-CD1 4.3Å; M397-L441 HydrophobicContact CE-CD1 3.26Å
398	P	90.3	Very high	87.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	23%	0.229	C	C	.	.			trans	-68.5	121	171.2	28.5	-31.7	0	0	0	109.2	D406 T409 Y410	P398-D406 HydrophobicContact CB-CB 4.22Å; P398-D406 PolarHBondContact O-N 3.36Å; P398-T409 HydrophobicContact CB-CG2 3.73Å; P398-Y410 HydrophobicContact CG-CD2 3.86Å; P398-Y410 HydrophobicContact CG-CG 4.31Å
399	T	91	Very high	87.7	Confident	60 Å²	60	43 Å²	43	37%	0.368	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-124.2	148.6	178.2	55.9	0	0	0	0	111.4	M397 K404 L437	M397-T399 PolarHBondContact O-N 3.48Å; T399-K404 CarbonylContact C-O 3.54Å; T399-K404 VanDerWaalsContact CA-O 3.24Å; T399-K404 WeakPolarHBondContact CA-O 3.37Å; T399-L437 HydrophobicContact CG2-CD1 3.78Å; T399-L437 HydrophobicContact CG2-CD2 3.92Å
400	T	86.9	Confident	88.2	Confident	43 Å²	43	42.8 Å²	42.8	26%	0.264	22%	0.218	S	C	.	.			trans	-73.9	168	170.1	67	0	0	0	0	110.3	T402 G403 K404 D406	T400-T402 PolarHBondContact O-N 3.06Å; T400-T402 PolarHBondContact OG1-N 3.38Å; T400-T402 PolarHBondContact OG1-OG1 3.11Å; T400-G403 PolarHBondContact O-N 3.22Å; T400-K404 PolarHBondContact N-O 2.89Å; T400-K404 PolarHBondContact OG1-N 3.34Å; T400-K404 PolarHBondContact OG1-O 2.54Å; T400-D406 HydrophobicContact CG2-CB 3.98Å
401	K	82.9	Confident	88.2	Confident	223 Å²	223	40.8 Å²	40.8	97%	0.97	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-19.2	172.5	-63.8	-171.2	178.5	-172.6	0	114.1
402	T	87.6	Confident	87.6	Confident	111 Å²	111	43.7 Å²	43.7	68%	0.681	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	2.7	178.8	63.9	0	0	0	0	113.7	T400 K404	T400-T402 PolarHBondContact O-N 3.06Å; T400-T402 PolarHBondContact OG1-N 3.38Å; T400-T402 PolarHBondContact OG1-OG1 3.11Å; T402-K404 VanDerWaalsContact C-N 3.28Å; T402-K404 PolarHBondContact O-N 3.29Å
403	G	88.6	Confident	87.3	Confident	29 Å²	29	44 Å²	44	30%	0.299	22%	0.221	S	C	.	.	S	Bend	trans	83.5	-8.3	-177.6	0	0	0	0	0	114.9	T400 Y436 L437	T400-G403 PolarHBondContact O-N 3.22Å; G403-Y436 PolarHBondContact O-OH 3.45Å; G403-L437 WeakPolarHBondContact O-CD2 3.49Å
404	K	91.8	Very high	86.7	Confident	112 Å²	112	44 Å²	44	49%	0.487	22%	0.221	S	C	.	.	S	Bend	trans	-69.6	155.7	174.3	-61.4	-173.4	177.2	-171.9	0	112	T399 T400 T402 D406	T399-K404 CarbonylContact C-O 3.54Å; T399-K404 VanDerWaalsContact CA-O 3.24Å; T399-K404 WeakPolarHBondContact CA-O 3.37Å; T400-K404 PolarHBondContact N-O 2.89Å; T400-K404 PolarHBondContact OG1-N 3.34Å; T400-K404 PolarHBondContact OG1-O 2.54Å; T402-K404 VanDerWaalsContact C-N 3.28Å; T402-K404 PolarHBondContact O-N 3.29Å; K404-D406 PolarHBondContact O-N 2.63Å
405	A	91.6	Very high	85.6	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.008	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-54.9	132.5	172.4	0	0	0	0	0	111.1	W407 L437 E440 L441	A405-W407 WeakPolarHBondContact O-CZ3 3.41Å; A405-W407 PolarHBondContact O-N 2.84Å; A405-L437 HydrophobicContact CB-CD2 4.1Å; A405-E440 HydrophobicContact CB-CB 4.02Å; A405-E440 PolarHBondContact N-OE2 2.98Å; A405-L441 HydrophobicContact CB-CD2 4.11Å; A405-L441 HydrophobicContact CB-CG 4.07Å
406	D	88.2	Confident	84.3	Confident	22 Å²	22	45.8 Å²	45.8	12%	0.118	23%	0.23	C	C	.	.			trans	-92.5	87.9	170.1	-179.9	-8.7	0	0	0	108.5	R382 P398 T400 K404 E408 T409 Y410	R382-D406 IonicContact NH1-OD2 3.19Å; R382-D406 PolarHBondContact NH1-OD2 3.43Å; P398-D406 HydrophobicContact CB-CB 4.22Å; P398-D406 PolarHBondContact O-N 3.36Å; T400-D406 HydrophobicContact CG2-CB 3.98Å; K404-D406 PolarHBondContact O-N 2.63Å; D406-E408 VanDerWaalsContact C-N 3.28Å; D406-E408 PolarHBondContact O-N 3.47Å; D406-E408 PolarHBondContact OD1-N 3.05Å; D406-T409 VanDerWaalsContact CG-CB 3.49Å; D406-T409 PolarHBondContact O-N 3.09Å; D406-T409 PolarHBondContact OD1-N 2.93Å; D406-T409 PolarHBondContact OD1-OG1 3.49Å; D406-T409 WeakPolarHBondContact OD2-CB 2.81Å; D406-T409 PolarHBondContact OD2-OG1 2.95Å; D406-Y410 WeakPolarHBondContact O-CB 3.43Å; D406-Y410 PolarHBondContact O-N 3.47Å
407	W	85.2	Confident	82.7	Confident	102 Å²	102	45.1 Å²	45.1	39%	0.386	23%	0.227	S	C	.	.	H	α-helix	trans	-59.6	-34.5	-179.3	39.5	84	0	0	0	113	A405 Y410 L411 L441 H444 F445	A405-W407 WeakPolarHBondContact O-CZ3 3.41Å; A405-W407 PolarHBondContact O-N 2.84Å; W407-Y410 PolarHBondContact O-N 2.85Å; W407-L411 VanDerWaalsContact O-CB 3.3Å; W407-L411 WeakPolarHBondContact O-CB 3.42Å; W407-L411 PolarHBondContact O-N 3.28Å; W407-L441 HydrophobicContact CB-CD2 4.31Å; W407-H444 AromaticContact CD1-CE1 3.75Å; W407-H444 AromaticContact CD1-NE2 3.59Å; W407-H444 AromaticContact CG-CD2 3.86Å; W407-H444 AromaticContact CG-CE1 3.86Å; W407-H444 AromaticContact CG-NE2 3.65Å; W407-F445 HydrophobicContact CB-CE2 3.95Å; W407-F445 HydrophobicContact CB-CZ 3.77Å; W407-F445 WeakPolarHBondContact O-CZ 3.28Å
408	E	76.1	Confident	80.8	Confident	94 Å²	94	45.3 Å²	45.3	44%	0.439	23%	0.23	S	C	.	.	H	α-helix	trans	-68.2	-47.6	179.2	-166.9	-163.7	136.1	0	0	110.7	R382 D406 Y410 L411 H412	R382-E408 IonicContact CZ-OE1 3.41Å; R382-E408 IonicContact NH2-OE1 2.83Å; R382-E408 PolarHBondContact NH2-OE1 2.9Å; R382-E408 IonicContact NH2-OE2 3.91Å; R382-E408 PolarHBondContact NH2-OE2 3.32Å; R382-E408 VanDerWaalsContact NH2-OE2 3.08Å; D406-E408 VanDerWaalsContact C-N 3.28Å; D406-E408 PolarHBondContact O-N 3.47Å; D406-E408 PolarHBondContact OD1-N 3.05Å; E408-Y410 VanDerWaalsContact C-N 3.33Å; E408-Y410 PolarHBondContact O-N 3.27Å; E408-L411 PolarHBondContact O-N 2.82Å; E408-H412 VanDerWaalsContact O-CG 3.3Å; E408-H412 PolarHBondContact O-N 2.91Å; E408-H412 IonicContact OE1-CE1 3.05Å
