A0A087Y367_POEFO Loading...

Platelet-activating factor acetylhydrolase

AlphaFold DB , UniProt , Accession A0A087Y367, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 435 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26	Very low	30.4	Very low	226 Å²	226	116 Å²	116	100%	1.113	65%	0.647	S	S	*	*				0	115.8	0	-86.1	172.4	168.8	0	0	108.5	F3	M1-F3 PolarHBondContact O-N 2.7Å
2	S	27.3	Very low	31.2	Very low	120 Å²	120	111.5 Å²	111.5	84%	0.839	62%	0.624	S	S	*	*			trans	-67.5	117.5	175	173.6	0	0	0	0	109.3
3	F	27.9	Very low	31.6	Very low	187 Å²	187	113.8 Å²	113.8	82%	0.82	62%	0.623	S	S	*	*			trans	-95.5	115.7	173.3	-103.4	-88.5	0	0	0	110.3	M1	M1-F3 PolarHBondContact O-N 2.7Å
4	N	30.9	Very low	32.1	Very low	118 Å²	118	118.7 Å²	118.7	63%	0.631	63%	0.628	S	S	*	*			trans	-25.4	113	174.9	-70.6	-27.3	0	0	0	118.2	G6	N4-G6 VanDerWaalsContact C-N 3.29Å; N4-G6 PolarHBondContact O-N 3.27Å
5	G	28.4	Very low	32.6	Very low	62 Å²	62	114.1 Å²	114.1	64%	0.639	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-6.9	167.2	0	0	0	0	0	115.7
6	G	25.5	Very low	33.3	Very low	44 Å²	44	115.8 Å²	115.8	45%	0.454	60%	0.6	S	S	.	*	H	α-helix	trans	-76.7	-25.3	-179	0	0	0	0	0	115.1	N4	N4-G6 VanDerWaalsContact C-N 3.29Å; N4-G6 PolarHBondContact O-N 3.27Å
7	F	28.9	Very low	33.5	Very low	163 Å²	163	113.5 Å²	113.5	72%	0.715	59%	0.589	S	S	*	*	H	α-helix	trans	-77.5	-28.2	-178	-106	-95.5	0	0	0	113.1	I10 A11	F7-I10 PolarHBondContact O-N 2.89Å; F7-A11 PolarHBondContact O-N 3.39Å; F7-A11 VanDerWaalsContact O-N 3.12Å
8	V	37.1	Very low	33.9	Very low	78 Å²	78	112.4 Å²	112.4	47%	0.473	58%	0.576	S	S	.	*	H	α-helix	trans	-72	-40.5	-176.7	179.6	0	0	0	0	111.5	I10 A11 V12	V8-I10 VanDerWaalsContact C-N 3.3Å; V8-I10 PolarHBondContact O-N 3.49Å; V8-A11 PolarHBondContact O-N 2.7Å; V8-V12 HydrophobicContact CG1-CG2 4.31Å; V8-V12 VanDerWaalsContact O-CG2 3.29Å; V8-V12 WeakPolarHBondContact O-CG2 3.19Å; V8-V12 PolarHBondContact O-N 3.38Å
9	Q	33.1	Very low	34.2	Very low	157 Å²	157	109.3 Å²	109.3	73%	0.734	57%	0.569	S	S	*	*	H	α-helix	trans	-63	-36.3	175.9	-87	-177.5	-19.7	0	0	112.7	K13	Q9-K13 WeakPolarHBondContact O-CB 3.31Å; Q9-K13 PolarHBondContact O-N 2.61Å
10	I	33.6	Very low	34.5	Very low	96 Å²	96	112.2 Å²	112.2	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-71.6	-38.5	178.3	-61.6	172.4	0	0	0	110.6	F7 V8 R14	F7-I10 PolarHBondContact O-N 2.89Å; V8-I10 VanDerWaalsContact C-N 3.3Å; V8-I10 PolarHBondContact O-N 3.49Å; I10-R14 WeakPolarHBondContact O-CB 3.31Å; I10-R14 WeakPolarHBondContact O-CG 3.34Å; I10-R14 PolarHBondContact O-N 3.28Å
11	A	35.9	Very low	34.6	Very low	25 Å²	25	110.6 Å²	110.6	21%	0.207	57%	0.568	C	S	.	*	H	α-helix	trans	-66.5	-44.4	176.3	0	0	0	0	0	112.1	F7 V8 R14 I15	F7-A11 PolarHBondContact O-N 3.39Å; F7-A11 VanDerWaalsContact O-N 3.12Å; V8-A11 PolarHBondContact O-N 2.7Å; A11-R14 PolarHBondContact O-N 3.44Å; A11-I15 VanDerWaalsContact O-CG1 3.27Å; A11-I15 WeakPolarHBondContact O-CG1 3.05Å; A11-I15 PolarHBondContact O-N 3.42Å
12	V	40	Very low	35.3	Very low	62 Å²	62	103.1 Å²	103.1	38%	0.376	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-42.4	177.4	173.4	0	0	0	0	111.3	V8 R14 I15 Y16	V8-V12 HydrophobicContact CG1-CG2 4.31Å; V8-V12 VanDerWaalsContact O-CG2 3.29Å; V8-V12 WeakPolarHBondContact O-CG2 3.19Å; V8-V12 PolarHBondContact O-N 3.38Å; V12-R14 PolarHBondContact O-N 2.99Å; V12-I15 PolarHBondContact O-N 2.82Å; V12-Y16 WeakPolarHBondContact O-CB 3.09Å; V12-Y16 PolarHBondContact O-N 3.03Å
13	K	36.3	Very low	35.8	Very low	141 Å²	141	104.6 Å²	104.6	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-62.8	-41.4	175.3	-170.7	175	-179.9	179.6	0	111.9	Q9 Y16 D17	Q9-K13 WeakPolarHBondContact O-CB 3.31Å; Q9-K13 PolarHBondContact O-N 2.61Å; K13-Y16 PolarHBondContact O-N 2.85Å; K13-D17 WeakPolarHBondContact O-CB 3.36Å; K13-D17 VanDerWaalsContact O-CG 3.24Å; K13-D17 PolarHBondContact O-N 2.74Å
14	R	38	Very low	35.9	Very low	183 Å²	183	105.3 Å²	105.3	69%	0.691	52%	0.521	S	S	*	.	H	α-helix	trans	-68.1	-36.4	177.3	-78.2	-178.5	173	-168	-1.4	113.4	I10 A11 V12 W18	I10-R14 WeakPolarHBondContact O-CB 3.31Å; I10-R14 WeakPolarHBondContact O-CG 3.34Å; I10-R14 PolarHBondContact O-N 3.28Å; A11-R14 PolarHBondContact O-N 3.44Å; V12-R14 PolarHBondContact O-N 2.99Å; R14-W18 WeakPolarHBondContact O-CB 3.42Å; R14-W18 PolarHBondContact O-N 3.4Å
15	I	40.8	Very low	35.9	Very low	49 Å²	49	108.7 Å²	108.7	25%	0.251	53%	0.525	S	S	.	.	H	α-helix	trans	-67.8	-41.3	174.9	-68.8	165	0	0	0	110.3	A11 V12 W18 A19	A11-I15 VanDerWaalsContact O-CG1 3.27Å; A11-I15 WeakPolarHBondContact O-CG1 3.05Å; A11-I15 PolarHBondContact O-N 3.42Å; V12-I15 PolarHBondContact O-N 2.82Å; I15-W18 PolarHBondContact O-N 3Å; I15-A19 WeakPolarHBondContact O-CB 3.46Å; I15-A19 PolarHBondContact O-N 3.49Å
16	Y	42.5	Very low	36.3	Very low	142 Å²	142	113.6 Å²	113.6	56%	0.557	53%	0.531	S	S	*	.	H	α-helix	trans	-64.6	-46.1	175.7	-176.5	-96.3	0	0	0	112.6	V12 K13 W18 A19 R20	V12-Y16 WeakPolarHBondContact O-CB 3.09Å; V12-Y16 PolarHBondContact O-N 3.03Å; K13-Y16 PolarHBondContact O-N 2.85Å; Y16-W18 VanDerWaalsContact C-N 3.29Å; Y16-W18 PolarHBondContact O-N 3.38Å; Y16-A19 PolarHBondContact O-N 3.33Å; Y16-R20 PolarHBondContact O-N 3.28Å
17	D	37.5	Very low	36.7	Very low	77 Å²	77	120.5 Å²	120.5	41%	0.412	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-31.4	177.6	-69.9	-24	0	0	0	111.9	K13 T21	K13-D17 WeakPolarHBondContact O-CB 3.36Å; K13-D17 VanDerWaalsContact O-CG 3.24Å; K13-D17 PolarHBondContact O-N 2.74Å; D17-T21 PolarHBondContact O-N 2.79Å; D17-T21 PolarHBondContact O-OG1 2.83Å
18	W	41.4	Very low	36.7	Very low	94 Å²	94	119.5 Å²	119.5	36%	0.356	55%	0.549	S	S	.	.	H	α-helix	trans	-72	-44.3	174.8	-180	78.9	0	0	0	113	R14 I15 Y16 R20 T21 E22	R14-W18 WeakPolarHBondContact O-CB 3.42Å; R14-W18 PolarHBondContact O-N 3.4Å; I15-W18 PolarHBondContact O-N 3Å; Y16-W18 VanDerWaalsContact C-N 3.29Å; Y16-W18 PolarHBondContact O-N 3.38Å; W18-R20 PolarHBondContact O-N 2.85Å; W18-T21 VanDerWaalsContact CA-OG1 3.24Å; W18-T21 WeakPolarHBondContact CA-OG1 3.38Å; W18-T21 WeakPolarHBondContact O-CA 3.32Å; W18-T21 PolarHBondContact O-N 2.83Å; W18-T21 PolarHBondContact O-OG1 3.38Å; W18-E22 HydrophobicContact CD2-CG 4.33Å; W18-E22 HydrophobicContact CH2-CG 3.96Å; W18-E22 WeakPolarHBondContact CH2-OE1 3.26Å; W18-E22 WeakPolarHBondContact CH2-OE2 3.37Å; W18-E22 HydrophobicContact CZ2-CG 3.64Å; W18-E22 WeakPolarHBondContact CZ2-OE1 3.42Å; W18-E22 HydrophobicContact CZ3-CG 4.43Å; W18-E22 PolarHBondContact O-N 3.11Å
19	A	39.4	Very low	36.2	Very low	52 Å²	52	119 Å²	119	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-58.7	-33.2	174.3	0	0	0	0	0	111.9	I15 Y16	I15-A19 WeakPolarHBondContact O-CB 3.46Å; I15-A19 PolarHBondContact O-N 3.49Å; Y16-A19 PolarHBondContact O-N 3.33Å
20	R	39.7	Very low	36.3	Very low	168 Å²	168	121 Å²	121	63%	0.634	57%	0.567	S	S	*	*	H	α-helix	trans	-68.8	-28.9	172.1	-119.9	-177.8	75.4	155.4	2.6	113.9	Y16 W18	Y16-R20 PolarHBondContact O-N 3.28Å; W18-R20 PolarHBondContact O-N 2.85Å
21	T	37.2	Very low	36	Very low	79 Å²	79	126.4 Å²	126.4	49%	0.485	59%	0.587	S	S	.	*	H	α-helix	trans	-87	-26.9	179.8	21.8	0	0	0	0	112.8	D17 W18 W24 R25	D17-T21 PolarHBondContact O-N 2.79Å; D17-T21 PolarHBondContact O-OG1 2.83Å; W18-T21 VanDerWaalsContact CA-OG1 3.24Å; W18-T21 WeakPolarHBondContact CA-OG1 3.38Å; W18-T21 WeakPolarHBondContact O-CA 3.32Å; W18-T21 PolarHBondContact O-N 2.83Å; W18-T21 PolarHBondContact O-OG1 3.38Å; T21-W24 WeakPolarHBondContact O-CB 3.48Å; T21-W24 PolarHBondContact O-N 3.14Å; T21-W24 VanDerWaalsContact O-N 3.17Å; T21-R25 PolarHBondContact O-N 3.34Å
22	E	39.3	Very low	35.6	Very low	68 Å²	68	129.6 Å²	129.6	32%	0.318	61%	0.613	S	S	.	*	H	α-helix	trans	-67.2	-32.4	170.1	-78.5	-143.2	143.6	0	0	113.5	W18 W24 R25 H26	W18-E22 HydrophobicContact CD2-CG 4.33Å; W18-E22 HydrophobicContact CH2-CG 3.96Å; W18-E22 WeakPolarHBondContact CH2-OE1 3.26Å; W18-E22 WeakPolarHBondContact CH2-OE2 3.37Å; W18-E22 HydrophobicContact CZ2-CG 3.64Å; W18-E22 WeakPolarHBondContact CZ2-OE1 3.42Å; W18-E22 HydrophobicContact CZ3-CG 4.43Å; W18-E22 PolarHBondContact O-N 3.11Å; E22-W24 PolarHBondContact O-N 2.95Å; E22-W24 VanDerWaalsContact O-N 3.11Å; E22-R25 PolarHBondContact O-N 3.05Å; E22-H26 PolarHBondContact O-N 3.3Å
23	Q	39.2	Very low	34.9	Very low	151 Å²	151	135.7 Å²	135.7	71%	0.706	64%	0.64	S	S	*	*	H	α-helix	trans	-54.6	-28.5	169.6	-101.5	-178.3	-10.3	0	0	113
24	W	29.2	Very low	34.3	Very low	203 Å²	203	132.6 Å²	132.6	77%	0.769	65%	0.649	S	S	*	*	H	α-helix	trans	-83.7	-31.9	175.7	-103.6	82	0	0	0	113.1	T21 E22	T21-W24 WeakPolarHBondContact O-CB 3.48Å; T21-W24 PolarHBondContact O-N 3.14Å; T21-W24 VanDerWaalsContact O-N 3.17Å; E22-W24 PolarHBondContact O-N 2.95Å; E22-W24 VanDerWaalsContact O-N 3.11Å
25	R	32.1	Very low	33.7	Very low	189 Å²	189	129.3 Å²	129.3	71%	0.713	65%	0.654	S	S	*	*	H	α-helix	trans	-80.3	-28.6	-178.8	-75.1	-177.6	160.4	-177.8	-5.9	113.4	T21 E22 K27 L28	T21-R25 PolarHBondContact O-N 3.34Å; E22-R25 PolarHBondContact O-N 3.05Å; R25-K27 PolarHBondContact O-N 3.04Å; R25-K27 VanDerWaalsContact O-N 3.09Å; R25-L28 CarbonylContact O-C 3.48Å; R25-L28 PolarHBondContact O-N 3.32Å; R25-L28 VanDerWaalsContact O-O 3.13Å
26	H	35.6	Very low	33.2	Very low	165 Å²	165	133.1 Å²	133.1	76%	0.764	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-7	172.1	-97.3	-81.2	0	0	0	114.3	E22	E22-H26 PolarHBondContact O-N 3.3Å
27	K	34.3	Very low	32.8	Very low	188 Å²	188	129.8 Å²	129.8	82%	0.817	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-5.6	168.4	-84.1	-175	174.8	-179.1	0	114.5	R25	R25-K27 PolarHBondContact O-N 3.04Å; R25-K27 VanDerWaalsContact O-N 3.09Å
28	L	27.8	Very low	32.7	Very low	142 Å²	142	130 Å²	130	74%	0.743	69%	0.689	S	S	*	*	S	Bend	trans	-130.8	93.8	-179.3	-80.1	157.3	0	0	0	109.3	R25	R25-L28 CarbonylContact O-C 3.48Å; R25-L28 PolarHBondContact O-N 3.32Å; R25-L28 VanDerWaalsContact O-O 3.13Å
29	G	27.1	Very low	32.8	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	71%	0.708	S	S	*	*			trans	-69	166.8	-178.6	0	0	0	0	0	114.9
30	F	35.6	Very low	33.9	Very low	200 Å²	200	137.4 Å²	137.4	88%	0.877	72%	0.723	S	S	*	*			trans	51.7	112.1	158.4	-86.4	-95.2	0	0	0	117.6
31	F	27.1	Very low	35.8	Very low	209 Å²	209	133.3 Å²	133.3	92%	0.917	71%	0.713	S	S	*	*				-175.9	115.6	128.1	-93.9	-69.9	0	0	0	110.7
32	A	27.6	Very low	38.3	Very low	91 Å²	91	130.7 Å²	130.7	75%	0.752	70%	0.701	S	S	*	*			trans	9.6	153.4	146.3	0	0	0	0	0	120.7
33	M	25.8	Very low	40.8	Very low	190 Å²	190	128.1 Å²	128.1	94%	0.936	69%	0.69	S	S	*	*			cis	-162.3	155.3	18.4	-80.1	-160.7	-85.7	0	0	110.4
34	G	23.2	Very low	43.4	Very low	77 Å²	77	121.7 Å²	121.7	79%	0.794	66%	0.661	S	S	*	*			trans	104.2	83.6	137.2	0	0	0	0	0	120.7
35	S	25.5	Very low	46.5	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	65%	0.652	S	S	*	*				168.5	136.3	119.2	68.4	0	0	0	0	109.5	C37	S35-C37 PolarHBondContact O-N 3.14Å
36	S	31.3	Very low	49.5	Very low	129 Å²	129	109 Å²	109	90%	0.902	63%	0.629	S	S	*	*			trans	-71	95.6	-176.6	173.3	0	0	0	0	110.7
37	C	32.3	Very low	52.4	Low	71 Å²	71	106.2 Å²	106.2	48%	0.48	62%	0.615	S	S	.	*			trans	-123.1	128.4	151.8	-74.1	0	0	0	0	106	S35 N39	S35-C37 PolarHBondContact O-N 3.14Å; C37-N39 PolarHBondContact O-N 2.96Å
38	S	36.9	Very low	55.4	Low	82 Å²	82	98 Å²	98	57%	0.573	58%	0.584	S	S	*	*			trans	-52	115.8	175.1	-179.1	0	0	0	0	109.3	H40	S38-H40 VanDerWaalsContact C-N 3.27Å; S38-H40 PolarHBondContact O-N 3.2Å; S38-H40 PolarHBondContact OG-CD2 3.13Å
39	N	43.8	Very low	58.6	Low	143 Å²	143	96.5 Å²	96.5	77%	0.765	58%	0.583	S	S	*	*			trans	-92	25.3	-176.6	-90.8	-22	0	0	0	112	C37 L41	C37-N39 PolarHBondContact O-N 2.96Å; N39-L41 PolarHBondContact O-N 3.07Å
40	H	61.6	Low	61.9	Low	158 Å²	158	95.8 Å²	95.8	73%	0.731	56%	0.563	S	S	*	*			trans	-88.4	98.7	178.7	-64.6	-60.8	0	0	0	109.5	S38	S38-H40 VanDerWaalsContact C-N 3.27Å; S38-H40 PolarHBondContact O-N 3.2Å; S38-H40 PolarHBondContact OG-CD2 3.13Å
41	L	80.1	Confident	64.8	Low	83 Å²	83	89.4 Å²	89.4	44%	0.435	54%	0.536	S	S	.	.			trans	-70.2	129	168.7	-68	172.8	0	0	0	109.4	N39 Y117 T367	N39-L41 PolarHBondContact O-N 3.07Å; L41-Y117 HydrophobicContact CB-CE1 4.31Å; L41-Y117 WeakPolarHBondContact CB-OH 3.49Å; L41-T367 VanDerWaalsContact CD2-C 3.42Å; L41-T367 WeakPolarHBondContact CD2-O 3.16Å
42	G	88.2	Confident	68.2	Low	23 Å²	23	79.6 Å²	79.6	24%	0.237	49%	0.493	C	S	.	.	S	Bend	trans	151.1	153.6	-177.9	0	0	0	0	0	111.6	F365	G42-F365 PolarHBondContact N-O 3.45Å; G42-F365 WeakPolarHBondContact O-CB 3.4Å
43	I	92.6	Very high	71.5	Confident	14 Å²	14	75.3 Å²	75.3	7%	0.072	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-68.8	128.2	177.9	-58.6	176.6	0	0	0	108.1	W85 I119 P120 S150 A151 D362 L366	I43-W85 VanDerWaalsContact CD1-CD1 3.49Å; I43-W85 HydrophobicContact CD1-CG 4.02Å; I43-I119 HydrophobicContact CD1-CG2 3.96Å; I43-P120 HydrophobicContact CG2-CG 4.15Å; I43-S150 VanDerWaalsContact CD1-OG 3.26Å; I43-S150 WeakPolarHBondContact CD1-OG 3.4Å; I43-A151 HydrophobicContact CG2-CB 3.94Å; I43-D362 HydrophobicContact CD1-CB 3.88Å; I43-D362 HydrophobicContact CG1-CB 4.28Å; I43-L366 HydrophobicContact CG1-CD2 3.89Å; I43-L366 HydrophobicContact CG1-CG 4.43Å
44	P	93.5	Very high	74.9	Confident	16 Å²	16	66.2 Å²	66.2	10%	0.104	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-63.7	142.5	-173.3	25.5	-34.6	0	0	0	111	P120 A151 F365 E384 I387	P44-P120 WeakPolarHBondContact O-CG 3.31Å; P44-A151 HydrophobicContact CG-CB 4.48Å; P44-F365 HydrophobicContact CG-CD1 4.22Å; P44-F365 HydrophobicContact CG-CE1 3.9Å; P44-F365 HydrophobicContact CG-CE2 4.39Å; P44-F365 HydrophobicContact CG-CZ 4.02Å; P44-E384 HydrophobicContact CB-CG 4.19Å; P44-E384 HydrophobicContact CG-CG 4.49Å; P44-I387 HydrophobicContact CG-CG2 4.45Å
45	P	93.9	Very high	78.5	Confident	90 Å²	90	62.6 Å²	62.6	58%	0.584	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-64.2	151.8	173.6	29.6	-34.8	0	0	0	110.7
46	P	96.1	Very high	82	Confident	36 Å²	36	57.9 Å²	57.9	23%	0.234	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-63.4	159.1	173.4	24.9	-31.1	0	0	0	112.3	V52 V154 E155 S158	P46-V52 HydrophobicContact CG-CG2 4.3Å; P46-V154 HydrophobicContact CB-CG1 3.85Å; P46-V154 HydrophobicContact CG-CG1 3.57Å; P46-E155 WeakPolarHBondContact CA-OE2 3.42Å; P46-S158 VanDerWaalsContact CB-OG 3.32Å; P46-S158 WeakPolarHBondContact CB-OG 3.48Å
47	K	96.9	Very high	85.1	Confident	106 Å²	106	51.7 Å²	51.7	46%	0.461	30%	0.298	S	S	.	.			trans	-111.4	-5.6	-179	-67.2	173	176	161.6	0	113.3	E155 D388	K47-E155 PolarHBondContact N-OE2 2.96Å; K47-D388 IonicContact NZ-OD1 2.69Å; K47-D388 PolarHBondContact NZ-OD1 3.33Å; K47-D388 IonicContact NZ-OD2 3.71Å; K47-D388 PolarHBondContact NZ-OD2 3.17Å
48	G	96.8	Very high	88.3	Confident	17 Å²	17	48.3 Å²	48.3	18%	0.175	28%	0.275	C	S	.	.	S	Bend	trans	-74.5	166.7	173.7	0	0	0	0	0	113.4	N50 S158 Q159	G48-N50 VanDerWaalsContact C-N 3.33Å; G48-N50 PolarHBondContact O-N 3.32Å; G48-S158 CarbonylContact C-O 3.5Å; G48-S158 VanDerWaalsContact CA-OG 3.23Å; G48-S158 WeakPolarHBondContact CA-OG 3.46Å; G48-S158 PolarHBondContact N-OG 3.48Å; G48-Q159 VanDerWaalsContact CA-CD 3.49Å; G48-Q159 VanDerWaalsContact CA-NE2 3.3Å
49	P	95.8	Very high	91.1	Very high	110 Å²	110	45.9 Å²	45.9	71%	0.714	26%	0.255	S	S	*	.	S	Bend	trans	-76.6	-15.2	-173.5	30.4	-36.7	0	0	0	114.3	S158	P49-S158 VanDerWaalsContact CD-O 3.3Å; P49-S158 WeakPolarHBondContact CD-O 3.06Å
50	N	96.3	Very high	93.4	Very high	52 Å²	52	43 Å²	43	28%	0.278	24%	0.24	S	C	.	.	S	Bend	trans	-95.7	141.2	-175.3	-56.8	-77.1	0	0	0	111.8	G48 P73 S158	G48-N50 VanDerWaalsContact C-N 3.33Å; G48-N50 PolarHBondContact O-N 3.32Å; N50-P73 HydrophobicContact CB-CB 4.1Å; N50-S158 WeakPolarHBondContact CB-O 3.2Å; N50-S158 PolarHBondContact N-O 3.44Å; N50-S158 PolarHBondContact ND2-O 2.63Å; N50-S158 WeakPolarHBondContact O-CB 3.14Å
51	H	96.2	Very high	94.9	Very high	67 Å²	67	37.6 Å²	37.6	31%	0.31	21%	0.214	S	C	.	.			trans	-64.6	148.6	161.2	-64.7	-91.2	0	0	0	109.7	P73 C74 E76 Y122	H51-P73 WeakPolarHBondContact O-CA 3.45Å; H51-C74 PolarHBondContact O-N 3.29Å; H51-E76 IonicContact CE1-OE1 3.75Å; H51-E76 PolarHBondContact CE1-OE1 3.33Å; H51-E76 IonicContact NE2-OE1 2.88Å; H51-E76 IonicContact NE2-OE2 3.76Å; H51-Y122 HydrophobicContact CB-CD2 4.48Å; H51-Y122 HydrophobicContact CB-CE2 4.11Å; H51-Y122 AromaticContact ND1-CE2 3.83Å
52	V	97.7	Very high	95.6	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.5	-173.6	-179.8	0	0	0	0	110.5	P46 Y72 A121 Y122 V154 A157	P46-V52 HydrophobicContact CG-CG2 4.3Å; V52-Y72 WeakPolarHBondContact CA-O 3.16Å; V52-A121 HydrophobicContact CG1-CB 4.18Å; V52-A121 CarbonylContact O-C 3.44Å; V52-A121 VanDerWaalsContact O-CA 3.27Å; V52-A121 WeakPolarHBondContact O-CA 3.39Å; V52-Y122 WeakPolarHBondContact O-CD2 3.29Å; V52-Y122 PolarHBondContact O-N 3.04Å; V52-V154 HydrophobicContact CB-CG1 4.02Å; V52-V154 HydrophobicContact CG1-CB 4.4Å; V52-V154 HydrophobicContact CG1-CG1 4.05Å; V52-V154 HydrophobicContact CG1-CG2 4.25Å; V52-V154 HydrophobicContact CG2-CG1 3.97Å; V52-V154 WeakPolarHBondContact CG2-O 3.43Å; V52-A157 HydrophobicContact CB-CB 4.48Å; V52-A157 HydrophobicContact CG1-CB 3.64Å; V52-A157 HydrophobicContact CG2-CB 4.04Å
53	G	97.5	Very high	95.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	160.3	167.7	0	0	0	0	0	110.9	Y71 Y72 C74 Y122	G53-Y71 WeakPolarHBondContact O-CA 3.32Å; G53-Y72 PolarHBondContact N-O 3.34Å; G53-Y72 PolarHBondContact O-N 3.43Å; G53-Y72 VanDerWaalsContact O-N 3.08Å; G53-C74 PolarHBondContact N-SG 3.11Å; G53-Y122 CarbonylContact C-O 3.21Å; G53-Y122 VanDerWaalsContact CA-O 3.22Å; G53-Y122 WeakPolarHBondContact CA-O 3.32Å
54	C	97.9	Very high	96.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.7	165.2	68.4	0	0	0	0	112.9	R69 L70 Y71 P83 A121 Y122 M123 D124	C54-R69 HydrophobicContact CB-CG 4.44Å; C54-L70 CarbonylContact C-O 3.51Å; C54-L70 WeakPolarHBondContact CA-O 3.32Å; C54-L70 WeakPolarHBondContact CB-O 3.49Å; C54-Y71 HydrophobicContact CB-CD1 3.77Å; C54-Y71 HydrophobicContact CB-CE1 4.08Å; C54-Y71 HydrophobicContact CB-CG 4.41Å; C54-P83 WeakPolarHBondContact SG-CG 3.46Å; C54-A121 HydrophobicContact CB-CB 4.29Å; C54-Y122 PolarHBondContact N-O 3.15Å; C54-M123 CarbonylContact O-C 3.55Å; C54-M123 WeakPolarHBondContact O-CA 3.39Å; C54-D124 PolarHBondContact O-N 3.21Å
55	T	97.8	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.2	173.7	-168.5	0	0	0	0	110.1	R69 L70 Y72 D124 T257 F259 Y261	T55-R69 WeakPolarHBondContact O-CA 3.45Å; T55-L70 HydrophobicContact CG2-CB 4.05Å; T55-L70 HydrophobicContact CG2-CD2 4.49Å; T55-L70 PolarHBondContact N-O 2.96Å; T55-L70 PolarHBondContact O-N 3.39Å; T55-Y72 HydrophobicContact CG2-CE1 4.1Å; T55-D124 WeakPolarHBondContact CB-OD1 3.33Å; T55-D124 PolarHBondContact OG1-OD1 2.82Å; T55-T257 PolarHBondContact OG1-OG1 3.14Å; T55-F259 HydrophobicContact CG2-CB 4.15Å; T55-F259 HydrophobicContact CG2-CD1 3.84Å; T55-F259 HydrophobicContact CG2-CD2 4.46Å; T55-F259 HydrophobicContact CG2-CE1 4.35Å; T55-F259 HydrophobicContact CG2-CG 3.88Å; T55-Y261 HydrophobicContact CG2-CE1 4.4Å
56	D	98.2	Very high	96.5	Very high	15 Å²	15	37.8 Å²	37.8	8%	0.08	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.5	173	-79	-31.3	0	0	0	109.8	F67 R69 R146 N253 L255 T257	D56-F67 HydrophobicContact CB-CE2 4.41Å; D56-R69 VanDerWaalsContact OD1-CB 3.31Å; D56-R69 WeakPolarHBondContact OD1-CB 3.38Å; D56-R69 IonicContact OD1-CZ 3.37Å; D56-R69 IonicContact OD1-NE 2.74Å; D56-R69 PolarHBondContact OD1-NE 3.4Å; D56-R69 IonicContact OD1-NH2 3.73Å; D56-R69 PolarHBondContact OD1-NH2 3.09Å; D56-R69 IonicContact OD2-CZ 2.68Å; D56-R69 IonicContact OD2-NE 3.1Å; D56-R69 IonicContact OD2-NH2 3.3Å; D56-R69 PolarHBondContact OD2-NH2 3.31Å; D56-R146 IonicContact OD1-CZ 2.68Å; D56-R146 IonicContact OD1-NE 2.7Å; D56-R146 PolarHBondContact OD1-NE 2.65Å; D56-R146 IonicContact OD1-NH2 3.14Å; D56-R146 IonicContact OD2-CZ 2.99Å; D56-R146 IonicContact OD2-NE 3.75Å; D56-R146 IonicContact OD2-NH2 3.87Å; D56-R146 PolarHBondContact OD2-NH2 3.22Å; D56-N253 PolarHBondContact O-ND2 3.34Å; D56-L255 HydrophobicContact CB-CD1 3.72Å; D56-T257 VanDerWaalsContact O-CG2 3.28Å; D56-T257 WeakPolarHBondContact O-CG2 3.41Å
57	F	98.3	Very high	96.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.7	-178.5	177.2	-93.5	0	0	0	111.2	M59 F67 F68 K241 M245 V251 N253 Y261	F57-M59 HydrophobicContact CE1-CB 3.5Å; F57-M59 HydrophobicContact CE2-CB 4.31Å; F57-M59 HydrophobicContact CZ-CB 3.38Å; F57-M59 HydrophobicContact CZ-CG 4.26Å; F57-M59 HydrophobicContact CZ-SD 3.97Å; F57-F67 VanDerWaalsContact O-CA 3.32Å; F57-F67 WeakPolarHBondContact O-CA 3.3Å; F57-F67 WeakPolarHBondContact O-CD2 3.35Å; F57-F68 HydrophobicContact CB-CD2 4.09Å; F57-F68 HydrophobicContact CB-CE2 3.66Å; F57-F68 HydrophobicContact CB-CZ 3.95Å; F57-F68 HydrophobicContact CD1-CD1 4.19Å; F57-F68 AromaticContact CD1-CE1 3.4Å; F57-F68 HydrophobicContact CD1-CE1 3.4Å; F57-F68 AromaticContact CD1-CE2 3.87Å; F57-F68 HydrophobicContact CD1-CE2 3.87Å; F57-F68 AromaticContact CD1-CZ 3.2Å; F57-F68 HydrophobicContact CD1-CZ 3.2Å; F57-F68 AromaticContact CE1-CE1 3.95Å; F57-F68 HydrophobicContact CE1-CE1 3.95Å; F57-F68 AromaticContact CE1-CZ 3.88Å; F57-F68 HydrophobicContact CE1-CZ 3.88Å; F57-F68 HydrophobicContact CG-CE1 4.34Å; F57-F68 HydrophobicContact CG-CE2 4.01Å; F57-F68 AromaticContact CG-CZ 3.78Å; F57-F68 HydrophobicContact CG-CZ 3.78Å; F57-F68 PolarHBondContact N-O 2.9Å; F57-F68 PolarHBondContact O-N 3.37Å; F57-K241 HydrophobicContact CE1-CB 4.08Å; F57-K241 HydrophobicContact CE1-CG 4.18Å; F57-M245 HydrophobicContact CD1-CE 3.88Å; F57-M245 HydrophobicContact CD2-CE 3.47Å; F57-M245 VanDerWaalsContact CD2-CE 3.47Å; F57-M245 HydrophobicContact CE1-CE 3.67Å; F57-M245 HydrophobicContact CE2-CE 3.26Å; F57-M245 HydrophobicContact CG-CE 3.76Å; F57-M245 HydrophobicContact CZ-CE 3.35Å; F57-V251 HydrophobicContact CE2-CB 3.97Å; F57-V251 HydrophobicContact CE2-CG2 3.95Å; F57-V251 HydrophobicContact CZ-CB 4.07Å; F57-V251 HydrophobicContact CZ-CG1 4.49Å; F57-V251 HydrophobicContact CZ-CG2 4.47Å; F57-N253 HydrophobicContact CD2-CB 3.79Å; F57-N253 HydrophobicContact CE2-CB 3.98Å; F57-Y261 HydrophobicContact CB-CE1 4.33Å; F57-Y261 HydrophobicContact CD2-CD1 4.28Å; F57-Y261 AromaticContact CD2-CE1 3.49Å; F57-Y261 HydrophobicContact CD2-CE1 3.49Å; F57-Y261 VanDerWaalsContact CD2-CE1 3.49Å; F57-Y261 HydrophobicContact CD2-CE2 4.4Å; F57-Y261 AromaticContact CD2-CZ 3.59Å; F57-Y261 HydrophobicContact CE2-CE1 4.19Å; F57-Y261 HydrophobicContact CG-CE1 4.24Å
58	M	98.4	Very high	96.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.9	173.2	-173.4	179.5	-69.3	0	0	111.3	S66 F67 F177 F179 N253 V254 L255	M58-S66 CarbonylContact C-O 3.52Å; M58-S66 VanDerWaalsContact CA-O 3.29Å; M58-S66 WeakPolarHBondContact CA-O 3.42Å; M58-F67 HydrophobicContact CB-CD2 4.07Å; M58-F67 HydrophobicContact CE-CB 4.2Å; M58-F67 HydrophobicContact CE-CD1 3.46Å; M58-F67 VanDerWaalsContact CE-CD1 3.46Å; M58-F67 HydrophobicContact CE-CD2 3.78Å; M58-F67 HydrophobicContact CE-CE1 3.49Å; M58-F67 VanDerWaalsContact CE-CE1 3.49Å; M58-F67 HydrophobicContact CE-CE2 3.84Å; M58-F67 HydrophobicContact CE-CG 3.57Å; M58-F67 HydrophobicContact CE-CZ 3.66Å; M58-F67 HydrophobicContact CG-CB 4.41Å; M58-F177 HydrophobicContact CE-CD2 3.82Å; M58-F177 HydrophobicContact CE-CE2 3.49Å; M58-F177 VanDerWaalsContact CE-CE2 3.49Å; M58-F177 HydrophobicContact CE-CZ 4.02Å; M58-F177 WeakPolarHBondContact CE-O 3.46Å; M58-F177 HydrophobicContact SD-CE2 4.44Å; M58-F179 HydrophobicContact SD-CD2 3.74Å; M58-F179 HydrophobicContact SD-CE2 3.74Å; M58-N253 PolarHBondContact N-OD1 3.3Å; M58-N253 PolarHBondContact O-OD1 2.8Å; M58-V254 PolarHBondContact O-N 3.15Å; M58-L255 HydrophobicContact CB-CD1 3.99Å; M58-L255 HydrophobicContact CB-CD2 4.26Å; M58-L255 HydrophobicContact CB-CG 3.8Å; M58-L255 HydrophobicContact CE-CD2 4.34Å; M58-L255 HydrophobicContact SD-CD2 4.47Å
59	M	95.6	Very high	96.8	Very high	30 Å²	30	30.5 Å²	30.5	15%	0.148	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	125	175.5	-174.7	-168.3	-175.7	0	0	111.7	F57 S66 K241 V251	F57-M59 HydrophobicContact CE1-CB 3.5Å; F57-M59 HydrophobicContact CE2-CB 4.31Å; F57-M59 HydrophobicContact CZ-CB 3.38Å; F57-M59 HydrophobicContact CZ-CG 4.26Å; F57-M59 HydrophobicContact CZ-SD 3.97Å; M59-S66 PolarHBondContact N-O 2.63Å; M59-S66 WeakPolarHBondContact O-CA 3.25Å; M59-S66 VanDerWaalsContact O-CB 3.26Å; M59-S66 WeakPolarHBondContact O-CB 3.27Å; M59-S66 PolarHBondContact O-N 2.97Å; M59-K241 HydrophobicContact SD-CD 3.96Å; M59-V251 HydrophobicContact SD-CB 4.28Å; M59-V251 HydrophobicContact SD-CG1 4.38Å
60	D	91.4	Very high	97	Very high	84 Å²	84	25.2 Å²	25.2	45%	0.449	13%	0.132	S	C	.	.	S	Bend	cis	-77.2	179.4	-3.4	-55.6	-42.2	0	0	0	111.6	T62 G65	D60-T62 PolarHBondContact O-N 3.49Å; D60-G65 VanDerWaalsContact N-CA 3.35Å
61	H	92.9	Very high	97.1	Very high	43 Å²	43	22.8 Å²	22.8	20%	0.199	12%	0.118	C	C	.	.	S	Bend	trans	-70.1	-16	-174.7	66.4	-96	0	0	0	113.6	F179 L204 V254	H61-F179 HydrophobicContact CB-CB 4.15Å; H61-F179 PolarHBondContact CD2-O 3Å; H61-F179 WeakPolarHBondContact O-CA 3.26Å; H61-F179 PolarHBondContact O-N 2.84Å; H61-L204 HydrophobicContact CB-CD1 4.14Å; H61-V254 HydrophobicContact CB-CB 4.28Å; H61-V254 HydrophobicContact CB-CG1 3.74Å; H61-V254 HydrophobicContact CB-CG2 3.67Å
62	T	95.6	Very high	97.2	Very high	54 Å²	54	19.6 Å²	19.6	33%	0.331	10%	0.104	S	C	.	.	S	Bend	trans	-83.8	172.7	-173.2	74.1	0	0	0	0	113.4	D60 Q64 G65	D60-T62 PolarHBondContact O-N 3.49Å; T62-Q64 PolarHBondContact O-N 3.06Å; T62-Q64 VanDerWaalsContact O-N 3.13Å; T62-Q64 PolarHBondContact OG1-N 2.87Å; T62-G65 PolarHBondContact O-N 2.95Å
63	A	95.1	Very high	97.2	Very high	21 Å²	21	19.4 Å²	19.4	17%	0.174	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.2	175.1	0	0	0	0	0	114.4	Y178 M209	A63-Y178 HydrophobicContact CB-CD1 3.81Å; A63-Y178 HydrophobicContact CB-CD2 4.04Å; A63-Y178 HydrophobicContact CB-CE1 3.9Å; A63-Y178 HydrophobicContact CB-CE2 4.17Å; A63-Y178 HydrophobicContact CB-CG 3.89Å; A63-M209 HydrophobicContact CB-CE 4.29Å
64	Q	96.7	Very high	97.2	Very high	149 Å²	149	19.9 Å²	19.9	70%	0.696	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.7	176.4	-56.7	-58.4	-14.5	0	0	113	T62 L237	T62-Q64 PolarHBondContact O-N 3.06Å; T62-Q64 VanDerWaalsContact O-N 3.13Å; T62-Q64 PolarHBondContact OG1-N 2.87Å; Q64-L237 WeakPolarHBondContact O-CD2 3.46Å
65	G	97	Very high	96.9	Very high	3 Å²	3	24.6 Å²	24.6	3%	0.031	13%	0.128	C	C	.	.	S	Bend	trans	-72.6	160.6	176	0	0	0	0	0	112.7	D60 T62 R169	D60-G65 VanDerWaalsContact N-CA 3.35Å; T62-G65 PolarHBondContact O-N 2.95Å; G65-R169 PolarHBondContact O-NH1 3.44Å
66	S	98.3	Very high	96.2	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.028	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	142.8	172.1	-160.8	0	0	0	0	111.2	M58 M59 F68	M58-S66 CarbonylContact C-O 3.52Å; M58-S66 VanDerWaalsContact CA-O 3.29Å; M58-S66 WeakPolarHBondContact CA-O 3.42Å; M59-S66 PolarHBondContact N-O 2.63Å; M59-S66 WeakPolarHBondContact O-CA 3.25Å; M59-S66 VanDerWaalsContact O-CB 3.26Å; M59-S66 WeakPolarHBondContact O-CB 3.27Å; M59-S66 PolarHBondContact O-N 2.97Å; S66-F68 WeakPolarHBondContact OG-CD1 3.48Å; S66-F68 WeakPolarHBondContact OG-CE1 3Å