409	T	80.7	Confident	79	Confident	8 Å²	8	47.7 Å²	47.7	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-41.8	174.9	-64	0	0	0	0	110.9	R382 P398 D406 L411 H412 R413	R382-T409 PolarHBondContact NH1-OG1 3.38Å; R382-T409 VanDerWaalsContact NH1-OG1 3.09Å; P398-T409 HydrophobicContact CB-CG2 3.73Å; D406-T409 VanDerWaalsContact CG-CB 3.49Å; D406-T409 PolarHBondContact O-N 3.09Å; D406-T409 PolarHBondContact OD1-N 2.93Å; D406-T409 PolarHBondContact OD1-OG1 3.49Å; D406-T409 WeakPolarHBondContact OD2-CB 2.81Å; D406-T409 PolarHBondContact OD2-OG1 2.95Å; T409-L411 PolarHBondContact O-N 3.08Å; T409-H412 PolarHBondContact O-N 2.77Å; T409-R413 HydrophobicContact CG2-CG 4.48Å; T409-R413 WeakPolarHBondContact O-CG 3.3Å; T409-R413 PolarHBondContact O-N 3.25Å
410	Y	86.2	Confident	76.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-55.6	-52.8	176.4	-174.1	-96.1	0	0	0	111.8	Q296 M397 P398 D406 W407 E408 H412 R413 I414 N428 L441 F445	Q296-Y410 PolarHBondContact OE1-OH 2.89Å; M397-Y410 HydrophobicContact CE-CD2 4.33Å; M397-Y410 HydrophobicContact CE-CE2 4.12Å; P398-Y410 HydrophobicContact CG-CD2 3.86Å; P398-Y410 HydrophobicContact CG-CG 4.31Å; D406-Y410 WeakPolarHBondContact O-CB 3.43Å; D406-Y410 PolarHBondContact O-N 3.47Å; W407-Y410 PolarHBondContact O-N 2.85Å; E408-Y410 VanDerWaalsContact C-N 3.33Å; E408-Y410 PolarHBondContact O-N 3.27Å; Y410-H412 VanDerWaalsContact C-N 3.29Å; Y410-H412 PolarHBondContact O-N 2.86Å; Y410-R413 WeakPolarHBondContact O-CB 3.46Å; Y410-R413 PolarHBondContact O-N 3.42Å; Y410-R413 VanDerWaalsContact O-N 3.14Å; Y410-I414 HydrophobicContact CD1-CD1 3.93Å; Y410-I414 HydrophobicContact CD1-CG1 4.31Å; Y410-I414 HydrophobicContact CE1-CD1 3.39Å; Y410-I414 HydrophobicContact CE1-CG1 4.15Å; Y410-I414 HydrophobicContact CE1-CG2 4.19Å; Y410-I414 HydrophobicContact CE2-CG2 4.4Å; Y410-I414 WeakPolarHBondContact O-CG1 3.31Å; Y410-I414 PolarHBondContact O-N 3.1Å; Y410-N428 WeakPolarHBondContact CE2-OD1 3.4Å; Y410-N428 PolarHBondContact OH-ND2 3.13Å; Y410-N428 PolarHBondContact OH-OD1 3.21Å; Y410-L441 HydrophobicContact CD1-CD1 4.3Å; Y410-L441 HydrophobicContact CD1-CD2 4Å; Y410-L441 HydrophobicContact CD2-CD1 3.6Å; Y410-L441 HydrophobicContact CD2-CD2 4.25Å; Y410-L441 HydrophobicContact CE1-CD1 4.26Å; Y410-L441 HydrophobicContact CE2-CD1 3.54Å; Y410-L441 HydrophobicContact CG-CD1 3.98Å; Y410-L441 HydrophobicContact CG-CD2 3.81Å; Y410-F445 AromaticContact CD1-CE2 3.94Å; Y410-F445 HydrophobicContact CD1-CE2 3.94Å
411	L	79.4	Confident	75	Confident	30 Å²	30	52.6 Å²	52.6	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-40.9	179.9	-174.1	61.7	0	0	0	111.6	L289 L291 W407 E408 T409 G415 F445	L289-L411 HydrophobicContact CB-CD1 3.97Å; L289-L411 HydrophobicContact CB-CD2 4.24Å; L289-L411 HydrophobicContact CB-CG 4.23Å; L289-L411 HydrophobicContact CD1-CD1 4.39Å; L289-L411 HydrophobicContact CD1-CD2 3.72Å; L289-L411 HydrophobicContact CD1-CG 3.74Å; L291-L411 HydrophobicContact CD1-CD1 4.18Å; L291-L411 HydrophobicContact CD2-CD1 3.44Å; L291-L411 VanDerWaalsContact CD2-CD1 3.44Å; L291-L411 HydrophobicContact CG-CD1 3.86Å; W407-L411 VanDerWaalsContact O-CB 3.3Å; W407-L411 WeakPolarHBondContact O-CB 3.42Å; W407-L411 PolarHBondContact O-N 3.28Å; E408-L411 PolarHBondContact O-N 2.82Å; T409-L411 PolarHBondContact O-N 3.08Å; L411-G415 PolarHBondContact O-N 2.91Å; L411-F445 HydrophobicContact CB-CE1 4.43Å; L411-F445 HydrophobicContact CB-CZ 4.05Å; L411-F445 HydrophobicContact CD1-CE1 4.29Å; L411-F445 HydrophobicContact CD2-CE1 4.23Å
412	H	74.4	Confident	73.8	Confident	60 Å²	60	48.7 Å²	48.7	28%	0.278	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-35.5	176.9	-74.5	177.2	0	0	0	113.8	E408 T409 Y410 R416	E408-H412 VanDerWaalsContact O-CG 3.3Å; E408-H412 PolarHBondContact O-N 2.91Å; E408-H412 IonicContact OE1-CE1 3.05Å; T409-H412 PolarHBondContact O-N 2.77Å; Y410-H412 VanDerWaalsContact C-N 3.29Å; Y410-H412 PolarHBondContact O-N 2.86Å; H412-R416 PolarHBondContact O-NE 3.28Å
413	R	82.7	Confident	72.9	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-61.7	174.3	-72.1	-179.2	-173.1	176.7	13.7	109.8	F326 N378 I392 N394 N396 T409 Y410 G415 R416	F326-R413 VanDerWaalsContact CB-NH1 3.32Å; F326-R413 HydrophobicContact CD1-CG 3.96Å; F326-R413 HydrophobicContact CD2-CB 4.25Å; F326-R413 HydrophobicContact CD2-CG 3.99Å; F326-R413 HydrophobicContact CE1-CG 3.75Å; F326-R413 HydrophobicContact CE2-CB 3.76Å; F326-R413 HydrophobicContact CE2-CG 3.76Å; F326-R413 HydrophobicContact CG-CG 4.08Å; F326-R413 HydrophobicContact CZ-CB 3.93Å; F326-R413 HydrophobicContact CZ-CG 3.64Å; N378-R413 PolarHBondContact ND2-NH2 3.26Å; N378-R413 PolarHBondContact OD1-NH2 3.15Å; I392-R413 WeakPolarHBondContact CD1-O 3.34Å; N394-R413 WeakPolarHBondContact OD1-CD 3.39Å; N394-R413 PolarHBondContact OD1-NH1 3.43Å; N396-R413 PolarHBondContact O-NH1 3.05Å; T409-R413 HydrophobicContact CG2-CG 4.48Å; T409-R413 WeakPolarHBondContact O-CG 3.3Å; T409-R413 PolarHBondContact O-N 3.25Å; Y410-R413 WeakPolarHBondContact O-CB 3.46Å; Y410-R413 PolarHBondContact O-N 3.42Å; Y410-R413 VanDerWaalsContact O-N 3.14Å; R413-G415 VanDerWaalsContact C-N 3.26Å; R413-G415 PolarHBondContact O-N 2.9Å; R413-R416 VanDerWaalsContact O-CB 3.32Å; R413-R416 WeakPolarHBondContact O-CB 3.36Å; R413-R416 VanDerWaalsContact O-CG 3.26Å; R413-R416 WeakPolarHBondContact O-CG 3.34Å; R413-R416 PolarHBondContact O-N 2.96Å