67	F	98.8	Very high	95.2	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	125.5	169.3	-176.2	-160.5	0	0	0	109.4	D56 F57 M58 R146 E167 F177 L255	D56-F67 HydrophobicContact CB-CE2 4.41Å; F57-F67 VanDerWaalsContact O-CA 3.32Å; F57-F67 WeakPolarHBondContact O-CA 3.3Å; F57-F67 WeakPolarHBondContact O-CD2 3.35Å; M58-F67 HydrophobicContact CB-CD2 4.07Å; M58-F67 HydrophobicContact CE-CB 4.2Å; M58-F67 HydrophobicContact CE-CD1 3.46Å; M58-F67 VanDerWaalsContact CE-CD1 3.46Å; M58-F67 HydrophobicContact CE-CD2 3.78Å; M58-F67 HydrophobicContact CE-CE1 3.49Å; M58-F67 VanDerWaalsContact CE-CE1 3.49Å; M58-F67 HydrophobicContact CE-CE2 3.84Å; M58-F67 HydrophobicContact CE-CG 3.57Å; M58-F67 HydrophobicContact CE-CZ 3.66Å; M58-F67 HydrophobicContact CG-CB 4.41Å; F67-R146 VanDerWaalsContact CE1-NH1 3.3Å; F67-R146 VanDerWaalsContact CZ-NH2 3.35Å; F67-E167 HydrophobicContact CB-CB 4.45Å; F67-E167 HydrophobicContact CD1-CB 3.82Å; F67-E167 HydrophobicContact CD1-CG 4.26Å; F67-E167 WeakPolarHBondContact CD1-OE1 3.31Å; F67-E167 HydrophobicContact CE1-CB 4.49Å; F67-E167 WeakPolarHBondContact CE1-OE1 3.23Å; F67-E167 HydrophobicContact CG-CB 4.22Å; F67-E167 PolarHBondContact O-N 2.88Å; F67-F177 HydrophobicContact CE1-CD1 4.07Å; F67-F177 AromaticContact CE1-CE1 3.72Å; F67-F177 HydrophobicContact CE1-CE1 3.72Å; F67-F177 AromaticContact CE1-CZ 3.97Å; F67-F177 HydrophobicContact CE1-CZ 3.97Å; F67-F177 HydrophobicContact CZ-CD1 4.39Å; F67-F177 AromaticContact CZ-CE1 3.59Å; F67-F177 HydrophobicContact CZ-CE1 3.59Å; F67-F177 HydrophobicContact CZ-CE2 4.35Å; F67-F177 AromaticContact CZ-CZ 3.56Å; F67-F177 HydrophobicContact CZ-CZ 3.56Å; F67-L255 HydrophobicContact CD2-CD1 4.4Å; F67-L255 HydrophobicContact CE2-CD1 3.69Å; F67-L255 HydrophobicContact CZ-CD1 4.42Å
68	F	98.8	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	158.3	178.6	51.8	-98.4	0	0	0	111.1	F57 S66 L70 A164 S165 V166 A238 K241 L242 M245	F57-F68 HydrophobicContact CB-CD2 4.09Å; F57-F68 HydrophobicContact CB-CE2 3.66Å; F57-F68 HydrophobicContact CB-CZ 3.95Å; F57-F68 HydrophobicContact CD1-CD1 4.19Å; F57-F68 AromaticContact CD1-CE1 3.4Å; F57-F68 HydrophobicContact CD1-CE1 3.4Å; F57-F68 AromaticContact CD1-CE2 3.87Å; F57-F68 HydrophobicContact CD1-CE2 3.87Å; F57-F68 AromaticContact CD1-CZ 3.2Å; F57-F68 HydrophobicContact CD1-CZ 3.2Å; F57-F68 AromaticContact CE1-CE1 3.95Å; F57-F68 HydrophobicContact CE1-CE1 3.95Å; F57-F68 AromaticContact CE1-CZ 3.88Å; F57-F68 HydrophobicContact CE1-CZ 3.88Å; F57-F68 HydrophobicContact CG-CE1 4.34Å; F57-F68 HydrophobicContact CG-CE2 4.01Å; F57-F68 AromaticContact CG-CZ 3.78Å; F57-F68 HydrophobicContact CG-CZ 3.78Å; F57-F68 PolarHBondContact N-O 2.9Å; F57-F68 PolarHBondContact O-N 3.37Å; S66-F68 WeakPolarHBondContact OG-CD1 3.48Å; S66-F68 WeakPolarHBondContact OG-CE1 3Å; F68-L70 HydrophobicContact CD2-CB 4.4Å; F68-L70 HydrophobicContact CD2-CD1 4.39Å; F68-L70 HydrophobicContact CE2-CB 4.38Å; F68-L70 HydrophobicContact CE2-CD1 4.07Å; F68-A164 HydrophobicContact CB-CB 4.26Å; F68-A164 HydrophobicContact CD2-CB 3.78Å; F68-A164 HydrophobicContact CE2-CB 4.22Å; F68-A164 HydrophobicContact CG-CB 3.99Å; F68-S165 CarbonylContact C-O 3.6Å; F68-S165 WeakPolarHBondContact CA-O 3.3Å; F68-S165 WeakPolarHBondContact CB-O 3.49Å; F68-V166 HydrophobicContact CB-CG2 4.42Å; F68-A238 HydrophobicContact CD1-CB 3.94Å; F68-A238 HydrophobicContact CE1-CB 4.2Å; F68-K241 HydrophobicContact CE1-CB 4.25Å; F68-K241 HydrophobicContact CZ-CB 4.48Å; F68-L242 HydrophobicContact CE2-CD2 4.14Å; F68-L242 HydrophobicContact CZ-CD2 4.05Å; F68-M245 HydrophobicContact CZ-CE 4.05Å
69	R	98.9	Very high	92.3	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.7	163	-179.6	160.7	-74.1	-169.2	-4.7	108.2	C54 T55 D56 Y71 R146 T147 S165	C54-R69 HydrophobicContact CB-CG 4.44Å; T55-R69 WeakPolarHBondContact O-CA 3.45Å; D56-R69 VanDerWaalsContact OD1-CB 3.31Å; D56-R69 WeakPolarHBondContact OD1-CB 3.38Å; D56-R69 IonicContact OD1-CZ 3.37Å; D56-R69 IonicContact OD1-NE 2.74Å; D56-R69 PolarHBondContact OD1-NE 3.4Å; D56-R69 IonicContact OD1-NH2 3.73Å; D56-R69 PolarHBondContact OD1-NH2 3.09Å; D56-R69 IonicContact OD2-CZ 2.68Å; D56-R69 IonicContact OD2-NE 3.1Å; D56-R69 IonicContact OD2-NH2 3.3Å; D56-R69 PolarHBondContact OD2-NH2 3.31Å; R69-Y71 HydrophobicContact CB-CE2 4.08Å; R69-Y71 VanDerWaalsContact CD-CZ 3.48Å; R69-Y71 VanDerWaalsContact CD-OH 3.24Å; R69-Y71 WeakPolarHBondContact CD-OH 3.29Å; R69-Y71 HydrophobicContact CG-CD2 4.21Å; R69-Y71 HydrophobicContact CG-CE1 4.27Å; R69-Y71 HydrophobicContact CG-CE2 3.64Å; R69-R146 HydrophobicContact CB-CB 4.41Å; R69-R146 HydrophobicContact CB-CG 4.08Å; R69-T147 VanDerWaalsContact CZ-CG2 3.45Å; R69-S165 PolarHBondContact N-O 3.17Å; R69-S165 PolarHBondContact O-N 2.83Å
70	L	98.8	Very high	91.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	134.7	174.2	-160.5	68.5	0	0	0	109.3	C54 T55 F68 Y72 I162 V163 A164 L242 L264	C54-L70 CarbonylContact C-O 3.51Å; C54-L70 WeakPolarHBondContact CA-O 3.32Å; C54-L70 WeakPolarHBondContact CB-O 3.49Å; T55-L70 HydrophobicContact CG2-CB 4.05Å; T55-L70 HydrophobicContact CG2-CD2 4.49Å; T55-L70 PolarHBondContact N-O 2.96Å; T55-L70 PolarHBondContact O-N 3.39Å; F68-L70 HydrophobicContact CD2-CB 4.4Å; F68-L70 HydrophobicContact CD2-CD1 4.39Å; F68-L70 HydrophobicContact CE2-CB 4.38Å; F68-L70 HydrophobicContact CE2-CD1 4.07Å; L70-Y72 HydrophobicContact CB-CD1 4.25Å; L70-Y72 HydrophobicContact CD2-CD1 3.87Å; L70-Y72 HydrophobicContact CD2-CE1 4.37Å; L70-Y72 HydrophobicContact CG-CD1 3.88Å; L70-I162 HydrophobicContact CD1-CG2 3.57Å; L70-I162 HydrophobicContact CD2-CG2 4.49Å; L70-I162 HydrophobicContact CG-CG2 4.17Å; L70-V163 CarbonylContact C-O 3.52Å; L70-V163 WeakPolarHBondContact CA-O 3.48Å; L70-A164 HydrophobicContact CD1-CB 4.04Å; L70-L242 HydrophobicContact CD1-CD2 3.75Å; L70-L264 HydrophobicContact CD2-CD1 3.8Å
71	Y	98.8	Very high	91.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.4	168.7	-56.9	-95.4	0	0	0	108.5	G53 C54 R69 I119 C153 V154 V163	G53-Y71 WeakPolarHBondContact O-CA 3.32Å; C54-Y71 HydrophobicContact CB-CD1 3.77Å; C54-Y71 HydrophobicContact CB-CE1 4.08Å; C54-Y71 HydrophobicContact CB-CG 4.41Å; R69-Y71 HydrophobicContact CB-CE2 4.08Å; R69-Y71 VanDerWaalsContact CD-CZ 3.48Å; R69-Y71 VanDerWaalsContact CD-OH 3.24Å; R69-Y71 WeakPolarHBondContact CD-OH 3.29Å; R69-Y71 HydrophobicContact CG-CD2 4.21Å; R69-Y71 HydrophobicContact CG-CE1 4.27Å; R69-Y71 HydrophobicContact CG-CE2 3.64Å; Y71-I119 HydrophobicContact CE1-CD1 3.91Å; Y71-C153 HydrophobicContact CD1-CB 4.22Å; Y71-C153 HydrophobicContact CD2-CB 3.31Å; Y71-C153 HydrophobicContact CE1-CB 4.3Å; Y71-C153 HydrophobicContact CE2-CB 3.4Å; Y71-C153 VanDerWaalsContact CE2-CB 3.4Å; Y71-C153 HydrophobicContact CG-CB 3.73Å; Y71-V154 HydrophobicContact CD1-CG2 3.7Å; Y71-V154 HydrophobicContact CE1-CG2 3.8Å; Y71-V163 PolarHBondContact N-O 3.46Å; Y71-V163 PolarHBondContact O-N 2.93Å
72	Y	98.7	Very high	91.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	155	-169.9	52.4	-92.3	0	0	0	112.2	V52 G53 T55 L70 C74 A125 F127 F259	V52-Y72 WeakPolarHBondContact CA-O 3.16Å; G53-Y72 PolarHBondContact N-O 3.34Å; G53-Y72 PolarHBondContact O-N 3.43Å; G53-Y72 VanDerWaalsContact O-N 3.08Å; T55-Y72 HydrophobicContact CG2-CE1 4.1Å; L70-Y72 HydrophobicContact CB-CD1 4.25Å; L70-Y72 HydrophobicContact CD2-CD1 3.87Å; L70-Y72 HydrophobicContact CD2-CE1 4.37Å; L70-Y72 HydrophobicContact CG-CD1 3.88Å; Y72-C74 HydrophobicContact CD2-CB 4.24Å; Y72-C74 HydrophobicContact CE2-CB 4.01Å; Y72-C74 PolarHBondContact O-N 3.4Å; Y72-A125 WeakPolarHBondContact CE2-O 3.33Å; Y72-A125 PolarHBondContact OH-O 3.43Å; Y72-F127 HydrophobicContact CD2-CB 4.18Å; Y72-F127 AromaticContact CD2-CD2 3.86Å; Y72-F127 HydrophobicContact CD2-CD2 3.86Å; Y72-F127 HydrophobicContact CE2-CB 4.36Å; Y72-F127 HydrophobicContact CG-CD2 4.22Å; Y72-F259 HydrophobicContact CD2-CE2 4.44Å; Y72-F259 HydrophobicContact CE1-CD2 4.37Å; Y72-F259 AromaticContact CE1-CE2 3.9Å; Y72-F259 HydrophobicContact CE1-CE2 3.9Å; Y72-F259 HydrophobicContact CE1-CZ 4.19Å; Y72-F259 HydrophobicContact CE2-CD2 4.37Å; Y72-F259 AromaticContact CE2-CE2 3.56Å; Y72-F259 HydrophobicContact CE2-CE2 3.56Å; Y72-F259 HydrophobicContact CE2-CZ 4.23Å; Y72-F259 AromaticContact CZ-CD2 3.71Å; Y72-F259 AromaticContact CZ-CE2 3.24Å; Y72-F259 AromaticContact CZ-CZ 3.94Å; Y72-F259 WeakPolarHBondContact OH-CD2 3.38Å; Y72-F259 WeakPolarHBondContact OH-CE2 3.22Å
73	P	98.2	Very high	91	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	127	167.7	-25.4	34.4	0	0	0	111.3	N50 H51 F127 K128 A157 F161	N50-P73 HydrophobicContact CB-CB 4.1Å; H51-P73 WeakPolarHBondContact O-CA 3.45Å; P73-F127 VanDerWaalsContact O-CD2 3.32Å; P73-F127 WeakPolarHBondContact O-CD2 3.3Å; P73-K128 CarbonylContact C-O 3.52Å; P73-K128 VanDerWaalsContact CB-O 3.25Å; P73-K128 WeakPolarHBondContact CB-O 3.39Å; P73-K128 PolarHBondContact O-N 2.87Å; P73-A157 WeakPolarHBondContact CG-O 3.4Å; P73-F161 WeakPolarHBondContact CD-O 3.27Å
74	C	96.5	Very high	90.9	Very high	9 Å²	9	55.1 Å²	55.1	6%	0.061	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-125.5	164.4	-177.8	79.4	0	0	0	0	112.6	H51 G53 Y72 A125 P126	H51-C74 PolarHBondContact O-N 3.29Å; G53-C74 PolarHBondContact N-SG 3.11Å; Y72-C74 HydrophobicContact CD2-CB 4.24Å; Y72-C74 HydrophobicContact CE2-CB 4.01Å; Y72-C74 PolarHBondContact O-N 3.4Å; C74-A125 HydrophobicContact CB-CB 3.89Å; C74-P126 VanDerWaalsContact CA-O 3.27Å; C74-P126 WeakPolarHBondContact CA-O 3.49Å; C74-P126 VanDerWaalsContact CB-O 3.31Å; C74-P126 WeakPolarHBondContact CB-O 3.19Å
75	Q	91.9	Very high	90.7	Very high	99 Å²	99	48 Å²	48	46%	0.463	23%	0.231	S	C	.	.			trans	-67.3	141.6	166.6	-175.6	170.5	-7.8	0	0	109.8	T77 P126 K128	Q75-T77 PolarHBondContact O-N 2.81Å; Q75-P126 PolarHBondContact N-O 3.26Å; Q75-K128 HydrophobicContact CB-CB 4.19Å; Q75-K128 HydrophobicContact CB-CD 4.08Å; Q75-K128 HydrophobicContact CG-CD 4.34Å
76	E	83.4	Confident	90.6	Very high	126 Å²	126	48.5 Å²	48.5	59%	0.589	23%	0.233	S	C	*	.			trans	-63.5	127.4	170.4	-171.7	174.1	-160	0	0	109.8	H51	H51-E76 IonicContact CE1-OE1 3.75Å; H51-E76 PolarHBondContact CE1-OE1 3.33Å; H51-E76 IonicContact NE2-OE1 2.88Å; H51-E76 IonicContact NE2-OE2 3.76Å
77	T	77.9	Confident	90.3	Very high	32 Å²	32	50.3 Å²	50.3	20%	0.196	25%	0.245	C	C	.	.			trans	-133.4	110.7	-178.2	51.2	0	0	0	0	109.3	Q75 K79 A80	Q75-T77 PolarHBondContact O-N 2.81Å; T77-K79 PolarHBondContact O-N 3.37Å; T77-K79 VanDerWaalsContact O-N 3.11Å; T77-A80 PolarHBondContact O-N 3.15Å; T77-A80 WeakPolarHBondContact OG1-CB 3.32Å
78	E	66.8	Low	90	Very high	198 Å²	198	52.3 Å²	52.3	93%	0.925	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.3	177.5	-66.1	-176.7	167.5	0	0	113.2
79	K	69.1	Low	89.5	Confident	204 Å²	204	54.8 Å²	54.8	89%	0.887	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-6.4	-173.8	-63.8	-175.9	-179.1	178.5	0	115.1	T77	T77-K79 PolarHBondContact O-N 3.37Å; T77-K79 VanDerWaalsContact O-N 3.11Å
80	A	74.7	Confident	89.3	Confident	27 Å²	27	57 Å²	57	22%	0.223	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76.5	132.5	-175.3	0	0	0	0	0	111.4	T77 Y122	T77-A80 PolarHBondContact O-N 3.15Å; T77-A80 WeakPolarHBondContact OG1-CB 3.32Å; A80-Y122 HydrophobicContact CB-CD1 3.87Å; A80-Y122 HydrophobicContact CB-CG 4.22Å
81	E	87.2	Confident	89.1	Confident	132 Å²	132	57 Å²	57	62%	0.617	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-70.1	142.7	177.8	-162.9	-171.9	157.4	0	0	110.4	K118 M123	E81-K118 IonicContact OE1-NZ 3.57Å; E81-K118 PolarHBondContact OE1-NZ 2.85Å; E81-M123 WeakPolarHBondContact O-CB 3.44Å; E81-M123 PolarHBondContact O-N 2.86Å
82	K	91.9	Very high	88.7	Confident	101 Å²	101	57.3 Å²	57.3	44%	0.439	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-79.8	126.4	166.6	-63.9	-172.9	178.1	-179.1	0	109.1	K118 A121	K82-K118 HydrophobicContact CB-CB 3.87Å; K82-K118 HydrophobicContact CB-CG 4.28Å; K82-K118 VanDerWaalsContact O-CD 3.23Å; K82-K118 WeakPolarHBondContact O-CD 3.46Å; K82-K118 VanDerWaalsContact O-CE 3.27Å; K82-K118 WeakPolarHBondContact O-CE 3.37Å; K82-K118 PolarHBondContact O-NZ 3.01Å; K82-K118 VanDerWaalsContact O-NZ 3.1Å; K82-A121 WeakPolarHBondContact CA-O 3.45Å
83	P	93.3	Very high	88.3	Confident	10 Å²	10	59.9 Å²	59.9	7%	0.065	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-73.7	151.7	-177.4	15.7	-11.2	0	0	0	111.7	C54 K118 I119 A121 M123	C54-P83 WeakPolarHBondContact SG-CG 3.46Å; P83-K118 VanDerWaalsContact O-CA 3.29Å; P83-K118 WeakPolarHBondContact O-CA 3.27Å; P83-I119 HydrophobicContact CG-CD1 3.9Å; P83-I119 HydrophobicContact CG-CG1 3.75Å; P83-I119 PolarHBondContact O-N 3.38Å; P83-A121 WeakPolarHBondContact CD-O 3.1Å; P83-M123 HydrophobicContact CB-CB 4.21Å; P83-M123 HydrophobicContact CB-CG 4.41Å; P83-M123 HydrophobicContact CB-SD 3.9Å; P83-M123 HydrophobicContact CG-CB 4.02Å; P83-M123 HydrophobicContact CG-SD 4.03Å
84	D	93.1	Very high	88.1	Confident	59 Å²	59	59.9 Å²	59.9	32%	0.316	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-59.8	143.1	170.8	-59.9	-45.7	0	0	0	110.5	K118	D84-K118 WeakPolarHBondContact OD1-CD 3.32Å; D84-K118 WeakPolarHBondContact OD1-CE 3.29Å; D84-K118 IonicContact OD1-NZ 2.8Å; D84-K118 PolarHBondContact OD1-NZ 2.98Å; D84-K118 IonicContact OD2-NZ 3.67Å
85	W	93.6	Very high	87.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	-63.4	-42.6	174.8	175.5	55	0	0	0	111.9	I43 F114 Y117 I119 T147 L148 D362 F363 L366	I43-W85 VanDerWaalsContact CD1-CD1 3.49Å; I43-W85 HydrophobicContact CD1-CG 4.02Å; W85-F114 HydrophobicContact CE3-CB 4.21Å; W85-F114 HydrophobicContact CZ3-CB 3.84Å; W85-F114 HydrophobicContact CZ3-CD1 4.02Å; W85-F114 AromaticContact CZ3-CG 3.98Å; W85-F114 HydrophobicContact CZ3-CG 3.98Å; W85-Y117 VanDerWaalsContact CB-O 3.25Å; W85-Y117 WeakPolarHBondContact CB-O 3.43Å; W85-Y117 PolarHBondContact N-O 3.04Å; W85-I119 HydrophobicContact CB-CG2 3.91Å; W85-I119 HydrophobicContact CG-CG2 4.3Å; W85-T147 PolarHBondContact NE1-O 2.83Å; W85-T147 WeakPolarHBondContact O-CB 3.44Å; W85-T147 PolarHBondContact O-OG1 2.75Å; W85-L148 HydrophobicContact CH2-CD2 3.89Å; W85-L148 HydrophobicContact CZ2-CD2 3.26Å; W85-D362 HydrophobicContact CZ2-CB 3.91Å; W85-D362 VanDerWaalsContact NE1-CB 3.34Å; W85-D362 PolarHBondContact NE1-OD2 2.89Å; W85-F363 AromaticContact CH2-CD1 3.62Å; W85-F363 HydrophobicContact CH2-CD1 3.62Å; W85-F363 HydrophobicContact CH2-CD2 4.25Å; W85-F363 AromaticContact CH2-CE1 3.48Å; W85-F363 HydrophobicContact CH2-CE1 3.48Å; W85-F363 VanDerWaalsContact CH2-CE1 3.48Å; W85-F363 HydrophobicContact CH2-CE2 4.12Å; W85-F363 HydrophobicContact CH2-CG 4.01Å; W85-F363 AromaticContact CH2-CZ 3.72Å; W85-F363 HydrophobicContact CH2-CZ 3.72Å; W85-F363 HydrophobicContact CZ2-CD1 4.36Å; W85-F363 HydrophobicContact CZ2-CD2 4.29Å; W85-F363 HydrophobicContact CZ2-CE1 4.41Å; W85-F363 HydrophobicContact CZ2-CE2 4.33Å; W85-F363 HydrophobicContact CZ2-CG 4.3Å; W85-F363 HydrophobicContact CZ2-CZ 4.37Å; W85-F363 HydrophobicContact CZ3-CE1 4.26Å; W85-L366 HydrophobicContact CD2-CD1 3.41Å; W85-L366 VanDerWaalsContact CD2-CD1 3.41Å; W85-L366 HydrophobicContact CE3-CD1 3.27Å; W85-L366 HydrophobicContact CG-CD1 4.23Å; W85-L366 HydrophobicContact CH2-CD1 3.45Å; W85-L366 VanDerWaalsContact CH2-CD1 3.45Å; W85-L366 HydrophobicContact CZ2-CD1 3.56Å; W85-L366 HydrophobicContact CZ3-CD1 3.32Å
86	V	93.6	Very high	87.8	Confident	12 Å²	12	55.1 Å²	55.1	7%	0.073	27%	0.267	C	S	.	.	S	Bend	trans	-122.6	106.2	173.4	179.4	0	0	0	0	108.2	N88 Y91 F92 F145 L148	V86-N88 PolarHBondContact O-N 3.43Å; V86-Y91 HydrophobicContact CG1-CD2 4.21Å; V86-Y91 HydrophobicContact CG1-CG 4.22Å; V86-F92 HydrophobicContact CB-CE1 4.05Å; V86-F92 HydrophobicContact CB-CE2 3.92Å; V86-F92 HydrophobicContact CB-CZ 3.54Å; V86-F92 HydrophobicContact CG1-CD1 4.38Å; V86-F92 HydrophobicContact CG1-CD2 4.07Å; V86-F92 HydrophobicContact CG1-CE1 4.05Å; V86-F92 HydrophobicContact CG1-CE2 3.7Å; V86-F92 HydrophobicContact CG1-CG 4.41Å; V86-F92 HydrophobicContact CG1-CZ 3.71Å; V86-F92 HydrophobicContact CG2-CE1 4.01Å; V86-F92 HydrophobicContact CG2-CZ 3.96Å; V86-F145 HydrophobicContact CG1-CE2 4.31Å; V86-F145 HydrophobicContact CG1-CZ 4.25Å; V86-F145 HydrophobicContact CG2-CE2 4.11Å; V86-F145 HydrophobicContact CG2-CZ 4.12Å; V86-L148 HydrophobicContact CG2-CD2 4.22Å
87	P	91.8	Very high	88.1	Confident	43 Å²	43	51.7 Å²	51.7	28%	0.279	25%	0.253	S	S	.	.			trans	-82.5	-10.2	-165	29.5	-35.2	0	0	0	115.2	Y91	P87-Y91 HydrophobicContact CG-CE2 4.21Å
88	N	92.1	Very high	88.7	Confident	43 Å²	43	53.7 Å²	53.7	23%	0.23	26%	0.259	C	S	.	.	S	Bend	trans	-143.1	147.9	-177.5	-60.8	-108.2	0	0	0	110.2	V86 E90 Y91 R206 W208	V86-N88 PolarHBondContact O-N 3.43Å; N88-E90 VanDerWaalsContact C-N 3.28Å; N88-E90 PolarHBondContact O-N 2.97Å; N88-Y91 HydrophobicContact CB-CD2 3.84Å; N88-Y91 HydrophobicContact CB-CE2 3.93Å; N88-Y91 WeakPolarHBondContact O-CD2 3.5Å; N88-Y91 PolarHBondContact O-N 2.87Å; N88-R206 PolarHBondContact OD1-NH1 3.34Å; N88-W208 HydrophobicContact CB-CH2 3.74Å; N88-W208 HydrophobicContact CB-CZ2 3.88Å
89	M	89.7	Confident	89.6	Confident	52 Å²	52	48.2 Å²	48.2	26%	0.256	24%	0.235	S	C	.	.	H	α-helix	trans	-67.3	-29.2	-175.7	-169.9	61.1	78.3	0	0	112.7	Y91 F92 Y93 E107 E111	M89-Y91 PolarHBondContact O-N 3.03Å; M89-F92 WeakPolarHBondContact O-CA 3.41Å; M89-F92 WeakPolarHBondContact O-CB 3.31Å; M89-F92 PolarHBondContact O-N 3.26Å; M89-F92 HydrophobicContact SD-CB 4.22Å; M89-F92 HydrophobicContact SD-CD2 3.74Å; M89-F92 HydrophobicContact SD-CG 4.42Å; M89-Y93 HydrophobicContact CG-CE1 4.04Å; M89-Y93 HydrophobicContact CG-CE2 4.13Å; M89-Y93 PolarHBondContact O-N 3.07Å; M89-Y93 VanDerWaalsContact O-N 3.11Å; M89-E107 HydrophobicContact CE-CG 4.16Å; M89-E107 HydrophobicContact CG-CG 4.35Å; M89-E107 HydrophobicContact SD-CG 3.86Å; M89-E111 HydrophobicContact CE-CB 4.27Å; M89-E111 HydrophobicContact CE-CG 4.32Å
90	E	94.1	Very high	90.5	Very high	50 Å²	50	47.4 Å²	47.4	23%	0.234	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-25.6	-178.5	-62.9	92.1	148	0	0	112.9	N88 F92 Y93 G94 A175 W208	N88-E90 VanDerWaalsContact C-N 3.28Å; N88-E90 PolarHBondContact O-N 2.97Å; E90-F92 VanDerWaalsContact C-N 3.33Å; E90-Y93 HydrophobicContact CB-CD2 4.44Å; E90-Y93 HydrophobicContact CG-CD2 4.24Å; E90-Y93 WeakPolarHBondContact O-CB 3.43Å; E90-Y93 PolarHBondContact O-N 3.21Å; E90-G94 PolarHBondContact O-N 2.91Å; E90-A175 WeakPolarHBondContact O-CB 3.5Å; E90-W208 HydrophobicContact CB-CD2 3.53Å; E90-W208 VanDerWaalsContact CB-CE2 3.45Å; E90-W208 HydrophobicContact CB-CE3 3.64Å; E90-W208 HydrophobicContact CB-CG 4.22Å; E90-W208 HydrophobicContact CB-CH2 3.69Å; E90-W208 HydrophobicContact CB-CZ2 3.55Å; E90-W208 HydrophobicContact CB-CZ3 3.72Å; E90-W208 HydrophobicContact CG-CD2 3.82Å; E90-W208 VanDerWaalsContact CG-CE2 3.42Å; E90-W208 HydrophobicContact CG-CE3 4.44Å; E90-W208 HydrophobicContact CG-CG 4.13Å; E90-W208 HydrophobicContact CG-CH2 4.42Å; E90-W208 HydrophobicContact CG-CZ2 3.77Å; E90-W208 PolarHBondContact OE1-NE1 3.05Å; E90-W208 WeakPolarHBondContact OE2-CZ2 3.48Å
91	Y	93.9	Very high	91	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-38.7	169.1	-69.3	-69.2	0	0	0	111.8	V86 P87 N88 M89 G94 L95 F145 R146 E167 A175 F177 W208	V86-Y91 HydrophobicContact CG1-CD2 4.21Å; V86-Y91 HydrophobicContact CG1-CG 4.22Å; P87-Y91 HydrophobicContact CG-CE2 4.21Å; N88-Y91 HydrophobicContact CB-CD2 3.84Å; N88-Y91 HydrophobicContact CB-CE2 3.93Å; N88-Y91 WeakPolarHBondContact O-CD2 3.5Å; N88-Y91 PolarHBondContact O-N 2.87Å; M89-Y91 PolarHBondContact O-N 3.03Å; Y91-G94 PolarHBondContact O-N 3.37Å; Y91-L95 VanDerWaalsContact O-CG 3.32Å; Y91-L95 WeakPolarHBondContact O-CG 3.24Å; Y91-L95 PolarHBondContact O-N 3.4Å; Y91-F145 HydrophobicContact CD1-CB 4.17Å; Y91-F145 AromaticContact CD1-CD1 3.7Å; Y91-F145 HydrophobicContact CD1-CD1 3.7Å; Y91-F145 AromaticContact CD1-CD2 3.62Å; Y91-F145 HydrophobicContact CD1-CD2 3.62Å; Y91-F145 AromaticContact CD1-CE1 3.92Å; Y91-F145 HydrophobicContact CD1-CE1 3.92Å; Y91-F145 AromaticContact CD1-CE2 3.84Å; Y91-F145 HydrophobicContact CD1-CE2 3.84Å; Y91-F145 AromaticContact CD1-CG 3.55Å; Y91-F145 HydrophobicContact CD1-CG 3.55Å; Y91-F145 AromaticContact CD1-CZ 4Å; Y91-F145 HydrophobicContact CD1-CZ 4Å; Y91-F145 HydrophobicContact CE1-CB 4.09Å; Y91-F145 HydrophobicContact CE1-CD1 4.45Å; Y91-F145 AromaticContact CE1-CD2 3.99Å; Y91-F145 HydrophobicContact CE1-CD2 3.99Å; Y91-F145 AromaticContact CE1-CG 3.93Å; Y91-F145 HydrophobicContact CE1-CG 3.93Å; Y91-F145 HydrophobicContact CG-CD1 4.49Å; Y91-F145 HydrophobicContact CG-CD2 4.16Å; Y91-F145 HydrophobicContact CG-CE1 4.28Å; Y91-F145 AromaticContact CG-CE2 3.93Å; Y91-F145 HydrophobicContact CG-CE2 3.93Å; Y91-F145 HydrophobicContact CG-CG 4.44Å; Y91-F145 HydrophobicContact CG-CZ 4.01Å; Y91-R146 PolarHBondContact OH-NH1 2.93Å; Y91-E167 PolarHBondContact OH-OE1 3.15Å; Y91-A175 HydrophobicContact CD1-CB 4.16Å; Y91-A175 VanDerWaalsContact CE1-O 3.25Å; Y91-A175 WeakPolarHBondContact CE1-O 3.39Å; Y91-F177 WeakPolarHBondContact OH-CD1 3.41Å; Y91-F177 WeakPolarHBondContact OH-CE1 3.45Å; Y91-W208 HydrophobicContact CD1-CZ3 4.35Å; Y91-W208 HydrophobicContact CD2-CH2 4.01Å; Y91-W208 HydrophobicContact CD2-CZ3 4.26Å; Y91-W208 HydrophobicContact CE1-CZ3 4.01Å; Y91-W208 AromaticContact CE2-CH2 3.58Å; Y91-W208 HydrophobicContact CE2-CH2 3.58Å; Y91-W208 AromaticContact CE2-CZ3 3.89Å; Y91-W208 HydrophobicContact CE2-CZ3 3.89Å; Y91-W208 HydrophobicContact CG-CZ3 4.44Å; Y91-W208 AromaticContact CZ-CH2 3.84Å; Y91-W208 AromaticContact CZ-CZ3 3.72Å
92	F	90.8	Very high	90.8	Very high	7 Å²	7	46.1 Å²	46.1	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-68.7	-35.4	173.9	-65.4	-60.6	0	0	0	112.1	V86 M89 E90 L95 A96 F110 F114	V86-F92 HydrophobicContact CB-CE1 4.05Å; V86-F92 HydrophobicContact CB-CE2 3.92Å; V86-F92 HydrophobicContact CB-CZ 3.54Å; V86-F92 HydrophobicContact CG1-CD1 4.38Å; V86-F92 HydrophobicContact CG1-CD2 4.07Å; V86-F92 HydrophobicContact CG1-CE1 4.05Å; V86-F92 HydrophobicContact CG1-CE2 3.7Å; V86-F92 HydrophobicContact CG1-CG 4.41Å; V86-F92 HydrophobicContact CG1-CZ 3.71Å; V86-F92 HydrophobicContact CG2-CE1 4.01Å; V86-F92 HydrophobicContact CG2-CZ 3.96Å; M89-F92 WeakPolarHBondContact O-CA 3.41Å; M89-F92 WeakPolarHBondContact O-CB 3.31Å; M89-F92 PolarHBondContact O-N 3.26Å; M89-F92 HydrophobicContact SD-CB 4.22Å; M89-F92 HydrophobicContact SD-CD2 3.74Å; M89-F92 HydrophobicContact SD-CG 4.42Å; E90-F92 VanDerWaalsContact C-N 3.33Å; F92-L95 HydrophobicContact CD1-CD1 4.06Å; F92-L95 PolarHBondContact O-N 3Å; F92-A96 WeakPolarHBondContact O-CB 3.33Å; F92-A96 PolarHBondContact O-N 3.13Å; F92-F110 HydrophobicContact CB-CB 4Å; F92-F110 HydrophobicContact CB-CD2 3.97Å; F92-F110 HydrophobicContact CB-CG 4.23Å; F92-F110 HydrophobicContact CD1-CB 3.5Å; F92-F110 HydrophobicContact CD1-CD1 4.2Å; F92-F110 HydrophobicContact CD1-CD2 4.28Å; F92-F110 AromaticContact CD1-CG 3.78Å; F92-F110 HydrophobicContact CD1-CG 3.78Å; F92-F110 HydrophobicContact CD2-CB 4.49Å; F92-F110 HydrophobicContact CE1-CB 4.01Å; F92-F110 HydrophobicContact CE1-CG 4.49Å; F92-F110 HydrophobicContact CG-CB 3.77Å; F92-F110 HydrophobicContact CG-CG 4.28Å; F92-F114 HydrophobicContact CE1-CB 4.07Å; F92-F114 HydrophobicContact CZ-CB 4.15Å
93	Y	91.6	Very high	90.5	Very high	54 Å²	54	45.8 Å²	45.8	21%	0.212	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-44.4	170.4	-61.4	-28.8	0	0	0	111.8	M89 E90 L95 A96 D97 R103 E107	M89-Y93 HydrophobicContact CG-CE1 4.04Å; M89-Y93 HydrophobicContact CG-CE2 4.13Å; M89-Y93 PolarHBondContact O-N 3.07Å; M89-Y93 VanDerWaalsContact O-N 3.11Å; E90-Y93 HydrophobicContact CB-CD2 4.44Å; E90-Y93 HydrophobicContact CG-CD2 4.24Å; E90-Y93 WeakPolarHBondContact O-CB 3.43Å; E90-Y93 PolarHBondContact O-N 3.21Å; Y93-L95 VanDerWaalsContact C-N 3.33Å; Y93-L95 PolarHBondContact O-N 3.29Å; Y93-A96 WeakPolarHBondContact O-CB 3.29Å; Y93-A96 PolarHBondContact O-N 2.74Å; Y93-D97 VanDerWaalsContact O-CG 3.3Å; Y93-D97 PolarHBondContact O-N 3.01Å; Y93-R103 HydrophobicContact CD1-CB 4.38Å; Y93-E107 HydrophobicContact CE1-CB 4.08Å; Y93-E107 HydrophobicContact CE1-CG 4Å; Y93-E107 WeakPolarHBondContact CE1-OE2 3.48Å; Y93-E107 VanDerWaalsContact OH-CD 3.26Å; Y93-E107 PolarHBondContact OH-OE2 3.41Å
94	G	93.8	Very high	89.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-36.9	175.5	0	0	0	0	0	113.5	E90 Y91 F98 S174	E90-G94 PolarHBondContact O-N 2.91Å; Y91-G94 PolarHBondContact O-N 3.37Å; G94-F98 WeakPolarHBondContact O-CB 3.36Å; G94-F98 PolarHBondContact O-N 3.33Å; G94-S174 VanDerWaalsContact C-CB 3.42Å; G94-S174 WeakPolarHBondContact CA-O 3.41Å; G94-S174 WeakPolarHBondContact O-CB 3.29Å; G94-S174 PolarHBondContact O-OG 2.95Å
95	L	91.6	Very high	88.9	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-65.6	-43	172.7	-73.7	166.4	0	0	0	111.2	Y91 F92 Y93 D97 F98 M99 F110 F145 S174 F363	Y91-L95 VanDerWaalsContact O-CG 3.32Å; Y91-L95 WeakPolarHBondContact O-CG 3.24Å; Y91-L95 PolarHBondContact O-N 3.4Å; F92-L95 HydrophobicContact CD1-CD1 4.06Å; F92-L95 PolarHBondContact O-N 3Å; Y93-L95 VanDerWaalsContact C-N 3.33Å; Y93-L95 PolarHBondContact O-N 3.29Å; L95-D97 VanDerWaalsContact C-N 3.34Å; L95-D97 PolarHBondContact O-N 3.2Å; L95-F98 PolarHBondContact O-N 3.04Å; L95-M99 WeakPolarHBondContact O-CB 3.44Å; L95-M99 VanDerWaalsContact O-CG 3.26Å; L95-M99 WeakPolarHBondContact O-CG 3.23Å; L95-M99 PolarHBondContact O-N 3.49Å; L95-F110 HydrophobicContact CB-CE2 4.36Å; L95-F110 HydrophobicContact CB-CZ 4.24Å; L95-F145 HydrophobicContact CD1-CE1 3.95Å; L95-F145 HydrophobicContact CD1-CZ 4Å; L95-F145 HydrophobicContact CD2-CE1 4.08Å; L95-F145 HydrophobicContact CG-CE1 3.88Å; L95-F145 HydrophobicContact CG-CZ 4.44Å; L95-S174 WeakPolarHBondContact CA-OG 3.4Å; L95-S174 PolarHBondContact N-OG 3.08Å; L95-F363 HydrophobicContact CD1-CZ 3.86Å; L95-F363 HydrophobicContact CD2-CE2 4.37Å; L95-F363 HydrophobicContact CD2-CZ 4.05Å
96	A	89.9	Confident	88	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.3	-47	175.7	0	0	0	0	0	111.3	F92 Y93 M99 K100 I101 R103 S106 F110	F92-A96 WeakPolarHBondContact O-CB 3.33Å; F92-A96 PolarHBondContact O-N 3.13Å; Y93-A96 WeakPolarHBondContact O-CB 3.29Å; Y93-A96 PolarHBondContact O-N 2.74Å; A96-M99 CarbonylContact O-C 3.48Å; A96-M99 PolarHBondContact O-N 3.34Å; A96-K100 PolarHBondContact O-N 3.37Å; A96-I101 PolarHBondContact O-N 2.8Å; A96-R103 HydrophobicContact CB-CG 4.42Å; A96-S106 WeakPolarHBondContact CB-OG 3.34Å; A96-F110 HydrophobicContact CB-CE2 4.07Å
97	D	90.3	Very high	87.1	Confident	54 Å²	54	57.9 Å²	57.9	29%	0.289	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-45.1	178.4	-65.9	-20.8	0	0	0	112.1	Y93 L95 M99 K100 R103	Y93-D97 VanDerWaalsContact O-CG 3.3Å; Y93-D97 PolarHBondContact O-N 3.01Å; L95-D97 VanDerWaalsContact C-N 3.34Å; L95-D97 PolarHBondContact O-N 3.2Å; D97-M99 VanDerWaalsContact C-N 3.29Å; D97-M99 PolarHBondContact O-N 3.48Å; D97-K100 PolarHBondContact O-N 2.94Å; D97-R103 WeakPolarHBondContact OD1-CG 3.33Å; D97-R103 IonicContact OD1-CZ 3.22Å; D97-R103 IonicContact OD1-NE 3.15Å; D97-R103 PolarHBondContact OD1-NE 3.45Å; D97-R103 IonicContact OD1-NH2 2.61Å; D97-R103 IonicContact OD2-CZ 3.64Å; D97-R103 VanDerWaalsContact OD2-CZ 3.22Å; D97-R103 IonicContact OD2-NE 3.6Å; D97-R103 PolarHBondContact OD2-NE 3.36Å; D97-R103 VanDerWaalsContact OD2-NE 3.15Å; D97-R103 IonicContact OD2-NH2 2.82Å; D97-R103 PolarHBondContact OD2-NH2 3.25Å
98	F	89.7	Confident	86.3	Confident	73 Å²	73	63.2 Å²	63.2	32%	0.32	29%	0.292	S	S	.	.	H	α-helix	trans	-59.2	-42.3	176.7	177	-102.7	0	0	0	111.6	G94 L95 K100 L142 S174 Y211	G94-F98 WeakPolarHBondContact O-CB 3.36Å; G94-F98 PolarHBondContact O-N 3.33Å; L95-F98 PolarHBondContact O-N 3.04Å; F98-K100 PolarHBondContact O-N 3.17Å; F98-L142 HydrophobicContact CE2-CD2 4.28Å; F98-L142 HydrophobicContact CE2-CG 4.03Å; F98-S174 WeakPolarHBondContact CB-OG 3.22Å; F98-Y211 HydrophobicContact CB-CD1 4.21Å; F98-Y211 AromaticContact CD2-CD1 3.69Å; F98-Y211 HydrophobicContact CD2-CD1 3.69Å; F98-Y211 HydrophobicContact CD2-CD2 4.24Å; F98-Y211 AromaticContact CD2-CE1 3.62Å; F98-Y211 HydrophobicContact CD2-CE1 3.62Å; F98-Y211 HydrophobicContact CD2-CE2 4.22Å; F98-Y211 AromaticContact CD2-CG 3.98Å; F98-Y211 HydrophobicContact CD2-CG 3.98Å; F98-Y211 AromaticContact CD2-CZ 3.9Å; F98-Y211 HydrophobicContact CE2-CE1 4.23Å; F98-Y211 HydrophobicContact CE2-CE2 4.37Å; F98-Y211 HydrophobicContact CG-CD1 4.45Å