414	I	81.1	Confident	72.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-29.9	-170.2	68.4	167	0	0	0	112.3	L291 I294 Q296 I392 Y410 R416 S417 A426	L291-I414 HydrophobicContact CD2-CD1 3.32Å; L291-I414 HydrophobicContact CD2-CG1 3.94Å; I294-I414 HydrophobicContact CD1-CB 4.36Å; I294-I414 HydrophobicContact CD1-CG1 4.27Å; I294-I414 WeakPolarHBondContact CD1-O 3.27Å; I294-I414 HydrophobicContact CG2-CB 4.46Å; Q296-I414 HydrophobicContact CG-CD1 4.2Å; I392-I414 HydrophobicContact CG2-CG2 4.43Å; Y410-I414 HydrophobicContact CD1-CD1 3.93Å; Y410-I414 HydrophobicContact CD1-CG1 4.31Å; Y410-I414 HydrophobicContact CE1-CD1 3.39Å; Y410-I414 HydrophobicContact CE1-CG1 4.15Å; Y410-I414 HydrophobicContact CE1-CG2 4.19Å; Y410-I414 HydrophobicContact CE2-CG2 4.4Å; Y410-I414 WeakPolarHBondContact O-CG1 3.31Å; Y410-I414 PolarHBondContact O-N 3.1Å; I414-R416 PolarHBondContact O-N 2.86Å; I414-S417 PolarHBondContact O-N 3.24Å; I414-A426 HydrophobicContact CB-CB 4.1Å; I414-A426 HydrophobicContact CG2-CB 3.55Å
415	G	71	Confident	72.2	Confident	7 Å²	7	43 Å²	43	7%	0.072	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-5.8	173.4	0	0	0	0	0	115.3	L411 R413 S417 R419	L411-G415 PolarHBondContact O-N 2.91Å; R413-G415 VanDerWaalsContact C-N 3.26Å; R413-G415 PolarHBondContact O-N 2.9Å; G415-S417 VanDerWaalsContact C-N 3.32Å; G415-R419 PolarHBondContact O-NE 3.31Å; G415-R419 PolarHBondContact O-NH2 2.89Å
416	R	66.3	Low	72.1	Confident	31 Å²	31	43 Å²	43	12%	0.117	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.1	169	-54.5	-62.6	146.1	-172.1	6.9	113.2	L384 D385 Q388 V389 I392 H412 R413 I414	L384-R416 VanDerWaalsContact O-CZ 3.27Å; L384-R416 PolarHBondContact O-NE 3.14Å; D385-R416 IonicContact OD1-CZ 3.2Å; D385-R416 IonicContact OD1-NH1 2.77Å; D385-R416 PolarHBondContact OD1-NH1 2.97Å; Q388-R416 WeakPolarHBondContact CA-O 3.36Å; V389-R416 PolarHBondContact N-O 3.09Å; I392-R416 HydrophobicContact CD1-CB 4.18Å; H412-R416 PolarHBondContact O-NE 3.28Å; R413-R416 VanDerWaalsContact O-CB 3.32Å; R413-R416 WeakPolarHBondContact O-CB 3.36Å; R413-R416 VanDerWaalsContact O-CG 3.26Å; R413-R416 WeakPolarHBondContact O-CG 3.34Å; R413-R416 PolarHBondContact O-N 2.96Å; I414-R416 PolarHBondContact O-N 2.86Å
417	S	60.6	Low	72.4	Confident	2 Å²	2	42 Å²	42	1%	0.014	21%	0.209	C	C	.	.	S	Bend	trans	-107.4	163	172.3	-158.1	0	0	0	0	110.4	I294 V389 N390 I414 G415 R419 G424	I294-S417 WeakPolarHBondContact CG1-O 3.42Å; V389-S417 WeakPolarHBondContact O-CA 3.25Å; V389-S417 WeakPolarHBondContact O-CB 3.28Å; V389-S417 PolarHBondContact O-OG 3.11Å; N390-S417 PolarHBondContact O-OG 3.41Å; I414-S417 PolarHBondContact O-N 3.24Å; G415-S417 VanDerWaalsContact C-N 3.32Å; S417-R419 PolarHBondContact O-N 3.25Å; S417-G424 WeakPolarHBondContact OG-CA 3.31Å
418	G	53.7	Low	72.9	Confident	8 Å²	8	37.2 Å²	37.2	8%	0.082	19%	0.19	C	C	.	.	S	Bend	trans	81.2	12.5	170.7	0	0	0	0	0	117.5	N293 K422	N293-G418 WeakPolarHBondContact CB-O 3.19Å; N293-G418 PolarHBondContact ND2-O 2.9Å; G418-K422 CarbonylContact C-O 3.54Å; G418-K422 WeakPolarHBondContact CA-O 3.3Å
419	R	53.1	Low	73.8	Confident	52 Å²	52	32.7 Å²	32.7	20%	0.196	17%	0.169	C	C	.	.			trans	-96	154.8	-179.2	-71.3	-177.5	-168.7	-164.2	-0.6	111.4	F53 Q388 G415 S417 G421	F53-R419 VanDerWaalsContact CE1-NH1 3.26Å; Q388-R419 VanDerWaalsContact CD-CB 3.41Å; Q388-R419 HydrophobicContact CG-CB 4.05Å; Q388-R419 PolarHBondContact OE1-O 2.85Å; Q388-R419 VanDerWaalsContact OE1-O 3.1Å; G415-R419 PolarHBondContact O-NE 3.31Å; G415-R419 PolarHBondContact O-NH2 2.89Å; S417-R419 PolarHBondContact O-N 3.25Å; R419-G421 PolarHBondContact O-N 3.49Å
420	F	45.8	Very low	74.5	Confident	137 Å²	137	32.3 Å²	32.3	60%	0.601	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	33.6	-174	-53.8	-59.4	0	0	0	116	K422	F420-K422 PolarHBondContact O-N 3.47Å
421	G	46.7	Very low	74.9	Confident	68 Å²	68	34.2 Å²	34.2	70%	0.701	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	3.7	175.1	0	0	0	0	0	114.9	R419	R419-G421 PolarHBondContact O-N 3.49Å
422	K	58.6	Low	75.4	Confident	142 Å²	142	37.4 Å²	37.4	62%	0.617	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-80.9	135.1	167.3	-66.4	-172	177	-174.1	0	108.9	G418 F420	G418-K422 CarbonylContact C-O 3.54Å; G418-K422 WeakPolarHBondContact CA-O 3.3Å; F420-K422 PolarHBondContact O-N 3.47Å
423	E	68.8	Low	76.3	Confident	124 Å²	124	40.4 Å²	40.4	58%	0.579	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-68.3	132.4	173.4	-64	-168.6	156.9	0	0	109.8	K295	K295-E423 WeakPolarHBondContact CE-OE2 3.36Å; K295-E423 IonicContact NZ-OE1 3.59Å; K295-E423 PolarHBondContact NZ-OE1 2.55Å; K295-E423 IonicContact NZ-OE2 3.65Å; K295-E423 PolarHBondContact NZ-OE2 3.43Å
424	G	78.6	Confident	76.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	149	172.4	0	0	0	0	0	111.8	N293 I294 K295 S417	N293-G424 PolarHBondContact O-N 3.36Å; N293-G424 VanDerWaalsContact O-N 3.13Å; I294-G424 CarbonylContact C-O 3.54Å; I294-G424 WeakPolarHBondContact CA-O 3.3Å; K295-G424 PolarHBondContact N-O 2.87Å; S417-G424 WeakPolarHBondContact OG-CA 3.31Å