99	M	86.3	Confident	85.5	Confident	84 Å²	84	64.5 Å²	64.5	41%	0.414	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-4.7	176.1	-65.3	178.4	75.2	0	0	113.8	L95 A96 D97 I101 F110 M375	L95-M99 WeakPolarHBondContact O-CB 3.44Å; L95-M99 VanDerWaalsContact O-CG 3.26Å; L95-M99 WeakPolarHBondContact O-CG 3.23Å; L95-M99 PolarHBondContact O-N 3.49Å; A96-M99 CarbonylContact O-C 3.48Å; A96-M99 PolarHBondContact O-N 3.34Å; D97-M99 VanDerWaalsContact C-N 3.29Å; D97-M99 PolarHBondContact O-N 3.48Å; M99-I101 VanDerWaalsContact C-N 3.29Å; M99-I101 HydrophobicContact CB-CD1 3.76Å; M99-I101 HydrophobicContact CB-CG1 3.87Å; M99-I101 HydrophobicContact CE-CD1 3.79Å; M99-I101 PolarHBondContact O-N 2.9Å; M99-I101 HydrophobicContact SD-CD1 4.16Å; M99-F110 HydrophobicContact SD-CZ 4.02Å; M99-M375 HydrophobicContact CE-CE 4.27Å
100	K	87.7	Confident	84.9	Confident	187 Å²	187	62.8 Å²	62.8	81%	0.813	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	38.6	-174.5	-53.8	-179.1	180	-178.8	0	113.2	A96 D97 F98	A96-K100 PolarHBondContact O-N 3.37Å; D97-K100 PolarHBondContact O-N 2.94Å; F98-K100 PolarHBondContact O-N 3.17Å
101	I	84.6	Confident	83.9	Confident	39 Å²	39	65.4 Å²	65.4	20%	0.2	30%	0.302	C	S	.	.			trans	-101.4	145.8	175.8	-57.6	174	0	0	0	108.6	A96 M99 R103	A96-I101 PolarHBondContact O-N 2.8Å; M99-I101 VanDerWaalsContact C-N 3.29Å; M99-I101 HydrophobicContact CB-CD1 3.76Å; M99-I101 HydrophobicContact CB-CG1 3.87Å; M99-I101 HydrophobicContact CE-CD1 3.79Å; M99-I101 PolarHBondContact O-N 2.9Å; M99-I101 HydrophobicContact SD-CD1 4.16Å; I101-R103 PolarHBondContact O-N 3.44Å
102	N	83.3	Confident	83	Confident	92 Å²	92	74.4 Å²	74.4	49%	0.492	34%	0.337	S	S	.	.			trans	-66.1	123.7	177.5	-179.6	-66.3	0	0	0	111.3	T104 W105 S106	N102-T104 VanDerWaalsContact C-N 3.3Å; N102-T104 PolarHBondContact O-N 3.05Å; N102-T104 VanDerWaalsContact OD1-CB 3.3Å; N102-T104 WeakPolarHBondContact OD1-CB 3.27Å; N102-T104 PolarHBondContact OD1-N 2.96Å; N102-T104 PolarHBondContact OD1-OG1 3.02Å; N102-W105 PolarHBondContact O-N 3.13Å; N102-S106 PolarHBondContact O-N 2.93Å; N102-S106 VanDerWaalsContact O-N 3.07Å; N102-S106 PolarHBondContact O-OG 3.3Å
103	R	85.3	Confident	82.2	Confident	94 Å²	94	77 Å²	77	36%	0.355	35%	0.351	S	S	.	.	H	α-helix	trans	-51.6	-41.9	-177.5	-68.2	-172.8	-179	-169.4	2.3	113.9	Y93 A96 D97 I101 W105 S106 E107	Y93-R103 HydrophobicContact CD1-CB 4.38Å; A96-R103 HydrophobicContact CB-CG 4.42Å; D97-R103 WeakPolarHBondContact OD1-CG 3.33Å; D97-R103 IonicContact OD1-CZ 3.22Å; D97-R103 IonicContact OD1-NE 3.15Å; D97-R103 PolarHBondContact OD1-NE 3.45Å; D97-R103 IonicContact OD1-NH2 2.61Å; D97-R103 IonicContact OD2-CZ 3.64Å; D97-R103 VanDerWaalsContact OD2-CZ 3.22Å; D97-R103 IonicContact OD2-NE 3.6Å; D97-R103 PolarHBondContact OD2-NE 3.36Å; D97-R103 VanDerWaalsContact OD2-NE 3.15Å; D97-R103 IonicContact OD2-NH2 2.82Å; D97-R103 PolarHBondContact OD2-NH2 3.25Å; I101-R103 PolarHBondContact O-N 3.44Å; R103-W105 PolarHBondContact O-N 3.48Å; R103-S106 WeakPolarHBondContact CA-OG 3.49Å; R103-S106 PolarHBondContact O-N 3.22Å; R103-S106 PolarHBondContact O-OG 2.86Å; R103-E107 PolarHBondContact O-N 3.09Å
104	T	79	Confident	81.6	Confident	101 Å²	101	75 Å²	75	62%	0.62	34%	0.343	S	S	*	.	H	α-helix	trans	-65.2	-37	-174.8	-50	0	0	0	0	112.7	N102	N102-T104 VanDerWaalsContact C-N 3.3Å; N102-T104 PolarHBondContact O-N 3.05Å; N102-T104 VanDerWaalsContact OD1-CB 3.3Å; N102-T104 WeakPolarHBondContact OD1-CB 3.27Å; N102-T104 PolarHBondContact OD1-N 2.96Å; N102-T104 PolarHBondContact OD1-OG1 3.02Å
105	W	74.8	Confident	80.6	Confident	168 Å²	168	76.5 Å²	76.5	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-84.7	-33.1	177.8	-63.8	101.7	0	0	0	111.9	N102 R103 I109	N102-W105 PolarHBondContact O-N 3.13Å; R103-W105 PolarHBondContact O-N 3.48Å; W105-I109 WeakPolarHBondContact O-CD1 3.45Å; W105-I109 WeakPolarHBondContact O-CG1 3.45Å
106	S	74.6	Confident	80.1	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.021	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-30	-178.5	60.4	0	0	0	0	113.4	A96 N102 R103 I109 F110	A96-S106 WeakPolarHBondContact CB-OG 3.34Å; N102-S106 PolarHBondContact O-N 2.93Å; N102-S106 VanDerWaalsContact O-N 3.07Å; N102-S106 PolarHBondContact O-OG 3.3Å; R103-S106 WeakPolarHBondContact CA-OG 3.49Å; R103-S106 PolarHBondContact O-N 3.22Å; R103-S106 PolarHBondContact O-OG 2.86Å; S106-I109 PolarHBondContact O-N 3.22Å; S106-F110 WeakPolarHBondContact O-CB 3.42Å; S106-F110 WeakPolarHBondContact O-CD2 3.08Å; S106-F110 WeakPolarHBondContact O-CG 3.13Å; S106-F110 PolarHBondContact O-N 3.19Å
107	E	73.9	Confident	80	Confident	63 Å²	63	82.6 Å²	82.6	29%	0.294	40%	0.396	S	S	.	.	H	α-helix	trans	-54.1	-57.6	178.1	-172.6	178.1	145.4	0	0	111.5	M89 Y93 R103 I109 F110 E111	M89-E107 HydrophobicContact CE-CG 4.16Å; M89-E107 HydrophobicContact CG-CG 4.35Å; M89-E107 HydrophobicContact SD-CG 3.86Å; Y93-E107 HydrophobicContact CE1-CB 4.08Å; Y93-E107 HydrophobicContact CE1-CG 4Å; Y93-E107 WeakPolarHBondContact CE1-OE2 3.48Å; Y93-E107 VanDerWaalsContact OH-CD 3.26Å; Y93-E107 PolarHBondContact OH-OE2 3.41Å; R103-E107 PolarHBondContact O-N 3.09Å; E107-I109 PolarHBondContact O-N 3.18Å; E107-F110 PolarHBondContact O-N 3.37Å; E107-E111 VanDerWaalsContact O-CB 3.29Å; E107-E111 WeakPolarHBondContact O-CB 3.19Å; E107-E111 PolarHBondContact O-N 3.36Å
108	K	74.8	Confident	80.1	Confident	155 Å²	155	83.5 Å²	83.5	67%	0.674	40%	0.398	S	S	*	.	H	α-helix	trans	-61.3	-34.1	179.5	-66.1	-175.7	178.1	-179	0	112.7	Y112	K108-Y112 WeakPolarHBondContact O-CB 3.32Å; K108-Y112 PolarHBondContact O-N 2.96Å; K108-Y112 VanDerWaalsContact O-N 3.09Å
109	I	75.9	Confident	80.4	Confident	71 Å²	71	80.1 Å²	80.1	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-71.2	-47.8	178.9	-67.4	169.9	0	0	0	110.2	W105 S106 E107 Y112 L113	W105-I109 WeakPolarHBondContact O-CD1 3.45Å; W105-I109 WeakPolarHBondContact O-CG1 3.45Å; S106-I109 PolarHBondContact O-N 3.22Å; E107-I109 PolarHBondContact O-N 3.18Å; I109-Y112 PolarHBondContact O-N 3.41Å; I109-L113 HydrophobicContact CG2-CD1 3.63Å; I109-L113 HydrophobicContact CG2-CG 4.31Å; I109-L113 VanDerWaalsContact O-CB 3.24Å; I109-L113 WeakPolarHBondContact O-CB 3.39Å; I109-L113 WeakPolarHBondContact O-CG 3.42Å; I109-L113 PolarHBondContact O-N 2.65Å
110	F	77.2	Confident	80.8	Confident	15 Å²	15	77.2 Å²	77.2	7%	0.066	37%	0.37	C	S	.	.	H	α-helix	trans	-70.2	-40.1	-178.1	-74.8	-50.3	0	0	0	112	F92 L95 A96 M99 S106 E107 L113 F114 G115	F92-F110 HydrophobicContact CB-CB 4Å; F92-F110 HydrophobicContact CB-CD2 3.97Å; F92-F110 HydrophobicContact CB-CG 4.23Å; F92-F110 HydrophobicContact CD1-CB 3.5Å; F92-F110 HydrophobicContact CD1-CD1 4.2Å; F92-F110 HydrophobicContact CD1-CD2 4.28Å; F92-F110 AromaticContact CD1-CG 3.78Å; F92-F110 HydrophobicContact CD1-CG 3.78Å; F92-F110 HydrophobicContact CD2-CB 4.49Å; F92-F110 HydrophobicContact CE1-CB 4.01Å; F92-F110 HydrophobicContact CE1-CG 4.49Å; F92-F110 HydrophobicContact CG-CB 3.77Å; F92-F110 HydrophobicContact CG-CG 4.28Å; L95-F110 HydrophobicContact CB-CE2 4.36Å; L95-F110 HydrophobicContact CB-CZ 4.24Å; A96-F110 HydrophobicContact CB-CE2 4.07Å; M99-F110 HydrophobicContact SD-CZ 4.02Å; S106-F110 WeakPolarHBondContact O-CB 3.42Å; S106-F110 WeakPolarHBondContact O-CD2 3.08Å; S106-F110 WeakPolarHBondContact O-CG 3.13Å; S106-F110 PolarHBondContact O-N 3.19Å; E107-F110 PolarHBondContact O-N 3.37Å; F110-L113 PolarHBondContact O-N 2.89Å; F110-F114 AromaticContact CD1-CD2 3.73Å; F110-F114 HydrophobicContact CD1-CD2 3.73Å; F110-F114 AromaticContact CD1-CE2 3.77Å; F110-F114 HydrophobicContact CD1-CE2 3.77Å; F110-F114 HydrophobicContact CE1-CE2 4.19Å; F110-F114 WeakPolarHBondContact O-CA 3.22Å; F110-F114 WeakPolarHBondContact O-CB 3.27Å; F110-F114 PolarHBondContact O-N 3.08Å; F110-G115 PolarHBondContact O-N 2.8Å
111	E	73.9	Confident	81.2	Confident	106 Å²	106	68.3 Å²	68.3	50%	0.495	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-47.6	173.6	-172.5	179.4	-162	0	0	110.9	M89 E107 L113 G115	M89-E111 HydrophobicContact CE-CB 4.27Å; M89-E111 HydrophobicContact CE-CG 4.32Å; E107-E111 VanDerWaalsContact O-CB 3.29Å; E107-E111 WeakPolarHBondContact O-CB 3.19Å; E107-E111 PolarHBondContact O-N 3.36Å; E111-L113 PolarHBondContact O-N 2.83Å; E111-G115 WeakPolarHBondContact O-CA 3.33Å; E111-G115 PolarHBondContact O-N 3.38Å
112	Y	74.8	Confident	81.7	Confident	188 Å²	188	68.9 Å²	68.9	74%	0.737	33%	0.331	S	S	*	.	H	α-helix	trans	-63.2	-43.2	178	176.8	-101.1	0	0	0	113	K108 I109	K108-Y112 WeakPolarHBondContact O-CB 3.32Å; K108-Y112 PolarHBondContact O-N 2.96Å; K108-Y112 VanDerWaalsContact O-N 3.09Å; I109-Y112 PolarHBondContact O-N 3.41Å
113	L	73.4	Confident	82.3	Confident	62 Å²	62	66.9 Å²	66.9	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-81.3	-34.5	-175.6	-69.6	177.9	0	0	0	113	I109 F110 E111 Y117	I109-L113 HydrophobicContact CG2-CD1 3.63Å; I109-L113 HydrophobicContact CG2-CG 4.31Å; I109-L113 VanDerWaalsContact O-CB 3.24Å; I109-L113 WeakPolarHBondContact O-CB 3.39Å; I109-L113 WeakPolarHBondContact O-CG 3.42Å; I109-L113 PolarHBondContact O-N 2.65Å; F110-L113 PolarHBondContact O-N 2.89Å; E111-L113 PolarHBondContact O-N 2.83Å; L113-Y117 WeakPolarHBondContact O-CE2 3.45Å
114	F	79.1	Confident	82.8	Confident	12 Å²	12	64.1 Å²	64.1	5%	0.053	31%	0.312	C	S	.	.	H	α-helix	trans	-134	-12.3	-166.2	-51.2	-68.4	0	0	0	116	W85 F92 F110 S116 Y117 L366 T367	W85-F114 HydrophobicContact CE3-CB 4.21Å; W85-F114 HydrophobicContact CZ3-CB 3.84Å; W85-F114 HydrophobicContact CZ3-CD1 4.02Å; W85-F114 AromaticContact CZ3-CG 3.98Å; W85-F114 HydrophobicContact CZ3-CG 3.98Å; F92-F114 HydrophobicContact CE1-CB 4.07Å; F92-F114 HydrophobicContact CZ-CB 4.15Å; F110-F114 AromaticContact CD1-CD2 3.73Å; F110-F114 HydrophobicContact CD1-CD2 3.73Å; F110-F114 AromaticContact CD1-CE2 3.77Å; F110-F114 HydrophobicContact CD1-CE2 3.77Å; F110-F114 HydrophobicContact CE1-CE2 4.19Å; F110-F114 WeakPolarHBondContact O-CA 3.22Å; F110-F114 WeakPolarHBondContact O-CB 3.27Å; F110-F114 PolarHBondContact O-N 3.08Å; F114-S116 PolarHBondContact O-N 3.11Å; F114-S116 VanDerWaalsContact O-N 3.09Å; F114-Y117 HydrophobicContact CB-CD2 4.33Å; F114-Y117 HydrophobicContact CD1-CD2 4.14Å; F114-Y117 HydrophobicContact CD1-CE2 4.05Å; F114-Y117 PolarHBondContact O-N 3.38Å; F114-L366 HydrophobicContact CD1-CB 3.83Å; F114-L366 HydrophobicContact CD1-CD1 4.33Å; F114-L366 HydrophobicContact CE1-CB 3.81Å; F114-T367 HydrophobicContact CE1-CG2 3.75Å; F114-T367 HydrophobicContact CZ-CG2 3.73Å
115	G	72.4	Confident	83.6	Confident	32 Å²	32	59.5 Å²	59.5	33%	0.33	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.3	-172.3	0	0	0	0	0	114.9	F110 E111	F110-G115 PolarHBondContact O-N 2.8Å; E111-G115 WeakPolarHBondContact O-CA 3.33Å; E111-G115 PolarHBondContact O-N 3.38Å
116	S	80.4	Confident	84.6	Confident	94 Å²	94	54.4 Å²	54.4	66%	0.657	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-1.7	-178.1	59.6	0	0	0	0	114.6	F114 K118	F114-S116 PolarHBondContact O-N 3.11Å; F114-S116 VanDerWaalsContact O-N 3.09Å; S116-K118 PolarHBondContact O-N 2.76Å
117	Y	89.2	Confident	85.6	Confident	42 Å²	42	55.7 Å²	55.7	17%	0.165	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-74.4	127.5	179.5	-74.1	-64.1	0	0	0	111	L41 W85 L113 F114 L366	L41-Y117 HydrophobicContact CB-CE1 4.31Å; L41-Y117 WeakPolarHBondContact CB-OH 3.49Å; W85-Y117 VanDerWaalsContact CB-O 3.25Å; W85-Y117 WeakPolarHBondContact CB-O 3.43Å; W85-Y117 PolarHBondContact N-O 3.04Å; L113-Y117 WeakPolarHBondContact O-CE2 3.45Å; F114-Y117 HydrophobicContact CB-CD2 4.33Å; F114-Y117 HydrophobicContact CD1-CD2 4.14Å; F114-Y117 HydrophobicContact CD1-CE2 4.05Å; F114-Y117 PolarHBondContact O-N 3.38Å; Y117-L366 HydrophobicContact CD1-CD2 3.67Å; Y117-L366 HydrophobicContact CD2-CB 4.09Å; Y117-L366 HydrophobicContact CD2-CD1 4.02Å; Y117-L366 HydrophobicContact CD2-CD2 3.69Å; Y117-L366 HydrophobicContact CD2-CG 4.14Å; Y117-L366 HydrophobicContact CE1-CD2 3.93Å; Y117-L366 HydrophobicContact CE2-CB 3.87Å; Y117-L366 HydrophobicContact CE2-CD2 3.94Å; Y117-L366 HydrophobicContact CE2-CG 4.36Å; Y117-L366 HydrophobicContact CG-CD1 4.36Å; Y117-L366 HydrophobicContact CG-CD2 3.57Å; Y117-L366 HydrophobicContact CG-CG 4.45Å; Y117-L366 PolarHBondContact OH-O 3.45Å
118	K	92.6	Very high	86.6	Confident	73 Å²	73	58.7 Å²	58.7	32%	0.317	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-99.4	155.6	171.1	-56.7	-60.5	-154.5	160.7	0	110	E81 K82 P83 D84 S116	E81-K118 IonicContact OE1-NZ 3.57Å; E81-K118 PolarHBondContact OE1-NZ 2.85Å; K82-K118 HydrophobicContact CB-CB 3.87Å; K82-K118 HydrophobicContact CB-CG 4.28Å; K82-K118 VanDerWaalsContact O-CD 3.23Å; K82-K118 WeakPolarHBondContact O-CD 3.46Å; K82-K118 VanDerWaalsContact O-CE 3.27Å; K82-K118 WeakPolarHBondContact O-CE 3.37Å; K82-K118 PolarHBondContact O-NZ 3.01Å; K82-K118 VanDerWaalsContact O-NZ 3.1Å; P83-K118 VanDerWaalsContact O-CA 3.29Å; P83-K118 WeakPolarHBondContact O-CA 3.27Å; D84-K118 WeakPolarHBondContact OD1-CD 3.32Å; D84-K118 WeakPolarHBondContact OD1-CE 3.29Å; D84-K118 IonicContact OD1-NZ 2.8Å; D84-K118 PolarHBondContact OD1-NZ 2.98Å; D84-K118 IonicContact OD2-NZ 3.67Å; S116-K118 PolarHBondContact O-N 2.76Å
119	I	94.9	Very high	87.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-92	153.6	171.9	72.8	178.6	0	0	0	110.6	I43 Y71 P83 W85 A121	I43-I119 HydrophobicContact CD1-CG2 3.96Å; Y71-I119 HydrophobicContact CE1-CD1 3.91Å; P83-I119 HydrophobicContact CG-CD1 3.9Å; P83-I119 HydrophobicContact CG-CG1 3.75Å; P83-I119 PolarHBondContact O-N 3.38Å; W85-I119 HydrophobicContact CB-CG2 3.91Å; W85-I119 HydrophobicContact CG-CG2 4.3Å; I119-A121 HydrophobicContact CD1-CB 4.22Å; I119-A121 HydrophobicContact CG1-CB 4.12Å; I119-A121 PolarHBondContact O-N 2.92Å
120	P	95	Very high	88	Confident	23 Å²	23	55.5 Å²	55.5	15%	0.149	29%	0.293	C	S	.	.	S	Bend	trans	-80.4	54.4	-179.1	32.2	-33.6	0	0	0	112.4	I43 P44 V154	I43-P120 HydrophobicContact CG2-CG 4.15Å; P44-P120 WeakPolarHBondContact O-CG 3.31Å; P120-V154 HydrophobicContact CG-CG1 4.28Å; P120-V154 WeakPolarHBondContact O-CG1 3.31Å
121	A	95.9	Very high	88.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.308	C	S	.	.	S	Bend	trans	-137.3	166	175.6	0	0	0	0	0	110.7	V52 C54 K82 P83 I119 V154	V52-A121 HydrophobicContact CG1-CB 4.18Å; V52-A121 CarbonylContact O-C 3.44Å; V52-A121 VanDerWaalsContact O-CA 3.27Å; V52-A121 WeakPolarHBondContact O-CA 3.39Å; C54-A121 HydrophobicContact CB-CB 4.29Å; K82-A121 WeakPolarHBondContact CA-O 3.45Å; P83-A121 WeakPolarHBondContact CD-O 3.1Å; I119-A121 HydrophobicContact CD1-CB 4.22Å; I119-A121 HydrophobicContact CG1-CB 4.12Å; I119-A121 PolarHBondContact O-N 2.92Å; A121-V154 HydrophobicContact CB-CG2 4.15Å
122	Y	96.3	Very high	89.9	Confident	52 Å²	52	58.5 Å²	58.5	20%	0.204	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.2	-179.6	-59.6	-77	0	0	0	110.6	H51 V52 G53 C54 A80 D124	H51-Y122 HydrophobicContact CB-CD2 4.48Å; H51-Y122 HydrophobicContact CB-CE2 4.11Å; H51-Y122 AromaticContact ND1-CE2 3.83Å; V52-Y122 WeakPolarHBondContact O-CD2 3.29Å; V52-Y122 PolarHBondContact O-N 3.04Å; G53-Y122 CarbonylContact C-O 3.21Å; G53-Y122 VanDerWaalsContact CA-O 3.22Å; G53-Y122 WeakPolarHBondContact CA-O 3.32Å; C54-Y122 PolarHBondContact N-O 3.15Å; A80-Y122 HydrophobicContact CB-CD1 3.87Å; A80-Y122 HydrophobicContact CB-CG 4.22Å; Y122-D124 PolarHBondContact O-N 3.26Å
123	M	95.5	Very high	91.1	Very high	50 Å²	50	49.6 Å²	49.6	25%	0.246	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	128.4	-177	-168.9	65.9	-170.9	0	0	110.9	C54 E81 P83 A125	C54-M123 CarbonylContact O-C 3.55Å; C54-M123 WeakPolarHBondContact O-CA 3.39Å; E81-M123 WeakPolarHBondContact O-CB 3.44Å; E81-M123 PolarHBondContact O-N 2.86Å; P83-M123 HydrophobicContact CB-CB 4.21Å; P83-M123 HydrophobicContact CB-CG 4.41Å; P83-M123 HydrophobicContact CB-SD 3.9Å; P83-M123 HydrophobicContact CG-CB 4.02Å; P83-M123 HydrophobicContact CG-SD 4.03Å; M123-A125 PolarHBondContact O-N 2.67Å
124	D	95.3	Very high	92.3	Very high	36 Å²	36	47.1 Å²	47.1	19%	0.193	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	20.8	177.1	-57.2	-52.2	0	0	0	114.8	C54 T55 Y122 P258 F259	C54-D124 PolarHBondContact O-N 3.21Å; T55-D124 WeakPolarHBondContact CB-OD1 3.33Å; T55-D124 PolarHBondContact OG1-OD1 2.82Å; Y122-D124 PolarHBondContact O-N 3.26Å; D124-P258 HydrophobicContact CB-CB 4.44Å; D124-P258 WeakPolarHBondContact OD2-CD 3.15Å; D124-F259 HydrophobicContact CB-CB 4.16Å
125	A	95.5	Very high	93.2	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.025	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-61.2	144.8	176.7	0	0	0	0	0	110.4	Y72 C74 M123 F127	Y72-A125 WeakPolarHBondContact CE2-O 3.33Å; Y72-A125 PolarHBondContact OH-O 3.43Å; C74-A125 HydrophobicContact CB-CB 3.89Å; M123-A125 PolarHBondContact O-N 2.67Å; A125-F127 PolarHBondContact O-N 2.8Å
126	P	95.2	Very high	94.5	Very high	62 Å²	62	45 Å²	45	40%	0.403	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-58.6	133.2	179.8	-24.8	34.3	0	0	0	112	C74 Q75	C74-P126 VanDerWaalsContact CA-O 3.27Å; C74-P126 WeakPolarHBondContact CA-O 3.49Å; C74-P126 VanDerWaalsContact CB-O 3.31Å; C74-P126 WeakPolarHBondContact CB-O 3.19Å; Q75-P126 PolarHBondContact N-O 3.26Å
127	F	96.9	Very high	95.4	Very high	29 Å²	29	40.6 Å²	40.6	13%	0.127	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-60.6	138.1	173.9	173.1	-99.6	0	0	0	110.6	Y72 P73 A125 I162 F259 T263 L264 S267	Y72-F127 HydrophobicContact CD2-CB 4.18Å; Y72-F127 AromaticContact CD2-CD2 3.86Å; Y72-F127 HydrophobicContact CD2-CD2 3.86Å; Y72-F127 HydrophobicContact CE2-CB 4.36Å; Y72-F127 HydrophobicContact CG-CD2 4.22Å; P73-F127 VanDerWaalsContact O-CD2 3.32Å; P73-F127 WeakPolarHBondContact O-CD2 3.3Å; A125-F127 PolarHBondContact O-N 2.8Å; F127-I162 HydrophobicContact CD2-CD1 4.37Å; F127-I162 HydrophobicContact CE2-CD1 3.66Å; F127-I162 HydrophobicContact CE2-CG1 4.15Å; F127-I162 HydrophobicContact CZ-CD1 4.14Å; F127-F259 HydrophobicContact CB-CE2 4.25Å; F127-F259 HydrophobicContact CB-CZ 4.14Å; F127-T263 VanDerWaalsContact CD1-O 3.32Å; F127-T263 WeakPolarHBondContact CD1-O 3.44Å; F127-L264 HydrophobicContact CB-CD2 4.25Å; F127-L264 HydrophobicContact CD1-CD2 4.24Å; F127-L264 HydrophobicContact CD2-CD2 3.83Å; F127-L264 HydrophobicContact CE2-CD2 4.24Å; F127-L264 HydrophobicContact CG-CD2 3.82Å; F127-S267 VanDerWaalsContact CE1-CB 3.47Å
128	K	94.4	Very high	95.8	Very high	126 Å²	126	38.6 Å²	38.6	55%	0.548	20%	0.201	S	C	.	.			trans	-150.5	117.8	174.5	-175.8	-179.1	177.9	-177.7	0	110.2	P73 Q75	P73-K128 CarbonylContact C-O 3.52Å; P73-K128 VanDerWaalsContact CB-O 3.25Å; P73-K128 WeakPolarHBondContact CB-O 3.39Å; P73-K128 PolarHBondContact O-N 2.87Å; Q75-K128 HydrophobicContact CB-CB 4.19Å; Q75-K128 HydrophobicContact CB-CD 4.08Å; Q75-K128 HydrophobicContact CG-CD 4.34Å
129	S	92.7	Very high	96.1	Very high	34 Å²	34	35.1 Å²	35.1	24%	0.238	19%	0.186	C	C	.	.			trans	-139	146.7	169	-175.1	0	0	0	0	110.3	E131 C133	S129-E131 VanDerWaalsContact C-N 3.33Å; S129-E131 WeakPolarHBondContact CB-O 3.31Å; S129-E131 PolarHBondContact OG-N 2.85Å; S129-E131 PolarHBondContact OG-O 2.82Å; S129-C133 PolarHBondContact OG-SG 3.37Å; S129-C133 VanDerWaalsContact OG-SG 3.39Å
130	S	87.4	Confident	96.3	Very high	125 Å²	125	35 Å²	35	87%	0.874	19%	0.186	S	C	*	.	S	Bend	trans	-80.7	-16.8	172.7	52.2	0	0	0	0	113.2
131	E	93.9	Very high	96.5	Very high	82 Å²	82	34 Å²	34	38%	0.383	18%	0.18	S	C	.	.	S	Bend	trans	-138.2	165.2	-175.2	67.7	-169	163.8	0	0	110.7	S129 C133 K406	S129-E131 VanDerWaalsContact C-N 3.33Å; S129-E131 WeakPolarHBondContact CB-O 3.31Å; S129-E131 PolarHBondContact OG-N 2.85Å; S129-E131 PolarHBondContact OG-O 2.82Å; E131-C133 PolarHBondContact O-N 3.27Å; E131-K406 WeakPolarHBondContact OE1-CE 3.42Å; E131-K406 IonicContact OE1-NZ 2.61Å; E131-K406 PolarHBondContact OE1-NZ 2.93Å; E131-K406 IonicContact OE2-NZ 3.67Å
132	K	97.7	Very high	96.6	Very high	103 Å²	103	35.8 Å²	35.8	45%	0.448	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-68	125.1	172.5	-70.2	-173.9	176.6	-171	0	110	N266 S267 D269	K132-N266 VanDerWaalsContact CE-O 3.31Å; K132-N266 WeakPolarHBondContact CE-O 3.35Å; K132-N266 WeakPolarHBondContact CE-OD1 3.48Å; K132-N266 PolarHBondContact NZ-OD1 2.92Å; K132-S267 CarbonylContact C-O 3.57Å; K132-S267 VanDerWaalsContact CA-O 3.26Å; K132-S267 WeakPolarHBondContact CA-O 3.43Å; K132-D269 HydrophobicContact CB-CB 4Å
133	C	98.6	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.6	-175.3	-60.6	0	0	0	0	110.9	S129 E131 G160 I162 S267 M268 D269	S129-C133 PolarHBondContact OG-SG 3.37Å; S129-C133 VanDerWaalsContact OG-SG 3.39Å; E131-C133 PolarHBondContact O-N 3.27Å; C133-G160 VanDerWaalsContact CB-O 3.29Å; C133-G160 WeakPolarHBondContact CB-O 3.31Å; C133-G160 PolarHBondContact SG-O 3.22Å; C133-G160 VanDerWaalsContact SG-O 3.4Å; C133-I162 HydrophobicContact CB-CB 4.42Å; C133-I162 HydrophobicContact CB-CD1 4.08Å; C133-I162 HydrophobicContact CB-CG1 3.7Å; C133-S267 PolarHBondContact N-O 3.27Å; C133-M268 WeakPolarHBondContact O-CA 3.49Å; C133-D269 PolarHBondContact O-N 2.9Å
134	P	98.8	Very high	96.7	Very high	11 Å²	11	31.5 Å²	31.5	7%	0.071	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	152.9	162	26	-34.1	0	0	0	111	F161 I162 R272 L402 L404	P134-F161 HydrophobicContact CB-CD1 3.76Å; P134-F161 HydrophobicContact CB-CE1 3.82Å; P134-F161 HydrophobicContact CG-CD1 3.39Å; P134-F161 HydrophobicContact CG-CD2 4.43Å; P134-F161 HydrophobicContact CG-CE1 3.5Å; P134-F161 HydrophobicContact CG-CG 3.91Å; P134-F161 HydrophobicContact CG-CZ 4.13Å; P134-F161 WeakPolarHBondContact O-CA 3.33Å; P134-I162 PolarHBondContact O-N 3.47Å; P134-R272 WeakPolarHBondContact CA-O 3.01Å; P134-R272 HydrophobicContact CB-CB 3.88Å; P134-R272 WeakPolarHBondContact CB-O 3.41Å; P134-L402 HydrophobicContact CB-CD1 4.48Å; P134-L404 HydrophobicContact CB-CD2 4.11Å; P134-L404 HydrophobicContact CG-CD2 4.07Å
135	V	98.9	Very high	96.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.9	-173.5	176.7	0	0	0	0	111.2	I137 I162 L239 L242 M268 L270 R272 T273 A274	V135-I137 HydrophobicContact CG1-CD1 4.41Å; V135-I162 CarbonylContact C-O 3.52Å; V135-I162 WeakPolarHBondContact CA-O 3.38Å; V135-L239 HydrophobicContact CG1-CD1 4.29Å; V135-L242 HydrophobicContact CG1-CD1 3.53Å; V135-M268 HydrophobicContact CG2-CB 3.83Å; V135-M268 HydrophobicContact CG2-CG 4.02Å; V135-M268 HydrophobicContact CG2-SD 3.86Å; V135-L270 HydrophobicContact CG2-CD2 4.14Å; V135-R272 PolarHBondContact N-O 2.91Å; V135-T273 HydrophobicContact CB-CG2 4.27Å; V135-T273 HydrophobicContact CG1-CG2 4.26Å; V135-T273 CarbonylContact O-C 3.56Å; V135-T273 VanDerWaalsContact O-CA 3.31Å; V135-T273 WeakPolarHBondContact O-CA 3.33Å; V135-A274 PolarHBondContact O-N 2.68Å
136	V	98.9	Very high	97	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.7	172.1	174.8	0	0	0	0	109.7	L156 F161 I162 V163 A164 A274 I276 L398	V136-L156 HydrophobicContact CG1-CD1 4.31Å; V136-F161 HydrophobicContact CG2-CD1 3.74Å; V136-F161 HydrophobicContact CG2-CE1 4.31Å; V136-F161 HydrophobicContact CG2-CG 4.49Å; V136-I162 PolarHBondContact N-O 2.99Å; V136-V163 HydrophobicContact CB-CG1 4.22Å; V136-V163 HydrophobicContact CB-CG2 4.26Å; V136-V163 HydrophobicContact CG1-CG1 4.13Å; V136-V163 CarbonylContact O-C 3.58Å; V136-V163 VanDerWaalsContact O-CA 3.3Å; V136-V163 WeakPolarHBondContact O-CA 3.39Å; V136-A164 PolarHBondContact O-N 3.21Å; V136-A274 WeakPolarHBondContact CA-O 3.34Å; V136-A274 HydrophobicContact CG2-CB 4.48Å; V136-I276 HydrophobicContact CG1-CB 4.17Å; V136-I276 HydrophobicContact CG1-CD1 3.76Å; V136-I276 HydrophobicContact CG1-CG1 3.79Å; V136-I276 HydrophobicContact CG2-CD1 4.5Å; V136-L398 HydrophobicContact CG2-CD1 4.44Å
137	I	98.9	Very high	97.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.6	164.2	-56.3	-56.8	0	0	0	108.1	V135 A164 V166 C235 A238 L239 L242 A274 V275 I276 F295	V135-I137 HydrophobicContact CG1-CD1 4.41Å; I137-A164 HydrophobicContact CD1-CB 3.89Å; I137-V166 HydrophobicContact CG2-CG2 3.71Å; I137-C235 HydrophobicContact CG2-CB 3.81Å; I137-A238 HydrophobicContact CD1-CB 4.22Å; I137-L239 HydrophobicContact CD1-CB 4.3Å; I137-L239 HydrophobicContact CG1-CB 4.24Å; I137-L242 HydrophobicContact CD1-CD1 3.76Å; I137-A274 PolarHBondContact N-O 2.95Å; I137-V275 HydrophobicContact CB-CG2 4.46Å; I137-V275 CarbonylContact O-C 3.47Å; I137-V275 WeakPolarHBondContact O-CA 3.4Å; I137-I276 PolarHBondContact O-N 3.42Å; I137-F295 HydrophobicContact CB-CE1 4.04Å; I137-F295 HydrophobicContact CB-CZ 4.32Å; I137-F295 HydrophobicContact CG1-CE1 3.64Å; I137-F295 HydrophobicContact CG1-CZ 3.96Å
138	F	98.9	Very high	97.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.6	179.2	-170.6	-80.1	0	0	0	111.3	Y149 I152 V163 A164 V166 I276 L301	F138-Y149 HydrophobicContact CD1-CG 4.42Å; F138-Y149 AromaticContact CE1-CD1 3.81Å; F138-Y149 HydrophobicContact CE1-CD1 3.81Å; F138-Y149 AromaticContact CE1-CD2 3.57Å; F138-Y149 HydrophobicContact CE1-CD2 3.57Å; F138-Y149 HydrophobicContact CE1-CE1 4.42Å; F138-Y149 HydrophobicContact CE1-CE2 4.25Å; F138-Y149 AromaticContact CE1-CG 3.32Å; F138-Y149 HydrophobicContact CE1-CG 3.32Å; F138-Y149 AromaticContact CZ-CD1 3.51Å; F138-Y149 HydrophobicContact CZ-CD1 3.51Å; F138-Y149 HydrophobicContact CZ-CD2 4.17Å; F138-Y149 HydrophobicContact CZ-CE1 4.21Å; F138-Y149 AromaticContact CZ-CG 3.48Å; F138-Y149 HydrophobicContact CZ-CG 3.48Å; F138-Y149 VanDerWaalsContact CZ-CG 3.48Å; F138-I152 HydrophobicContact CE2-CD1 4.29Å; F138-I152 HydrophobicContact CE2-CG2 4.1Å; F138-I152 HydrophobicContact CZ-CD1 4.41Å; F138-V163 HydrophobicContact CB-CG1 4.16Å; F138-A164 PolarHBondContact N-O 3.35Å; F138-V166 PolarHBondContact O-N 3.28Å; F138-I276 CarbonylContact C-O 3.54Å; F138-I276 VanDerWaalsContact CA-O 3.25Å; F138-I276 WeakPolarHBondContact CA-O 3.12Å; F138-I276 HydrophobicContact CD2-CB 3.98Å; F138-I276 HydrophobicContact CD2-CG2 3.81Å; F138-I276 HydrophobicContact CE2-CB 4.45Å; F138-I276 HydrophobicContact CE2-CG2 3.78Å; F138-L301 HydrophobicContact CE2-CD1 4.3Å
139	S	98.9	Very high	97.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.6	178.8	179.6	0	0	0	0	111.7	H168 R231 I276 G277 H278 G281	S139-H168 WeakPolarHBondContact CB-NE2 3.14Å; S139-H168 PolarHBondContact OG-NE2 3.12Å; S139-R231 PolarHBondContact OG-NH1 2.84Å; S139-I276 PolarHBondContact N-O 3.21Å; S139-G277 WeakPolarHBondContact O-CA 3.37Å; S139-H278 PolarHBondContact O-N 3.05Å; S139-H278 VanDerWaalsContact O-N 3.13Å; S139-G281 WeakPolarHBondContact O-CA 3.44Å; S139-G281 VanDerWaalsContact OG-CA 3.27Å; S139-G281 WeakPolarHBondContact OG-CA 3.28Å
140	H	98.9	Very high	97.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-74.5	165.3	-179.2	66.7	76.7	0	0	0	113.2	A144 Y149 V166 H168 R231 G281	H140-A144 HydrophobicContact CB-CB 3.99Å; H140-A144 PolarHBondContact CE1-O 2.97Å; H140-A144 PolarHBondContact ND1-O 3.43Å; H140-Y149 HydrophobicContact CB-CD2 4.11Å; H140-Y149 HydrophobicContact CB-CE2 3.59Å; H140-V166 PolarHBondContact CD2-O 3.14Å; H140-H168 AromaticContact CD2-CD2 3.63Å; H140-H168 AromaticContact CE1-CD2 3.87Å; H140-H168 AromaticContact NE2-CD2 3.47Å; H140-H168 PolarHBondContact NE2-CD2 3.24Å; H140-H168 AromaticContact NE2-CG 3.9Å; H140-H168 PolarHBondContact NE2-N 3.01Å; H140-H168 VanDerWaalsContact NE2-N 3.14Å; H140-R231 PolarHBondContact ND1-NH2 3.05Å; H140-R231 PolarHBondContact O-NH1 3.03Å; H140-R231 VanDerWaalsContact O-NH1 3.13Å; H140-R231 PolarHBondContact O-NH2 3.23Å; H140-G281 WeakPolarHBondContact O-CA 3.38Å; H140-G281 PolarHBondContact O-N 3.16Å