425	V	86.5	Confident	77.5	Confident	9 Å²	9	44.6 Å²	44.6	6%	0.055	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.3	173.1	-175.1	0	0	0	0	109.6	K295 F297 F318 N390 L391 I392 V427 F460	K295-V425 CarbonylContact O-C 3.47Å; K295-V425 WeakPolarHBondContact O-CA 3.33Å; F297-V425 HydrophobicContact CD2-CG1 4.11Å; F297-V425 HydrophobicContact CE2-CG1 4.28Å; F318-V425 HydrophobicContact CZ-CG2 4.48Å; N390-V425 PolarHBondContact O-N 3.21Å; L391-V425 CarbonylContact C-O 3.59Å; L391-V425 WeakPolarHBondContact CA-O 3.39Å; L391-V425 HydrophobicContact CD1-CB 4.14Å; L391-V425 HydrophobicContact CD1-CG1 4.07Å; I392-V425 PolarHBondContact N-O 3.22Å; V425-V427 HydrophobicContact CG1-CG2 3.94Å; V425-F460 HydrophobicContact CG2-CD1 3.72Å; V425-F460 HydrophobicContact CG2-CE1 3.8Å; V425-F460 HydrophobicContact CG2-CG 4.37Å
426	A	90.4	Very high	78.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123	170.3	0	0	0	0	0	109.6	I294 K295 Q296 F297 I392 I414	I294-A426 HydrophobicContact CG2-CB 3.99Å; K295-A426 PolarHBondContact O-N 2.86Å; Q296-A426 CarbonylContact C-O 3.51Å; Q296-A426 WeakPolarHBondContact CA-O 3.16Å; Q296-A426 HydrophobicContact CG-CB 4.34Å; F297-A426 PolarHBondContact N-O 3.48Å; I392-A426 HydrophobicContact CB-CB 4.31Å; I392-A426 CarbonylContact O-C 3.59Å; I392-A426 WeakPolarHBondContact O-CA 3.27Å; I414-A426 HydrophobicContact CB-CB 4.1Å; I414-A426 HydrophobicContact CG2-CB 3.55Å
427	V	93.7	Very high	80.1	Confident	2 Å²	2	48 Å²	48	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.4	178.2	-170.2	0	0	0	0	109.2	F297 M299 I314 L391 I392 I393 N394 V425 F429 L452	F297-V427 WeakPolarHBondContact O-CA 3.5Å; M299-V427 HydrophobicContact CG-CG1 4.02Å; M299-V427 HydrophobicContact SD-CG1 4.14Å; I314-V427 HydrophobicContact CD1-CG1 4.33Å; L391-V427 HydrophobicContact CD1-CG2 3.97Å; I392-V427 PolarHBondContact O-N 3.05Å; I393-V427 WeakPolarHBondContact CA-O 3.41Å; N394-V427 PolarHBondContact N-O 3Å; V425-V427 HydrophobicContact CG1-CG2 3.94Å; V427-F429 HydrophobicContact CG1-CD1 3.96Å; V427-F429 HydrophobicContact CG1-CE1 3.68Å; V427-L452 HydrophobicContact CG1-CD2 4Å; V427-L452 HydrophobicContact CG2-CD2 4.18Å
428	N	95.7	Very high	81.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.5	-174.8	-58.1	-60.7	0	0	0	109.8	F297 Y298 M299 N394 M397 Y410 I438	F297-N428 WeakPolarHBondContact O-CB 3.48Å; F297-N428 PolarHBondContact O-N 3.37Å; F297-N428 PolarHBondContact O-ND2 3.06Å; Y298-N428 CarbonylContact C-O 3.57Å; Y298-N428 WeakPolarHBondContact CA-O 3.36Å; M299-N428 PolarHBondContact N-O 2.87Å; N394-N428 PolarHBondContact ND2-OD1 3.1Å; M397-N428 HydrophobicContact CE-CB 4.44Å; M397-N428 HydrophobicContact SD-CB 3.69Å; Y410-N428 WeakPolarHBondContact CE2-OD1 3.4Å; Y410-N428 PolarHBondContact OH-ND2 3.13Å; Y410-N428 PolarHBondContact OH-OD1 3.21Å; N428-I438 HydrophobicContact CB-CD1 3.87Å
429	F	96.2	Very high	83.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.7	176.8	-69.7	1.9	0	0	0	109.5	M299 F301 K307 A310 L311 I314 I393 N394 W395 V427	M299-F429 HydrophobicContact CB-CD1 4.2Å; M299-F429 HydrophobicContact CB-CE1 4.35Å; M299-F429 HydrophobicContact CG-CE1 4.39Å; M299-F429 HydrophobicContact SD-CD1 4.5Å; M299-F429 HydrophobicContact SD-CE1 3.75Å; M299-F429 HydrophobicContact SD-CZ 4.42Å; F301-F429 HydrophobicContact CD2-CB 4.22Å; F301-F429 HydrophobicContact CD2-CG 4.44Å; F301-F429 HydrophobicContact CE2-CB 3.68Å; F301-F429 AromaticContact CE2-CD1 3.65Å; F301-F429 HydrophobicContact CE2-CD1 3.65Å; F301-F429 AromaticContact CE2-CD2 3.92Å; F301-F429 HydrophobicContact CE2-CD2 3.92Å; F301-F429 HydrophobicContact CE2-CE1 4.16Å; F301-F429 HydrophobicContact CE2-CE2 4.37Å; F301-F429 AromaticContact CE2-CG 3.5Å; F301-F429 HydrophobicContact CE2-CG 3.5Å; F301-F429 HydrophobicContact CE2-CZ 4.48Å; F301-F429 HydrophobicContact CZ-CD1 4.01Å; F301-F429 HydrophobicContact CZ-CD2 4.37Å; F301-F429 HydrophobicContact CZ-CE1 4.04Å; F301-F429 HydrophobicContact CZ-CE2 4.37Å; F301-F429 HydrophobicContact CZ-CG 4.17Å; F301-F429 HydrophobicContact CZ-CZ 4.21Å; K307-F429 HydrophobicContact CD-CB 4.3Å; K307-F429 HydrophobicContact CD-CD2 4.19Å; K307-F429 HydrophobicContact CG-CB 4.17Å; K307-F429 HydrophobicContact CG-CD2 3.37Å; K307-F429 HydrophobicContact CG-CE2 3.98Å; K307-F429 HydrophobicContact CG-CG 4.13Å; K307-F429 WeakPolarHBondContact O-CE2 3.43Å; A310-F429 HydrophobicContact CB-CZ 4.44Å; L311-F429 HydrophobicContact CB-CE2 4.13Å; L311-F429 HydrophobicContact CB-CZ 4.42Å; L311-F429 HydrophobicContact CD1-CE2 4.37Å; L311-F429 HydrophobicContact CD1-CZ 4.46Å; I314-F429 HydrophobicContact CD1-CE1 3.8Å; I314-F429 HydrophobicContact CD1-CZ 3.72Å; I393-F429 HydrophobicContact CG2-CD1 4.39Å; I393-F429 HydrophobicContact CG2-CD2 4.2Å; I393-F429 HydrophobicContact CG2-CE1 4.23Å; I393-F429 HydrophobicContact CG2-CE2 4.07Å; I393-F429 HydrophobicContact CG2-CG 4.39Å; I393-F429 HydrophobicContact CG2-CZ 4.09Å; N394-F429 WeakPolarHBondContact O-CB 3.4Å; N394-F429 PolarHBondContact O-N 3.36Å; W395-F429 HydrophobicContact CD2-CD2 4.44Å; W395-F429 AromaticContact CE3-CD2 3.66Å; W395-F429 HydrophobicContact CE3-CD2 3.66Å; W395-F429 AromaticContact CE3-CE2 3.83Å; W395-F429 HydrophobicContact CE3-CE2 3.83Å; W395-F429 HydrophobicContact CZ3-CD2 4.02Å; W395-F429 AromaticContact CZ3-CE2 3.91Å; W395-F429 HydrophobicContact CZ3-CE2 3.91Å; V427-F429 HydrophobicContact CG1-CD1 3.96Å; V427-F429 HydrophobicContact CG1-CE1 3.68Å