141	G	98.4	Very high	98.1	Very high	2 Å²	2	12.4 Å²	12.4	2%	0.021	6%	0.062	C	C	.	.	P	Polyproline II helix	trans	-77.8	174	171.5	0	0	0	0	0	114.7	A144 Y149 H278	G141-A144 WeakPolarHBondContact O-CB 3.47Å; G141-A144 PolarHBondContact O-N 2.85Å; G141-A144 VanDerWaalsContact O-N 3.16Å; G141-Y149 PolarHBondContact N-OH 2.87Å; G141-H278 WeakPolarHBondContact CA-O 3.33Å; G141-H278 PolarHBondContact N-O 3.05Å
142	L	98	Very high	98.3	Very high	36 Å²	36	8.6 Å²	8.6	19%	0.188	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	135	173.2	-174.3	69.6	0	0	0	110.6	F98 A144 Y211 F280 W304	F98-L142 HydrophobicContact CE2-CD2 4.28Å; F98-L142 HydrophobicContact CE2-CG 4.03Å; L142-A144 PolarHBondContact O-N 2.91Å; L142-Y211 HydrophobicContact CD1-CD2 4.33Å; L142-Y211 HydrophobicContact CD1-CE2 3.76Å; L142-Y211 HydrophobicContact CD2-CE2 4.49Å; L142-Y211 HydrophobicContact CG-CE2 4.19Å; L142-F280 HydrophobicContact CB-CB 4.23Å; L142-F280 HydrophobicContact CB-CD1 4.09Å; L142-F280 HydrophobicContact CD1-CD1 3.89Å; L142-F280 HydrophobicContact CD1-CE1 4.19Å; L142-W304 HydrophobicContact CD2-CH2 4.39Å; L142-W304 HydrophobicContact CD2-CZ3 4.12Å
143	G	96.2	Very high	98.4	Very high	5 Å²	5	3.7 Å²	3.7	5%	0.052	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	2.1	-176.4	0	0	0	0	0	114.2	S172 S174	G143-S172 PolarHBondContact N-O 2.79Å; G143-S174 WeakPolarHBondContact O-CB 3.41Å; G143-S174 PolarHBondContact O-OG 3Å
144	A	97.8	Very high	98.4	Very high	7 Å²	7	3.7 Å²	3.7	6%	0.058	2%	0.023	C	C	.	.			trans	-96.1	-173.8	172.4	0	0	0	0	0	111.2	H140 G141 L142 L148 Y149 A173 S174	H140-A144 HydrophobicContact CB-CB 3.99Å; H140-A144 PolarHBondContact CE1-O 2.97Å; H140-A144 PolarHBondContact ND1-O 3.43Å; G141-A144 WeakPolarHBondContact O-CB 3.47Å; G141-A144 PolarHBondContact O-N 2.85Å; G141-A144 VanDerWaalsContact O-N 3.16Å; L142-A144 PolarHBondContact O-N 2.91Å; A144-L148 HydrophobicContact CB-CD1 3.82Å; A144-Y149 HydrophobicContact CB-CE2 3.82Å; A144-A173 WeakPolarHBondContact O-CA 3.41Å; A144-A173 WeakPolarHBondContact O-CB 3.43Å; A144-S174 PolarHBondContact O-N 3.36Å
145	F	98.6	Very high	98.4	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.023	C	C	.	.			trans	-159.2	177.7	175.9	42.8	-93.7	0	0	0	108.9	V86 Y91 L95 T147 L148 E167	V86-F145 HydrophobicContact CG1-CE2 4.31Å; V86-F145 HydrophobicContact CG1-CZ 4.25Å; V86-F145 HydrophobicContact CG2-CE2 4.11Å; V86-F145 HydrophobicContact CG2-CZ 4.12Å; Y91-F145 HydrophobicContact CD1-CB 4.17Å; Y91-F145 AromaticContact CD1-CD1 3.7Å; Y91-F145 HydrophobicContact CD1-CD1 3.7Å; Y91-F145 AromaticContact CD1-CD2 3.62Å; Y91-F145 HydrophobicContact CD1-CD2 3.62Å; Y91-F145 AromaticContact CD1-CE1 3.92Å; Y91-F145 HydrophobicContact CD1-CE1 3.92Å; Y91-F145 AromaticContact CD1-CE2 3.84Å; Y91-F145 HydrophobicContact CD1-CE2 3.84Å; Y91-F145 AromaticContact CD1-CG 3.55Å; Y91-F145 HydrophobicContact CD1-CG 3.55Å; Y91-F145 AromaticContact CD1-CZ 4Å; Y91-F145 HydrophobicContact CD1-CZ 4Å; Y91-F145 HydrophobicContact CE1-CB 4.09Å; Y91-F145 HydrophobicContact CE1-CD1 4.45Å; Y91-F145 AromaticContact CE1-CD2 3.99Å; Y91-F145 HydrophobicContact CE1-CD2 3.99Å; Y91-F145 AromaticContact CE1-CG 3.93Å; Y91-F145 HydrophobicContact CE1-CG 3.93Å; Y91-F145 HydrophobicContact CG-CD1 4.49Å; Y91-F145 HydrophobicContact CG-CD2 4.16Å; Y91-F145 HydrophobicContact CG-CE1 4.28Å; Y91-F145 AromaticContact CG-CE2 3.93Å; Y91-F145 HydrophobicContact CG-CE2 3.93Å; Y91-F145 HydrophobicContact CG-CG 4.44Å; Y91-F145 HydrophobicContact CG-CZ 4.01Å; L95-F145 HydrophobicContact CD1-CE1 3.95Å; L95-F145 HydrophobicContact CD1-CZ 4Å; L95-F145 HydrophobicContact CD2-CE1 4.08Å; L95-F145 HydrophobicContact CG-CE1 3.88Å; L95-F145 HydrophobicContact CG-CZ 4.44Å; F145-T147 WeakPolarHBondContact CD2-OG1 3.33Å; F145-T147 WeakPolarHBondContact CE2-OG1 3.28Å; F145-T147 PolarHBondContact O-N 3.05Å; F145-L148 HydrophobicContact CD1-CD1 3.87Å; F145-L148 HydrophobicContact CD1-CG 4.43Å; F145-L148 HydrophobicContact CD2-CD1 4.21Å; F145-L148 HydrophobicContact CD2-CD2 4.43Å; F145-L148 HydrophobicContact CD2-CG 3.88Å; F145-L148 HydrophobicContact CE1-CD1 3.62Å; F145-L148 HydrophobicContact CE1-CD2 4.47Å; F145-L148 HydrophobicContact CE1-CG 4.19Å; F145-L148 HydrophobicContact CE2-CD1 3.99Å; F145-L148 HydrophobicContact CE2-CD2 3.67Å; F145-L148 HydrophobicContact CE2-CG 3.6Å; F145-L148 HydrophobicContact CG-CD1 4.15Å; F145-L148 HydrophobicContact CG-CG 4.28Å; F145-L148 HydrophobicContact CZ-CD1 3.67Å; F145-L148 HydrophobicContact CZ-CD2 3.68Å; F145-L148 HydrophobicContact CZ-CG 3.76Å; F145-L148 PolarHBondContact O-N 3.42Å; F145-E167 HydrophobicContact CB-CG 4.4Å
146	R	98.5	Very high	98.4	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.008	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.6	-163.4	70.5	-170.7	-173.4	-79	1.6	116.3	D56 F67 R69 Y91 S165 E167	D56-R146 IonicContact OD1-CZ 2.68Å; D56-R146 IonicContact OD1-NE 2.7Å; D56-R146 PolarHBondContact OD1-NE 2.65Å; D56-R146 IonicContact OD1-NH2 3.14Å; D56-R146 IonicContact OD2-CZ 2.99Å; D56-R146 IonicContact OD2-NE 3.75Å; D56-R146 IonicContact OD2-NH2 3.87Å; D56-R146 PolarHBondContact OD2-NH2 3.22Å; F67-R146 VanDerWaalsContact CE1-NH1 3.3Å; F67-R146 VanDerWaalsContact CZ-NH2 3.35Å; R69-R146 HydrophobicContact CB-CB 4.41Å; R69-R146 HydrophobicContact CB-CG 4.08Å; Y91-R146 PolarHBondContact OH-NH1 2.93Å; R146-S165 VanDerWaalsContact CB-O 3.31Å; R146-S165 WeakPolarHBondContact CB-O 3.43Å; R146-S165 WeakPolarHBondContact O-CB 3.13Å; R146-S165 PolarHBondContact O-OG 2.91Å; R146-E167 HydrophobicContact CB-CB 3.99Å; R146-E167 HydrophobicContact CG-CB 4.36Å; R146-E167 VanDerWaalsContact CG-OE2 3.29Å; R146-E167 WeakPolarHBondContact CG-OE2 3.3Å; R146-E167 IonicContact CZ-OE2 3.83Å; R146-E167 PolarHBondContact N-OE2 3.25Å; R146-E167 VanDerWaalsContact NH1-CD 3.27Å; R146-E167 IonicContact NH1-OE1 3.21Å; R146-E167 PolarHBondContact NH1-OE1 3.05Å; R146-E167 IonicContact NH1-OE2 2.73Å; R146-E167 PolarHBondContact NH1-OE2 3.39Å
147	T	97.8	Very high	98.3	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-2.7	-172.6	70.5	0	0	0	0	114.6	R69 W85 F145 Y149	R69-T147 VanDerWaalsContact CZ-CG2 3.45Å; W85-T147 PolarHBondContact NE1-O 2.83Å; W85-T147 WeakPolarHBondContact O-CB 3.44Å; W85-T147 PolarHBondContact O-OG1 2.75Å; F145-T147 WeakPolarHBondContact CD2-OG1 3.33Å; F145-T147 WeakPolarHBondContact CE2-OG1 3.28Å; F145-T147 PolarHBondContact O-N 3.05Å; T147-Y149 PolarHBondContact O-N 2.87Å
148	L	97.2	Very high	98.3	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.01	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	9.3	-172.3	-61.2	-179.4	0	0	0	115.5	W85 V86 A144 F145 P361 D362 F363	W85-L148 HydrophobicContact CH2-CD2 3.89Å; W85-L148 HydrophobicContact CZ2-CD2 3.26Å; V86-L148 HydrophobicContact CG2-CD2 4.22Å; A144-L148 HydrophobicContact CB-CD1 3.82Å; F145-L148 HydrophobicContact CD1-CD1 3.87Å; F145-L148 HydrophobicContact CD1-CG 4.43Å; F145-L148 HydrophobicContact CD2-CD1 4.21Å; F145-L148 HydrophobicContact CD2-CD2 4.43Å; F145-L148 HydrophobicContact CD2-CG 3.88Å; F145-L148 HydrophobicContact CE1-CD1 3.62Å; F145-L148 HydrophobicContact CE1-CD2 4.47Å; F145-L148 HydrophobicContact CE1-CG 4.19Å; F145-L148 HydrophobicContact CE2-CD1 3.99Å; F145-L148 HydrophobicContact CE2-CD2 3.67Å; F145-L148 HydrophobicContact CE2-CG 3.6Å; F145-L148 HydrophobicContact CG-CD1 4.15Å; F145-L148 HydrophobicContact CG-CG 4.28Å; F145-L148 HydrophobicContact CZ-CD1 3.67Å; F145-L148 HydrophobicContact CZ-CD2 3.68Å; F145-L148 HydrophobicContact CZ-CG 3.76Å; F145-L148 PolarHBondContact O-N 3.42Å; L148-P361 WeakPolarHBondContact O-CA 3.43Å; L148-D362 PolarHBondContact O-N 3.29Å; L148-F363 HydrophobicContact CD1-CE2 3.9Å; L148-F363 HydrophobicContact CD2-CE2 4.06Å; L148-F363 HydrophobicContact CD2-CZ 4.42Å
149	Y	98.5	Very high	98.3	Very high	5 Å²	5	4.8 Å²	4.8	2%	0.02	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.8	31.1	-179.7	-60.2	-92	0	0	0	111.5	F138 H140 G141 A144 T147 A151 I152 C153 H278 P361 D362	F138-Y149 HydrophobicContact CD1-CG 4.42Å; F138-Y149 AromaticContact CE1-CD1 3.81Å; F138-Y149 HydrophobicContact CE1-CD1 3.81Å; F138-Y149 AromaticContact CE1-CD2 3.57Å; F138-Y149 HydrophobicContact CE1-CD2 3.57Å; F138-Y149 HydrophobicContact CE1-CE1 4.42Å; F138-Y149 HydrophobicContact CE1-CE2 4.25Å; F138-Y149 AromaticContact CE1-CG 3.32Å; F138-Y149 HydrophobicContact CE1-CG 3.32Å; F138-Y149 AromaticContact CZ-CD1 3.51Å; F138-Y149 HydrophobicContact CZ-CD1 3.51Å; F138-Y149 HydrophobicContact CZ-CD2 4.17Å; F138-Y149 HydrophobicContact CZ-CE1 4.21Å; F138-Y149 AromaticContact CZ-CG 3.48Å; F138-Y149 HydrophobicContact CZ-CG 3.48Å; F138-Y149 VanDerWaalsContact CZ-CG 3.48Å; H140-Y149 HydrophobicContact CB-CD2 4.11Å; H140-Y149 HydrophobicContact CB-CE2 3.59Å; G141-Y149 PolarHBondContact N-OH 2.87Å; A144-Y149 HydrophobicContact CB-CE2 3.82Å; T147-Y149 PolarHBondContact O-N 2.87Å; Y149-A151 VanDerWaalsContact C-N 3.28Å; Y149-A151 PolarHBondContact O-N 3.04Å; Y149-I152 HydrophobicContact CD1-CD1 4.33Å; Y149-I152 PolarHBondContact O-N 3.42Å; Y149-C153 PolarHBondContact O-N 3.45Å; Y149-C153 PolarHBondContact O-SG 3.07Å; Y149-H278 HydrophobicContact CD1-CB 4.25Å; Y149-H278 HydrophobicContact CE1-CB 3.43Å; Y149-H278 VanDerWaalsContact CE1-CB 3.43Å; Y149-H278 AromaticContact CE1-CG 3.59Å; Y149-H278 AromaticContact CE1-ND1 3.41Å; Y149-H278 WeakPolarHBondContact CE1-ND1 3.23Å; Y149-H278 AromaticContact CZ-ND1 3.54Å; Y149-H278 PolarHBondContact OH-ND1 3.37Å; Y149-P361 HydrophobicContact CD1-CB 4.28Å; Y149-P361 HydrophobicContact CE1-CB 3.81Å; Y149-D362 PolarHBondContact N-OD2 2.81Å
150	S	98.1	Very high	98.3	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-64.1	-31.1	-177.4	64.7	0	0	0	0	112.3	I43 I152 C153 V154 D362	I43-S150 VanDerWaalsContact CD1-OG 3.26Å; I43-S150 WeakPolarHBondContact CD1-OG 3.4Å; S150-I152 PolarHBondContact O-N 2.81Å; S150-C153 PolarHBondContact O-N 2.83Å; S150-V154 WeakPolarHBondContact O-CB 3.27Å; S150-V154 WeakPolarHBondContact O-CG2 3.26Å; S150-V154 PolarHBondContact O-N 2.82Å; S150-D362 WeakPolarHBondContact CB-OD2 3.39Å; S150-D362 VanDerWaalsContact N-CG 3.35Å; S150-D362 PolarHBondContact N-OD1 2.88Å; S150-D362 VanDerWaalsContact N-OD1 3.14Å; S150-D362 PolarHBondContact N-OD2 3.32Å; S150-D362 PolarHBondContact OG-OD2 2.89Å
151	A	98.1	Very high	98.3	Very high	6 Å²	6	5 Å²	5	5%	0.05	3%	0.029	C	C	.	.	H	α-helix	trans	-57.7	-36.4	174.6	0	0	0	0	0	112.9	I43 P44 Y149 E155 D362 F365 I387	I43-A151 HydrophobicContact CG2-CB 3.94Å; P44-A151 HydrophobicContact CG-CB 4.48Å; Y149-A151 VanDerWaalsContact C-N 3.28Å; Y149-A151 PolarHBondContact O-N 3.04Å; A151-E155 WeakPolarHBondContact O-CB 3.45Å; A151-E155 PolarHBondContact O-N 3.47Å; A151-D362 WeakPolarHBondContact CB-OD1 3.47Å; A151-D362 PolarHBondContact N-OD1 3.39Å; A151-F365 HydrophobicContact CB-CD2 4.36Å; A151-F365 HydrophobicContact CB-CE2 3.6Å; A151-F365 HydrophobicContact CB-CZ 4.23Å; A151-I387 HydrophobicContact CB-CG1 4.34Å
152	I	98.8	Very high	98.3	Very high	1 Å²	1	4.9 Å²	4.9	1%	0.005	3%	0.028	C	C	.	.	H	α-helix	trans	-80.6	-49	178.2	-58.9	175	0	0	0	110.1	F138 Y149 S150 V154 E155 L156 L301 I387	F138-I152 HydrophobicContact CE2-CD1 4.29Å; F138-I152 HydrophobicContact CE2-CG2 4.1Å; F138-I152 HydrophobicContact CZ-CD1 4.41Å; Y149-I152 HydrophobicContact CD1-CD1 4.33Å; Y149-I152 PolarHBondContact O-N 3.42Å; S150-I152 PolarHBondContact O-N 2.81Å; I152-V154 PolarHBondContact O-N 3.01Å; I152-E155 PolarHBondContact O-N 3.33Å; I152-L156 HydrophobicContact CG2-CD1 4.12Å; I152-L156 WeakPolarHBondContact O-CG 3.3Å; I152-L156 PolarHBondContact O-N 3.4Å; I152-L301 HydrophobicContact CD1-CD1 3.58Å; I152-I387 HydrophobicContact CD1-CD1 4.06Å; I152-I387 HydrophobicContact CG1-CD1 3.69Å; I152-I387 HydrophobicContact CG1-CG1 4.34Å
153	C	98.8	Very high	98.3	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-66.8	-38.2	-173.9	-59.2	0	0	0	0	112.1	Y71 Y149 S150 A157 V163	Y71-C153 HydrophobicContact CD1-CB 4.22Å; Y71-C153 HydrophobicContact CD2-CB 3.31Å; Y71-C153 HydrophobicContact CE1-CB 4.3Å; Y71-C153 HydrophobicContact CE2-CB 3.4Å; Y71-C153 VanDerWaalsContact CE2-CB 3.4Å; Y71-C153 HydrophobicContact CG-CB 3.73Å; Y149-C153 PolarHBondContact O-N 3.45Å; Y149-C153 PolarHBondContact O-SG 3.07Å; S150-C153 PolarHBondContact O-N 2.83Å; C153-A157 WeakPolarHBondContact O-CB 3.4Å; C153-A157 PolarHBondContact O-N 2.65Å; C153-V163 HydrophobicContact CB-CG1 4.07Å
154	V	98.6	Very high	98.5	Very high	1 Å²	1	3 Å²	3	1%	0.006	2%	0.017	C	C	.	.	H	α-helix	trans	-70.1	-40	176.7	174.2	0	0	0	0	110.9	P46 V52 Y71 P120 A121 S150 I152 A157 S158	P46-V154 HydrophobicContact CB-CG1 3.85Å; P46-V154 HydrophobicContact CG-CG1 3.57Å; V52-V154 HydrophobicContact CB-CG1 4.02Å; V52-V154 HydrophobicContact CG1-CB 4.4Å; V52-V154 HydrophobicContact CG1-CG1 4.05Å; V52-V154 HydrophobicContact CG1-CG2 4.25Å; V52-V154 HydrophobicContact CG2-CG1 3.97Å; V52-V154 WeakPolarHBondContact CG2-O 3.43Å; Y71-V154 HydrophobicContact CD1-CG2 3.7Å; Y71-V154 HydrophobicContact CE1-CG2 3.8Å; P120-V154 HydrophobicContact CG-CG1 4.28Å; P120-V154 WeakPolarHBondContact O-CG1 3.31Å; A121-V154 HydrophobicContact CB-CG2 4.15Å; S150-V154 WeakPolarHBondContact O-CB 3.27Å; S150-V154 WeakPolarHBondContact O-CG2 3.26Å; S150-V154 PolarHBondContact O-N 2.82Å; I152-V154 PolarHBondContact O-N 3.01Å; V154-A157 PolarHBondContact O-N 2.96Å; V154-S158 WeakPolarHBondContact O-CB 3.37Å; V154-S158 PolarHBondContact O-N 3.5Å
155	E	98.8	Very high	98.5	Very high	12 Å²	12	2.6 Å²	2.6	6%	0.056	1%	0.014	C	C	.	.	H	α-helix	trans	-59.7	-51.4	173.8	178.1	58.2	-154.9	0	0	110.9	P46 K47 A151 I152 A157 S158 Q159 N391	P46-E155 WeakPolarHBondContact CA-OE2 3.42Å; K47-E155 PolarHBondContact N-OE2 2.96Å; A151-E155 WeakPolarHBondContact O-CB 3.45Å; A151-E155 PolarHBondContact O-N 3.47Å; I152-E155 PolarHBondContact O-N 3.33Å; E155-A157 VanDerWaalsContact C-N 3.34Å; E155-A157 PolarHBondContact O-N 2.56Å; E155-S158 PolarHBondContact O-N 3.23Å; E155-S158 PolarHBondContact O-OG 2.79Å; E155-Q159 VanDerWaalsContact O-CG 3.27Å; E155-Q159 WeakPolarHBondContact O-CG 3.28Å; E155-Q159 PolarHBondContact O-N 2.82Å; E155-Q159 PolarHBondContact OE1-NE2 3.1Å; E155-N391 WeakPolarHBondContact CB-ND2 3.32Å; E155-N391 HydrophobicContact CG-CB 3.89Å; E155-N391 WeakPolarHBondContact CG-ND2 3.37Å