430	I	95.8	Very high	85.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.2	179	58	163.1	0	0	0	110.8	Y298 M299 C300 F301 M397 E434 M435 I438	Y298-I430 HydrophobicContact CD2-CD1 3.96Å; Y298-I430 HydrophobicContact CD2-CG1 4.32Å; Y298-I430 HydrophobicContact CG-CD1 4.47Å; M299-I430 WeakPolarHBondContact O-CG1 2.97Å; M299-I430 PolarHBondContact O-N 3.38Å; C300-I430 WeakPolarHBondContact CA-O 3.46Å; C300-I430 HydrophobicContact CB-CD1 4.37Å; C300-I430 HydrophobicContact CB-CG1 4.25Å; F301-I430 WeakPolarHBondContact CD2-O 3.47Å; F301-I430 PolarHBondContact N-O 3.24Å; M397-I430 HydrophobicContact CG-CG2 3.53Å; M397-I430 HydrophobicContact SD-CG2 4.04Å; I430-E434 HydrophobicContact CB-CB 4.02Å; I430-E434 HydrophobicContact CG2-CB 4.37Å; I430-M435 HydrophobicContact CD1-CB 4.41Å; I430-M435 HydrophobicContact CD1-CE 3.73Å; I430-M435 HydrophobicContact CD1-SD 4.05Å; I430-I438 HydrophobicContact CD1-CG1 3.84Å; I430-I438 HydrophobicContact CG2-CD1 4.08Å; I430-I438 HydrophobicContact CG2-CG1 3.98Å
431	L	93.6	Very high	87.8	Confident	39 Å²	39	46.6 Å²	46.6	20%	0.204	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	161.3	162.6	-61.7	177.5	0	0	0	110.6	F301 D433 E434	F301-L431 HydrophobicContact CB-CD2 4.42Å; F301-L431 WeakPolarHBondContact O-CA 3.14Å; L431-D433 VanDerWaalsContact CB-OD1 3.3Å; L431-D433 WeakPolarHBondContact CB-OD1 3.45Å; L431-D433 PolarHBondContact O-N 2.96Å; L431-D433 VanDerWaalsContact O-N 3.13Å; L431-E434 HydrophobicContact CB-CG 4.18Å; L431-E434 PolarHBondContact N-OE2 2.81Å; L431-E434 WeakPolarHBondContact O-CB 3.46Å; L431-E434 PolarHBondContact O-N 2.91Å
432	N	90.2	Very high	90	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-53.4	-34.1	-178.3	-71.4	-32	0	0	0	114	C300 F301	C300-N432 PolarHBondContact SG-OD1 2.89Å; F301-N432 PolarHBondContact O-N 2.91Å
433	D	92.2	Very high	91.5	Very high	123 Å²	123	42.5 Å²	42.5	66%	0.658	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-84.1	-7.1	178.3	62	-27.3	0	0	0	113.8	L431 Y436	L431-D433 VanDerWaalsContact CB-OD1 3.3Å; L431-D433 WeakPolarHBondContact CB-OD1 3.45Å; L431-D433 PolarHBondContact O-N 2.96Å; L431-D433 VanDerWaalsContact O-N 3.13Å; D433-Y436 WeakPolarHBondContact O-CD1 3.26Å; D433-Y436 VanDerWaalsContact O-CE1 3.27Å; D433-Y436 WeakPolarHBondContact O-CE1 3.45Å
434	E	94.4	Very high	92.4	Very high	41 Å²	41	41 Å²	41	19%	0.192	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-96.4	2.5	-179.8	-67.1	-178.3	134	0	0	113.4	I430 L431 Y436 L437	I430-E434 HydrophobicContact CB-CB 4.02Å; I430-E434 HydrophobicContact CG2-CB 4.37Å; L431-E434 HydrophobicContact CB-CG 4.18Å; L431-E434 PolarHBondContact N-OE2 2.81Å; L431-E434 WeakPolarHBondContact O-CB 3.46Å; L431-E434 PolarHBondContact O-N 2.91Å; E434-Y436 PolarHBondContact O-N 3.45Å; E434-L437 HydrophobicContact CB-CD1 4.08Å; E434-L437 HydrophobicContact CG-CD1 4.3Å; E434-L437 VanDerWaalsContact O-CB 3.3Å; E434-L437 WeakPolarHBondContact O-CB 3.4Å; E434-L437 PolarHBondContact O-N 3.22Å
435	M	94.9	Very high	92.6	Very high	54 Å²	54	42.9 Å²	42.9	27%	0.266	22%	0.215	S	C	.	.	H	α-helix	trans	-54	-30.3	178.6	-178.7	58.9	70.3	0	0	113.1	Y298 I430 L437 I438 K439	Y298-M435 HydrophobicContact CD2-CE 4.37Å; Y298-M435 HydrophobicContact CE2-CE 3.73Å; I430-M435 HydrophobicContact CD1-CB 4.41Å; I430-M435 HydrophobicContact CD1-CE 3.73Å; I430-M435 HydrophobicContact CD1-SD 4.05Å; M435-L437 PolarHBondContact O-N 3.02Å; M435-I438 PolarHBondContact O-N 3.31Å; M435-I438 HydrophobicContact SD-CB 4.43Å; M435-K439 PolarHBondContact O-N 3.2Å
436	Y	95.3	Very high	92.6	Very high	108 Å²	108	51.1 Å²	51.1	42%	0.424	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-31	175.8	74.4	-84.8	0	0	0	112.6	G403 D433 E434 K439 E440	G403-Y436 PolarHBondContact O-OH 3.45Å; D433-Y436 WeakPolarHBondContact O-CD1 3.26Å; D433-Y436 VanDerWaalsContact O-CE1 3.27Å; D433-Y436 WeakPolarHBondContact O-CE1 3.45Å; E434-Y436 PolarHBondContact O-N 3.45Å; Y436-K439 PolarHBondContact O-N 3.2Å; Y436-E440 WeakPolarHBondContact O-CG 3.32Å; Y436-E440 PolarHBondContact O-N 2.92Å
437	L	96.3	Very high	92.5	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-39.7	178.3	-63.7	175.5	0	0	0	111.7	M397 T399 G403 A405 E434 M435 E440 L441	M397-L437 HydrophobicContact CB-CD1 3.69Å; M397-L437 HydrophobicContact CG-CD1 4.11Å; T399-L437 HydrophobicContact CG2-CD1 3.78Å; T399-L437 HydrophobicContact CG2-CD2 3.92Å; G403-L437 WeakPolarHBondContact O-CD2 3.49Å; A405-L437 HydrophobicContact CB-CD2 4.1Å; E434-L437 HydrophobicContact CB-CD1 4.08Å; E434-L437 HydrophobicContact CG-CD1 4.3Å; E434-L437 VanDerWaalsContact O-CB 3.3Å; E434-L437 WeakPolarHBondContact O-CB 3.4Å; E434-L437 PolarHBondContact O-N 3.22Å; M435-L437 PolarHBondContact O-N 3.02Å; L437-E440 PolarHBondContact O-N 3.18Å; L437-L441 WeakPolarHBondContact O-CG 3.39Å; L437-L441 PolarHBondContact O-N 3.46Å; L437-L441 VanDerWaalsContact O-N 3.11Å
438	I	96.1	Very high	92.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-45.3	173.7	-62.3	-60.5	0	0	0	109.7	Y298 M397 N428 I430 M435 E440 L441 E442 I449	Y298-I438 HydrophobicContact CD1-CG2 4.04Å; Y298-I438 HydrophobicContact CG-CG1 4.34Å; M397-I438 HydrophobicContact CE-CD1 3.79Å; M397-I438 HydrophobicContact SD-CD1 4.3Å; N428-I438 HydrophobicContact CB-CD1 3.87Å; I430-I438 HydrophobicContact CD1-CG1 3.84Å; I430-I438 HydrophobicContact CG2-CD1 4.08Å; I430-I438 HydrophobicContact CG2-CG1 3.98Å; M435-I438 PolarHBondContact O-N 3.31Å; M435-I438 HydrophobicContact SD-CB 4.43Å; I438-E440 VanDerWaalsContact C-N 3.33Å; I438-E440 PolarHBondContact O-N 3.28Å; I438-L441 PolarHBondContact O-N 2.98Å; I438-L441 VanDerWaalsContact O-N 3.16Å; I438-E442 HydrophobicContact CG2-CG 4.27Å; I438-E442 WeakPolarHBondContact O-CG 3.49Å; I438-E442 PolarHBondContact O-N 2.94Å; I438-I449 HydrophobicContact CG2-CB 4.13Å; I438-I449 HydrophobicContact CG2-CD1 4.45Å; I438-I449 HydrophobicContact CG2-CG2 4.45Å
439	K	95.3	Very high	92.2	Very high	109 Å²	109	61 Å²	61	47%	0.474	30%	0.299	S	S	.	.	H	α-helix	trans	-63.4	-35.9	178	-62.2	-50.1	179.1	-170.5	0	113.3	M435 Y436 E442 S443	M435-K439 PolarHBondContact O-N 3.2Å; Y436-K439 PolarHBondContact O-N 3.2Å; K439-E442 WeakPolarHBondContact CD-OE2 3.42Å; K439-E442 WeakPolarHBondContact CE-OE2 3.48Å; K439-E442 IonicContact NZ-OE1 3.18Å; K439-E442 IonicContact NZ-OE2 3.97Å; K439-E442 PolarHBondContact NZ-OE2 3.14Å; K439-S443 VanDerWaalsContact O-CB 3.24Å; K439-S443 WeakPolarHBondContact O-CB 3.24Å; K439-S443 PolarHBondContact O-N 3.35Å
440	E	94.1	Very high	92.1	Very high	60 Å²	60	63.6 Å²	63.6	28%	0.28	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-42.7	172.7	-76.1	-172.4	165.3	0	0	111.8	A405 Y436 L437 I438 H444	A405-E440 HydrophobicContact CB-CB 4.02Å; A405-E440 PolarHBondContact N-OE2 2.98Å; Y436-E440 WeakPolarHBondContact O-CG 3.32Å; Y436-E440 PolarHBondContact O-N 2.92Å; L437-E440 PolarHBondContact O-N 3.18Å; I438-E440 VanDerWaalsContact C-N 3.33Å; I438-E440 PolarHBondContact O-N 3.28Å; E440-H444 VanDerWaalsContact O-CB 3.3Å; E440-H444 WeakPolarHBondContact O-CB 3.3Å; E440-H444 PolarHBondContact O-N 3.43Å
441	L	91.2	Very high	92.1	Very high	1 Å²	1	68.6 Å²	68.6	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-46.4	177.4	-69.3	171.1	0	0	0	112.5	M397 A405 W407 Y410 L437 I438 S443 H444 F445 I449	M397-L441 HydrophobicContact CE-CD1 3.26Å; A405-L441 HydrophobicContact CB-CD2 4.11Å; A405-L441 HydrophobicContact CB-CG 4.07Å; W407-L441 HydrophobicContact CB-CD2 4.31Å; Y410-L441 HydrophobicContact CD1-CD1 4.3Å; Y410-L441 HydrophobicContact CD1-CD2 4Å; Y410-L441 HydrophobicContact CD2-CD1 3.6Å; Y410-L441 HydrophobicContact CD2-CD2 4.25Å; Y410-L441 HydrophobicContact CE1-CD1 4.26Å; Y410-L441 HydrophobicContact CE2-CD1 3.54Å; Y410-L441 HydrophobicContact CG-CD1 3.98Å; Y410-L441 HydrophobicContact CG-CD2 3.81Å; L437-L441 WeakPolarHBondContact O-CG 3.39Å; L437-L441 PolarHBondContact O-N 3.46Å; L437-L441 VanDerWaalsContact O-N 3.11Å; I438-L441 PolarHBondContact O-N 2.98Å; I438-L441 VanDerWaalsContact O-N 3.16Å; L441-S443 VanDerWaalsContact C-N 3.3Å; L441-S443 PolarHBondContact O-N 2.84Å; L441-H444 PolarHBondContact O-N 3.28Å; L441-F445 HydrophobicContact CB-CD2 4.47Å; L441-F445 HydrophobicContact CD2-CD2 4.3Å; L441-F445 HydrophobicContact CD2-CE2 3.78Å; L441-F445 WeakPolarHBondContact O-CD2 3.41Å; L441-F445 PolarHBondContact O-N 2.93Å; L441-I449 HydrophobicContact CB-CD1 4.19Å
442	E	91.9	Very high	91.9	Very high	26 Å²	26	67.4 Å²	67.4	12%	0.121	33%	0.334	C	S	.	.	H	α-helix	trans	-55.8	-46.3	176	-74.6	-174.1	137.8	0	0	111.1	I438 K439 E446 I447 I449	I438-E442 HydrophobicContact CG2-CG 4.27Å; I438-E442 WeakPolarHBondContact O-CG 3.49Å; I438-E442 PolarHBondContact O-N 2.94Å; K439-E442 WeakPolarHBondContact CD-OE2 3.42Å; K439-E442 WeakPolarHBondContact CE-OE2 3.48Å; K439-E442 IonicContact NZ-OE1 3.18Å; K439-E442 IonicContact NZ-OE2 3.97Å; K439-E442 PolarHBondContact NZ-OE2 3.14Å; E442-E446 VanDerWaalsContact O-CA 3.3Å; E442-E446 WeakPolarHBondContact O-CA 3.37Å; E442-E446 PolarHBondContact O-N 3.44Å; E442-I447 WeakPolarHBondContact CA-O 3.31Å; E442-I447 VanDerWaalsContact CB-O 3.28Å; E442-I447 WeakPolarHBondContact CB-O 3.36Å; E442-I447 WeakPolarHBondContact CG-O 3.43Å; E442-I447 PolarHBondContact O-N 3.14Å; E442-I447 VanDerWaalsContact O-N 3.15Å; E442-I449 HydrophobicContact CG-CB 4.18Å; E442-I449 HydrophobicContact CG-CD1 4.23Å; E442-I449 HydrophobicContact CG-CG1 3.98Å; E442-I449 PolarHBondContact OE1-N 3.26Å
443	S	90.9	Very high	91.6	Very high	98 Å²	98	65.8 Å²	65.8	69%	0.685	33%	0.327	S	S	*	.	H	α-helix	trans	-65.2	-43	178.1	-175.4	0	0	0	0	112.5	K439 L441	K439-S443 VanDerWaalsContact O-CB 3.24Å; K439-S443 WeakPolarHBondContact O-CB 3.24Å; K439-S443 PolarHBondContact O-N 3.35Å; L441-S443 VanDerWaalsContact C-N 3.3Å; L441-S443 PolarHBondContact O-N 2.84Å
444	H	87	Confident	90.8	Very high	92 Å²	92	63.3 Å²	63.3	43%	0.426	32%	0.324	S	S	.	.	H	α-helix	trans	-68.8	-42.7	-178	-177.8	80.7	0	0	0	113.1	W407 E440 L441	W407-H444 AromaticContact CD1-CE1 3.75Å; W407-H444 AromaticContact CD1-NE2 3.59Å; W407-H444 AromaticContact CG-CD2 3.86Å; W407-H444 AromaticContact CG-CE1 3.86Å; W407-H444 AromaticContact CG-NE2 3.65Å; E440-H444 VanDerWaalsContact O-CB 3.3Å; E440-H444 WeakPolarHBondContact O-CB 3.3Å; E440-H444 PolarHBondContact O-N 3.43Å; L441-H444 PolarHBondContact O-N 3.28Å
445	F	83.7	Confident	89.8	Confident	40 Å²	40	67.7 Å²	67.7	18%	0.175	34%	0.344	C	S	.	.	H	α-helix	trans	-92.4	-5.1	-177.1	-68.1	-62.6	0	0	0	113.7	L291 W407 Y410 L411 L441 I447	L291-F445 HydrophobicContact CD1-CB 4.11Å; L291-F445 HydrophobicContact CD1-CD1 3.87Å; L291-F445 HydrophobicContact CD1-CE1 4.46Å; L291-F445 HydrophobicContact CD1-CG 3.94Å; W407-F445 HydrophobicContact CB-CE2 3.95Å; W407-F445 HydrophobicContact CB-CZ 3.77Å; W407-F445 WeakPolarHBondContact O-CZ 3.28Å; Y410-F445 AromaticContact CD1-CE2 3.94Å; Y410-F445 HydrophobicContact CD1-CE2 3.94Å; L411-F445 HydrophobicContact CB-CE1 4.43Å; L411-F445 HydrophobicContact CB-CZ 4.05Å; L411-F445 HydrophobicContact CD1-CE1 4.29Å; L411-F445 HydrophobicContact CD2-CE1 4.23Å; L441-F445 HydrophobicContact CB-CD2 4.47Å; L441-F445 HydrophobicContact CD2-CD2 4.3Å; L441-F445 HydrophobicContact CD2-CE2 3.78Å; L441-F445 WeakPolarHBondContact O-CD2 3.41Å; L441-F445 PolarHBondContact O-N 2.93Å; F445-I447 VanDerWaalsContact C-N 3.32Å; F445-I447 HydrophobicContact CB-CD1 3.91Å; F445-I447 HydrophobicContact CB-CG1 3.88Å; F445-I447 HydrophobicContact CB-CG2 4.16Å; F445-I447 WeakPolarHBondContact O-CG2 3.42Å; F445-I447 PolarHBondContact O-N 3.43Å
446	E	86.2	Confident	88.9	Confident	181 Å²	181	66.5 Å²	66.5	85%	0.846	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	47.1	-174.5	-57.6	-179.6	179.3	0	0	111.9	E442	E442-E446 VanDerWaalsContact O-CA 3.3Å; E442-E446 WeakPolarHBondContact O-CA 3.37Å; E442-E446 PolarHBondContact O-N 3.44Å
447	I	87.5	Confident	87.7	Confident	49 Å²	49	62.9 Å²	62.9	25%	0.251	33%	0.327	S	S	.	.			trans	-126.6	167.5	-179.3	64.6	178.5	0	0	0	111.5	L291 E442 F445 I449	L291-I447 HydrophobicContact CD1-CD1 4.39Å; E442-I447 WeakPolarHBondContact CA-O 3.31Å; E442-I447 VanDerWaalsContact CB-O 3.28Å; E442-I447 WeakPolarHBondContact CB-O 3.36Å; E442-I447 WeakPolarHBondContact CG-O 3.43Å; E442-I447 PolarHBondContact O-N 3.14Å; E442-I447 VanDerWaalsContact O-N 3.15Å; F445-I447 VanDerWaalsContact C-N 3.32Å; F445-I447 HydrophobicContact CB-CD1 3.91Å; F445-I447 HydrophobicContact CB-CG1 3.88Å; F445-I447 HydrophobicContact CB-CG2 4.16Å; F445-I447 WeakPolarHBondContact O-CG2 3.42Å; F445-I447 PolarHBondContact O-N 3.43Å; I447-I449 HydrophobicContact CD1-CD1 4.25Å; I447-I449 HydrophobicContact CD1-CG1 4.04Å; I447-I449 HydrophobicContact CG1-CG1 4.28Å
448	E	90.4	Very high	86.2	Confident	159 Å²	159	69.3 Å²	69.3	74%	0.743	36%	0.361	S	S	*	.			trans	-108.2	133	167.5	-172.5	175.7	-171.3	0	0	109.2	P450	E448-P450 WeakPolarHBondContact O-CD 3.41Å
449	I	93.6	Very high	84.6	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.005	40%	0.395	C	S	.	.			trans	-114.9	92.8	173.5	-56.8	175.6	0	0	0	106.2	Q296 Y298 I438 L441 E442 I447	Q296-I449 HydrophobicContact CB-CG1 4.29Å; Q296-I449 HydrophobicContact CB-CG2 4.27Å; Y298-I449 HydrophobicContact CD1-CG2 4.21Å; Y298-I449 WeakPolarHBondContact CD1-O 3.38Å; Y298-I449 VanDerWaalsContact CE1-O 3.23Å; Y298-I449 WeakPolarHBondContact CE1-O 3.35Å; I438-I449 HydrophobicContact CG2-CB 4.13Å; I438-I449 HydrophobicContact CG2-CD1 4.45Å; I438-I449 HydrophobicContact CG2-CG2 4.45Å; L441-I449 HydrophobicContact CB-CD1 4.19Å; E442-I449 HydrophobicContact CG-CB 4.18Å; E442-I449 HydrophobicContact CG-CD1 4.23Å; E442-I449 HydrophobicContact CG-CG1 3.98Å; E442-I449 PolarHBondContact OE1-N 3.26Å; I447-I449 HydrophobicContact CD1-CD1 4.25Å; I447-I449 HydrophobicContact CD1-CG1 4.04Å; I447-I449 HydrophobicContact CG1-CG1 4.28Å
450	P	94.5	Very high	82.9	Confident	55 Å²	55	77 Å²	77	36%	0.357	39%	0.39	S	S	.	.			trans	-68.2	159.2	-179.9	26.5	-35.5	0	0	0	112.7	Q296 F297 Y298 E448	Q296-P450 WeakPolarHBondContact O-CD 3.35Å; F297-P450 CarbonylContact C-O 3.58Å; F297-P450 WeakPolarHBondContact CA-O 3.41Å; F297-P450 HydrophobicContact CD1-CG 3.85Å; F297-P450 HydrophobicContact CE1-CG 3.89Å; Y298-P450 PolarHBondContact N-O 2.66Å; E448-P450 WeakPolarHBondContact O-CD 3.41Å
451	E	94	Very high	82.3	Confident	106 Å²	106	77.8 Å²	77.8	50%	0.495	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-67.1	136.1	169.1	-164.9	166.8	171.8	0	0	110.2	Y298 T453	Y298-E451 HydrophobicContact CD2-CG 4.3Å; Y298-E451 HydrophobicContact CE1-CB 4.04Å; Y298-E451 HydrophobicContact CE2-CB 3.84Å; Y298-E451 HydrophobicContact CE2-CG 3.68Å; Y298-E451 CarbonylContact O-C 3.49Å; Y298-E451 WeakPolarHBondContact O-CA 3.29Å; Y298-E451 PolarHBondContact OH-OE2 3.24Å; E451-T453 PolarHBondContact O-N 3Å
452	L	90.7	Very high	81.9	Confident	14 Å²	14	81.8 Å²	81.8	7%	0.073	42%	0.415	C	S	.	.			trans	-73.4	113.5	177	-171.3	67.3	0	0	0	109.8	F297 Y298 M299 V427 D456 L457 F460	F297-L452 HydrophobicContact CB-CB 3.79Å; F297-L452 HydrophobicContact CB-CD1 3.95Å; F297-L452 HydrophobicContact CB-CG 4.4Å; F297-L452 HydrophobicContact CD1-CB 4.39Å; F297-L452 HydrophobicContact CD1-CD1 3.79Å; F297-L452 HydrophobicContact CD2-CD1 3.86Å; F297-L452 HydrophobicContact CE1-CD1 4.28Å; F297-L452 HydrophobicContact CE2-CD1 4.34Å; F297-L452 HydrophobicContact CG-CB 4.25Å; F297-L452 HydrophobicContact CG-CD1 3.58Å; F297-L452 HydrophobicContact CG-CG 4.5Å; Y298-L452 PolarHBondContact O-N 2.79Å; M299-L452 HydrophobicContact CG-CB 3.73Å; M299-L452 HydrophobicContact CG-CD2 4.11Å; M299-L452 HydrophobicContact SD-CB 4.42Å; M299-L452 HydrophobicContact SD-CD2 3.76Å; V427-L452 HydrophobicContact CG1-CD2 4Å; V427-L452 HydrophobicContact CG2-CD2 4.18Å; L452-D456 HydrophobicContact CD1-CB 3.7Å; L452-L457 HydrophobicContact CD2-CD2 3.75Å; L452-L457 HydrophobicContact CD2-CG 4.26Å; L452-L457 HydrophobicContact CG-CD2 4.35Å; L452-L457 HydrophobicContact CG-CG 4.39Å; L452-F460 HydrophobicContact CD1-CE2 3.9Å
453	T	84	Confident	81.3	Confident	63 Å²	63	84.9 Å²	84.9	39%	0.387	43%	0.432	S	S	.	.			trans	-91.5	162.8	176.3	72.9	0	0	0	0	111.8	E451 E455 D456 L457	E451-T453 PolarHBondContact O-N 3Å; T453-E455 PolarHBondContact O-N 3.46Å; T453-E455 PolarHBondContact OG1-N 2.87Å; T453-D456 WeakPolarHBondContact CB-OD2 3.44Å; T453-D456 PolarHBondContact N-OD2 3.37Å; T453-D456 WeakPolarHBondContact O-CB 3.39Å; T453-D456 PolarHBondContact O-N 3.25Å; T453-D456 VanDerWaalsContact O-N 3.12Å; T453-D456 VanDerWaalsContact OG1-CG 3.23Å; T453-D456 PolarHBondContact OG1-N 2.94Å; T453-D456 PolarHBondContact OG1-OD2 3.45Å; T453-L457 PolarHBondContact O-N 3.02Å; T453-L457 VanDerWaalsContact O-N 3.14Å
454	A	75.7	Confident	80.8	Confident	71 Å²	71	84.2 Å²	84.2	59%	0.587	42%	0.417	S	S	*	.	H	α-helix	trans	-62.2	-25.8	170.9	0	0	0	0	0	112.7	N458	A454-N458 PolarHBondContact O-N 3.12Å; A454-N458 PolarHBondContact O-ND2 3.37Å
455	E	73.5	Confident	80.4	Confident	133 Å²	133	83.7 Å²	83.7	62%	0.621	42%	0.416	S	S	*	.	H	α-helix	trans	-69.7	-38.4	173.4	-66.7	-173.1	-174	0	0	111.4	T453 L457 N458 R459	T453-E455 PolarHBondContact O-N 3.46Å; T453-E455 PolarHBondContact OG1-N 2.87Å; E455-L457 VanDerWaalsContact C-N 3.35Å; E455-N458 PolarHBondContact O-N 3.23Å; E455-R459 WeakPolarHBondContact O-CG 3.45Å; E455-R459 PolarHBondContact O-N 3.42Å
456	D	76	Confident	80.1	Confident	30 Å²	30	86.6 Å²	86.6	16%	0.16	43%	0.432	C	S	.	.	H	α-helix	trans	-63.6	-43.2	175.6	-59.8	-53.6	0	0	0	110.6	F297 L452 T453 N458 R459 F460	F297-D456 HydrophobicContact CE1-CB 4.42Å; L452-D456 HydrophobicContact CD1-CB 3.7Å; T453-D456 WeakPolarHBondContact CB-OD2 3.44Å; T453-D456 PolarHBondContact N-OD2 3.37Å; T453-D456 WeakPolarHBondContact O-CB 3.39Å; T453-D456 PolarHBondContact O-N 3.25Å; T453-D456 VanDerWaalsContact O-N 3.12Å; T453-D456 VanDerWaalsContact OG1-CG 3.23Å; T453-D456 PolarHBondContact OG1-N 2.94Å; T453-D456 PolarHBondContact OG1-OD2 3.45Å; D456-N458 PolarHBondContact O-N 3.5Å; D456-N458 VanDerWaalsContact O-N 3.11Å; D456-R459 PolarHBondContact O-N 3.41Å; D456-F460 VanDerWaalsContact C-CE2 3.47Å; D456-F460 HydrophobicContact CB-CE2 3.85Å; D456-F460 HydrophobicContact CB-CZ 4.29Å; D456-F460 WeakPolarHBondContact O-CD2 3.31Å; D456-F460 WeakPolarHBondContact O-CE2 3.5Å; D456-F460 PolarHBondContact O-N 3.44Å
457	L	68.3	Low	79.7	Confident	32 Å²	32	79.9 Å²	79.9	17%	0.168	40%	0.403	C	S	.	.	H	α-helix	trans	-54.8	-30.1	175.7	-72.8	175.4	0	0	0	113.8	I314 F318 L452 T453 E455	I314-L457 HydrophobicContact CG1-CD2 4.05Å; F318-L457 HydrophobicContact CD2-CD2 4.42Å; F318-L457 HydrophobicContact CE2-CD2 4.1Å; L452-L457 HydrophobicContact CD2-CD2 3.75Å; L452-L457 HydrophobicContact CD2-CG 4.26Å; L452-L457 HydrophobicContact CG-CD2 4.35Å; L452-L457 HydrophobicContact CG-CG 4.39Å; T453-L457 PolarHBondContact O-N 3.02Å; T453-L457 VanDerWaalsContact O-N 3.14Å; E455-L457 VanDerWaalsContact C-N 3.35Å
458	N	65	Low	79.1	Confident	136 Å²	136	82.2 Å²	82.2	73%	0.727	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-9.7	178.5	-70.7	-60.5	0	0	0	113.9	A454 E455 D456	A454-N458 PolarHBondContact O-N 3.12Å; A454-N458 PolarHBondContact O-ND2 3.37Å; E455-N458 PolarHBondContact O-N 3.23Å; D456-N458 PolarHBondContact O-N 3.5Å; D456-N458 VanDerWaalsContact O-N 3.11Å
459	R	63.4	Low	78.2	Confident	187 Å²	187	75.8 Å²	75.8	71%	0.706	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-15.1	-178.2	-74.6	-179.4	-179.8	177.5	6.1	113.6	E455 D456	E455-R459 WeakPolarHBondContact O-CG 3.45Å; E455-R459 PolarHBondContact O-N 3.42Å; D456-R459 PolarHBondContact O-N 3.41Å
460	F	59.5	Low	76.8	Confident	82 Å²	82	82.6 Å²	82.6	36%	0.36	42%	0.422	S	S	.	.			trans	-87.9	0	172.4	-53.9	-63.6	0	0	0	110.7	K295 F297 F318 V425 L452 D456	K295-F460 HydrophobicContact CD-CE1 3.81Å; F297-F460 HydrophobicContact CD2-CZ 4.24Å; F297-F460 HydrophobicContact CE2-CE1 4.04Å; F297-F460 HydrophobicContact CE2-CE2 4.12Å; F297-F460 AromaticContact CE2-CZ 3.3Å; F297-F460 HydrophobicContact CE2-CZ 3.3Å; F297-F460 HydrophobicContact CZ-CE1 4.35Å; F297-F460 HydrophobicContact CZ-CE2 4.38Å; F297-F460 AromaticContact CZ-CZ 3.5Å; F297-F460 HydrophobicContact CZ-CZ 3.5Å; F318-F460 HydrophobicContact CD1-CB 4.08Å; F318-F460 HydrophobicContact CD2-CB 4.42Å; F318-F460 HydrophobicContact CE1-CB 3.32Å; F318-F460 HydrophobicContact CE1-CD2 4.37Å; F318-F460 AromaticContact CE1-CG 3.93Å; F318-F460 HydrophobicContact CE1-CG 3.93Å; F318-F460 HydrophobicContact CE2-CB 3.71Å; F318-F460 AromaticContact CE2-CD2 3.55Å; F318-F460 HydrophobicContact CE2-CD2 3.55Å; F318-F460 AromaticContact CE2-CG 3.93Å; F318-F460 HydrophobicContact CE2-CG 3.93Å; F318-F460 HydrophobicContact CZ-CB 3.12Å; F318-F460 HydrophobicContact CZ-CD1 4.23Å; F318-F460 AromaticContact CZ-CD2 3.33Å; F318-F460 HydrophobicContact CZ-CD2 3.33Å; F318-F460 HydrophobicContact CZ-CE2 4.32Å; F318-F460 AromaticContact CZ-CG 3.29Å; F318-F460 HydrophobicContact CZ-CG 3.29Å; V425-F460 HydrophobicContact CG2-CD1 3.72Å; V425-F460 HydrophobicContact CG2-CE1 3.8Å; V425-F460 HydrophobicContact CG2-CG 4.37Å; L452-F460 HydrophobicContact CD1-CE2 3.9Å; D456-F460 VanDerWaalsContact C-CE2 3.47Å; D456-F460 HydrophobicContact CB-CE2 3.85Å; D456-F460 HydrophobicContact CB-CZ 4.29Å; D456-F460 WeakPolarHBondContact O-CD2 3.31Å; D456-F460 WeakPolarHBondContact O-CE2 3.5Å; D456-F460 PolarHBondContact O-N 3.44Å

Retrieved 460 of 460 residues in 889.8 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).