156	L	98.9	Very high	98.5	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-58.1	-45.2	177.2	-69.6	174.2	0	0	0	111.8	V136 I152 S158 Q159 G160 F161 V163 I276 T394 L395 L398	V136-L156 HydrophobicContact CG1-CD1 4.31Å; I152-L156 HydrophobicContact CG2-CD1 4.12Å; I152-L156 WeakPolarHBondContact O-CG 3.3Å; I152-L156 PolarHBondContact O-N 3.4Å; L156-S158 VanDerWaalsContact C-N 3.33Å; L156-S158 PolarHBondContact O-N 3.07Å; L156-Q159 WeakPolarHBondContact O-CB 3.19Å; L156-Q159 PolarHBondContact O-N 2.91Å; L156-Q159 VanDerWaalsContact O-N 3.09Å; L156-G160 PolarHBondContact O-N 3.44Å; L156-F161 HydrophobicContact CB-CB 4.37Å; L156-F161 WeakPolarHBondContact O-CB 3.37Å; L156-F161 VanDerWaalsContact O-CD2 3.24Å; L156-F161 WeakPolarHBondContact O-CD2 3.19Å; L156-F161 PolarHBondContact O-N 3.25Å; L156-V163 HydrophobicContact CB-CG2 3.69Å; L156-V163 HydrophobicContact CD1-CG2 4.34Å; L156-I276 HydrophobicContact CD1-CD1 3.89Å; L156-T394 HydrophobicContact CD2-CG2 4.28Å; L156-L395 HydrophobicContact CD2-CD2 3.77Å; L156-L395 HydrophobicContact CD2-CG 4.28Å; L156-L398 HydrophobicContact CD2-CD1 3.95Å
157	A	98.7	Very high	98.5	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-62.4	-39.5	178.2	0	0	0	0	0	112.7	V52 P73 C153 V154 E155 Q159 G160 F161	V52-A157 HydrophobicContact CB-CB 4.48Å; V52-A157 HydrophobicContact CG1-CB 3.64Å; V52-A157 HydrophobicContact CG2-CB 4.04Å; P73-A157 WeakPolarHBondContact CG-O 3.4Å; C153-A157 WeakPolarHBondContact O-CB 3.4Å; C153-A157 PolarHBondContact O-N 2.65Å; V154-A157 PolarHBondContact O-N 2.96Å; E155-A157 VanDerWaalsContact C-N 3.34Å; E155-A157 PolarHBondContact O-N 2.56Å; A157-Q159 PolarHBondContact O-N 2.89Å; A157-G160 PolarHBondContact O-N 3.49Å; A157-F161 WeakPolarHBondContact CA-O 3.39Å
158	S	98.4	Very high	98.6	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-63	-24.1	176.4	76.9	0	0	0	0	113.1	P46 G48 P49 N50 V154 E155 L156 G160	P46-S158 VanDerWaalsContact CB-OG 3.32Å; P46-S158 WeakPolarHBondContact CB-OG 3.48Å; G48-S158 CarbonylContact C-O 3.5Å; G48-S158 VanDerWaalsContact CA-OG 3.23Å; G48-S158 WeakPolarHBondContact CA-OG 3.46Å; G48-S158 PolarHBondContact N-OG 3.48Å; P49-S158 VanDerWaalsContact CD-O 3.3Å; P49-S158 WeakPolarHBondContact CD-O 3.06Å; N50-S158 WeakPolarHBondContact CB-O 3.2Å; N50-S158 PolarHBondContact N-O 3.44Å; N50-S158 PolarHBondContact ND2-O 2.63Å; N50-S158 WeakPolarHBondContact O-CB 3.14Å; V154-S158 WeakPolarHBondContact O-CB 3.37Å; V154-S158 PolarHBondContact O-N 3.5Å; E155-S158 PolarHBondContact O-N 3.23Å; E155-S158 PolarHBondContact O-OG 2.79Å; L156-S158 VanDerWaalsContact C-N 3.33Å; L156-S158 PolarHBondContact O-N 3.07Å; S158-G160 VanDerWaalsContact C-N 3.3Å
159	Q	98.4	Very high	98.7	Very high	21 Å²	21	3 Å²	3	10%	0.098	2%	0.016	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	5.2	177.4	-61.5	-67.4	-0.5	0	0	113.2	G48 E155 L156 A157 F161 L395 F408	G48-Q159 VanDerWaalsContact CA-CD 3.49Å; G48-Q159 VanDerWaalsContact CA-NE2 3.3Å; E155-Q159 VanDerWaalsContact O-CG 3.27Å; E155-Q159 WeakPolarHBondContact O-CG 3.28Å; E155-Q159 PolarHBondContact O-N 2.82Å; E155-Q159 PolarHBondContact OE1-NE2 3.1Å; L156-Q159 WeakPolarHBondContact O-CB 3.19Å; L156-Q159 PolarHBondContact O-N 2.91Å; L156-Q159 VanDerWaalsContact O-N 3.09Å; A157-Q159 PolarHBondContact O-N 2.89Å; Q159-F161 HydrophobicContact CB-CD2 4.18Å; Q159-F161 HydrophobicContact CB-CE2 4.29Å; Q159-L395 HydrophobicContact CB-CD2 3.88Å; Q159-L395 HydrophobicContact CG-CD1 3.82Å; Q159-L395 HydrophobicContact CG-CD2 3.91Å; Q159-F408 HydrophobicContact CB-CE1 4.34Å; Q159-F408 HydrophobicContact CB-CZ 3.77Å; Q159-F408 HydrophobicContact CG-CE1 4.42Å; Q159-F408 HydrophobicContact CG-CZ 4.33Å
160	G	98.3	Very high	98.7	Very high	4 Å²	4	2.9 Å²	2.9	4%	0.041	2%	0.015	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.3	12.5	174.8	0	0	0	0	0	115.1	C133 L156 A157 S158	C133-G160 VanDerWaalsContact CB-O 3.29Å; C133-G160 WeakPolarHBondContact CB-O 3.31Å; C133-G160 PolarHBondContact SG-O 3.22Å; C133-G160 VanDerWaalsContact SG-O 3.4Å; L156-G160 PolarHBondContact O-N 3.44Å; A157-G160 PolarHBondContact O-N 3.49Å; S158-G160 VanDerWaalsContact C-N 3.3Å
161	F	98.8	Very high	98.7	Very high	1 Å²	1	6.8 Å²	6.8	0%	0.004	3%	0.034	C	C	.	.			trans	-91.1	151.6	176.5	-66.4	-102.6	0	0	0	111.9	P73 P134 V136 L156 A157 Q159 V163 L395 L398 L402 L404 F408	P73-F161 WeakPolarHBondContact CD-O 3.27Å; P134-F161 HydrophobicContact CB-CD1 3.76Å; P134-F161 HydrophobicContact CB-CE1 3.82Å; P134-F161 HydrophobicContact CG-CD1 3.39Å; P134-F161 HydrophobicContact CG-CD2 4.43Å; P134-F161 HydrophobicContact CG-CE1 3.5Å; P134-F161 HydrophobicContact CG-CG 3.91Å; P134-F161 HydrophobicContact CG-CZ 4.13Å; P134-F161 WeakPolarHBondContact O-CA 3.33Å; V136-F161 HydrophobicContact CG2-CD1 3.74Å; V136-F161 HydrophobicContact CG2-CE1 4.31Å; V136-F161 HydrophobicContact CG2-CG 4.49Å; L156-F161 HydrophobicContact CB-CB 4.37Å; L156-F161 WeakPolarHBondContact O-CB 3.37Å; L156-F161 VanDerWaalsContact O-CD2 3.24Å; L156-F161 WeakPolarHBondContact O-CD2 3.19Å; L156-F161 PolarHBondContact O-N 3.25Å; A157-F161 WeakPolarHBondContact CA-O 3.39Å; Q159-F161 HydrophobicContact CB-CD2 4.18Å; Q159-F161 HydrophobicContact CB-CE2 4.29Å; F161-V163 HydrophobicContact CB-CG2 4.14Å; F161-L395 HydrophobicContact CD2-CD2 4.44Å; F161-L395 HydrophobicContact CE2-CD2 3.67Å; F161-L395 HydrophobicContact CZ-CD2 4.32Å; F161-L398 HydrophobicContact CE1-CB 4.39Å; F161-L398 HydrophobicContact CE1-CD1 3.8Å; F161-L398 HydrophobicContact CZ-CB 4.17Å; F161-L398 HydrophobicContact CZ-CD1 3.82Å; F161-L402 HydrophobicContact CE1-CD1 4.35Å; F161-L404 HydrophobicContact CE1-CD1 3.85Å; F161-L404 HydrophobicContact CE2-CD1 4.25Å; F161-L404 HydrophobicContact CZ-CD1 3.33Å; F161-F408 AromaticContact CE2-CE2 3.94Å; F161-F408 HydrophobicContact CE2-CE2 3.94Å; F161-F408 HydrophobicContact CZ-CE2 4.39Å
162	I	98.9	Very high	98.7	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.6	159.2	-68.6	-176.6	0	0	0	108.2	L70 F127 C133 P134 V135 V136 L264 M268	L70-I162 HydrophobicContact CD1-CG2 3.57Å; L70-I162 HydrophobicContact CD2-CG2 4.49Å; L70-I162 HydrophobicContact CG-CG2 4.17Å; F127-I162 HydrophobicContact CD2-CD1 4.37Å; F127-I162 HydrophobicContact CE2-CD1 3.66Å; F127-I162 HydrophobicContact CE2-CG1 4.15Å; F127-I162 HydrophobicContact CZ-CD1 4.14Å; C133-I162 HydrophobicContact CB-CB 4.42Å; C133-I162 HydrophobicContact CB-CD1 4.08Å; C133-I162 HydrophobicContact CB-CG1 3.7Å; P134-I162 PolarHBondContact O-N 3.47Å; V135-I162 CarbonylContact C-O 3.52Å; V135-I162 WeakPolarHBondContact CA-O 3.38Å; V136-I162 PolarHBondContact N-O 2.99Å; I162-L264 HydrophobicContact CD1-CD2 3.91Å; I162-M268 HydrophobicContact CD1-CE 3.95Å; I162-M268 HydrophobicContact CD1-CG 3.9Å; I162-M268 HydrophobicContact CD1-SD 4.49Å; I162-M268 HydrophobicContact CG2-CE 4.29Å
163	V	98.9	Very high	98.7	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.9	-175.2	-170.1	0	0	0	0	110.1	L70 Y71 V136 F138 C153 L156 F161	L70-V163 CarbonylContact C-O 3.52Å; L70-V163 WeakPolarHBondContact CA-O 3.48Å; Y71-V163 PolarHBondContact N-O 3.46Å; Y71-V163 PolarHBondContact O-N 2.93Å; V136-V163 HydrophobicContact CB-CG1 4.22Å; V136-V163 HydrophobicContact CB-CG2 4.26Å; V136-V163 HydrophobicContact CG1-CG1 4.13Å; V136-V163 CarbonylContact O-C 3.58Å; V136-V163 VanDerWaalsContact O-CA 3.3Å; V136-V163 WeakPolarHBondContact O-CA 3.39Å; F138-V163 HydrophobicContact CB-CG1 4.16Å; C153-V163 HydrophobicContact CB-CG1 4.07Å; L156-V163 HydrophobicContact CB-CG2 3.69Å; L156-V163 HydrophobicContact CD1-CG2 4.34Å; F161-V163 HydrophobicContact CB-CG2 4.14Å
164	A	98.9	Very high	98.6	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	105.5	170.7	0	0	0	0	0	110.2	F68 L70 V136 I137 F138 V166 L242	F68-A164 HydrophobicContact CB-CB 4.26Å; F68-A164 HydrophobicContact CD2-CB 3.78Å; F68-A164 HydrophobicContact CE2-CB 4.22Å; F68-A164 HydrophobicContact CG-CB 3.99Å; L70-A164 HydrophobicContact CD1-CB 4.04Å; V136-A164 PolarHBondContact O-N 3.21Å; I137-A164 HydrophobicContact CD1-CB 3.89Å; F138-A164 PolarHBondContact N-O 3.35Å; A164-V166 PolarHBondContact O-N 2.65Å; A164-L242 HydrophobicContact CB-CD1 3.92Å
165	S	98.9	Very high	98.6	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	103.6	173.5	-176.7	0	0	0	0	109.7	F68 R69 R146	F68-S165 CarbonylContact C-O 3.6Å; F68-S165 WeakPolarHBondContact CA-O 3.3Å; F68-S165 WeakPolarHBondContact CB-O 3.49Å; R69-S165 PolarHBondContact N-O 3.17Å; R69-S165 PolarHBondContact O-N 2.83Å; R146-S165 VanDerWaalsContact CB-O 3.31Å; R146-S165 WeakPolarHBondContact CB-O 3.43Å; R146-S165 WeakPolarHBondContact O-CB 3.13Å; R146-S165 PolarHBondContact O-OG 2.91Å
166	V	98.9	Very high	98.6	Very high	2 Å²	2	6 Å²	6	1%	0.012	3%	0.03	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.7	-173.8	-179.8	0	0	0	0	110.5	F68 I137 F138 H140 A164 E234 A238	F68-V166 HydrophobicContact CB-CG2 4.42Å; I137-V166 HydrophobicContact CG2-CG2 3.71Å; F138-V166 PolarHBondContact O-N 3.28Å; H140-V166 PolarHBondContact CD2-O 3.14Å; A164-V166 PolarHBondContact O-N 2.65Å; V166-E234 HydrophobicContact CG1-CB 4.27Å; V166-A238 HydrophobicContact CG2-CB 3.64Å
167	E	98.9	Very high	98.5	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.031	C	C	.	.	P	Polyproline II helix	trans	-95.2	116.9	164.8	-163.3	157.3	102.2	0	0	110.1	F67 Y91 F145 R146 R169 T176	F67-E167 HydrophobicContact CB-CB 4.45Å; F67-E167 HydrophobicContact CD1-CB 3.82Å; F67-E167 HydrophobicContact CD1-CG 4.26Å; F67-E167 WeakPolarHBondContact CD1-OE1 3.31Å; F67-E167 HydrophobicContact CE1-CB 4.49Å; F67-E167 WeakPolarHBondContact CE1-OE1 3.23Å; F67-E167 HydrophobicContact CG-CB 4.22Å; F67-E167 PolarHBondContact O-N 2.88Å; Y91-E167 PolarHBondContact OH-OE1 3.15Å; F145-E167 HydrophobicContact CB-CG 4.4Å; R146-E167 HydrophobicContact CB-CB 3.99Å; R146-E167 HydrophobicContact CG-CB 4.36Å; R146-E167 VanDerWaalsContact CG-OE2 3.29Å; R146-E167 WeakPolarHBondContact CG-OE2 3.3Å; R146-E167 IonicContact CZ-OE2 3.83Å; R146-E167 PolarHBondContact N-OE2 3.25Å; R146-E167 VanDerWaalsContact NH1-CD 3.27Å; R146-E167 IonicContact NH1-OE1 3.21Å; R146-E167 PolarHBondContact NH1-OE1 3.05Å; R146-E167 IonicContact NH1-OE2 2.73Å; R146-E167 PolarHBondContact NH1-OE2 3.39Å; E167-R169 WeakPolarHBondContact O-CD 3.46Å; E167-R169 PolarHBondContact O-NE 3.39Å; E167-T176 WeakPolarHBondContact CG-OG1 3.44Å; E167-T176 VanDerWaalsContact OE1-CA 3.3Å; E167-T176 WeakPolarHBondContact OE1-CA 3.3Å; E167-T176 WeakPolarHBondContact OE1-CB 3.25Å; E167-T176 PolarHBondContact OE1-OG1 2.84Å
168	H	98.8	Very high	98.5	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.038	C	C	.	.	P	Polyproline II helix	trans	-83.6	137.4	-173.5	-66.3	-67.5	0	0	0	112.3	S139 H140 D170 R231 E234	S139-H168 WeakPolarHBondContact CB-NE2 3.14Å; S139-H168 PolarHBondContact OG-NE2 3.12Å; H140-H168 AromaticContact CD2-CD2 3.63Å; H140-H168 AromaticContact CE1-CD2 3.87Å; H140-H168 AromaticContact NE2-CD2 3.47Å; H140-H168 PolarHBondContact NE2-CD2 3.24Å; H140-H168 AromaticContact NE2-CG 3.9Å; H140-H168 PolarHBondContact NE2-N 3.01Å; H140-H168 VanDerWaalsContact NE2-N 3.14Å; H168-D170 WeakPolarHBondContact CB-OD1 3.41Å; H168-R231 HydrophobicContact CB-CG 4.16Å; H168-R231 VanDerWaalsContact CD2-CZ 3.45Å; H168-R231 PolarHBondContact CD2-NH2 3.4Å; H168-R231 VanDerWaalsContact CD2-NH2 3.26Å; H168-R231 PolarHBondContact CE1-O 3.4Å; H168-E234 VanDerWaalsContact CA-OE2 3.24Å; H168-E234 WeakPolarHBondContact CA-OE2 3.48Å; H168-E234 VanDerWaalsContact CB-OE2 3.3Å; H168-E234 WeakPolarHBondContact CB-OE2 3.35Å; H168-E234 IonicContact CE1-OE2 3.38Å; H168-E234 IonicContact CG-OE2 2.61Å; H168-E234 IonicContact ND1-OE2 2.69Å; H168-E234 PolarHBondContact ND1-OE2 3.09Å
169	R	98.5	Very high	98.3	Very high	9 Å²	9	8.4 Å²	8.4	3%	0.034	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	26	-178	-80.3	53.5	165.2	-76.7	-30.6	111.2	G65 E167 E171 T176 F177 M209 Q230 E234	G65-R169 PolarHBondContact O-NH1 3.44Å; E167-R169 WeakPolarHBondContact O-CD 3.46Å; E167-R169 PolarHBondContact O-NE 3.39Å; R169-E171 PolarHBondContact O-N 3.42Å; R169-T176 HydrophobicContact CG-CG2 4.01Å; R169-T176 PolarHBondContact NE-OG1 2.73Å; R169-T176 VanDerWaalsContact NE-OG1 3.1Å; R169-F177 PolarHBondContact NH2-O 2.88Å; R169-M209 HydrophobicContact CB-CE 4.44Å; R169-M209 HydrophobicContact CB-SD 4.36Å; R169-Q230 PolarHBondContact O-NE2 2.76Å; R169-E234 WeakPolarHBondContact CA-OE1 3.28Å; R169-E234 WeakPolarHBondContact CB-OE1 3.22Å; R169-E234 PolarHBondContact N-OE1 3.11Å; R169-E234 PolarHBondContact N-OE2 2.67Å
170	D	98.4	Very high	97.9	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.016	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.9	178.8	71.7	-30.3	0	0	0	112.1	H168 S172 Q227 Q230 R231	H168-D170 WeakPolarHBondContact CB-OD1 3.41Å; D170-S172 VanDerWaalsContact CG-CB 3.47Å; D170-S172 PolarHBondContact O-N 2.94Å; D170-S172 WeakPolarHBondContact OD1-CA 3.27Å; D170-S172 WeakPolarHBondContact OD1-CB 3.23Å; D170-S172 PolarHBondContact OD1-N 3.46Å; D170-S172 PolarHBondContact OD1-OG 2.88Å; D170-S172 WeakPolarHBondContact OD2-CB 3.25Å; D170-S172 PolarHBondContact OD2-OG 3.24Å; D170-Q227 HydrophobicContact CB-CB 4.19Å; D170-Q227 HydrophobicContact CB-CG 4.06Å; D170-Q227 WeakPolarHBondContact O-CG 3.29Å; D170-Q227 PolarHBondContact O-NE2 2.85Å; D170-Q227 WeakPolarHBondContact OD2-CB 3.39Å; D170-Q230 HydrophobicContact CB-CB 4.35Å; D170-Q230 HydrophobicContact CB-CG 4.17Å; D170-R231 HydrophobicContact CB-CG 4.25Å; D170-R231 WeakPolarHBondContact OD2-CD 3.44Å; D170-R231 WeakPolarHBondContact OD2-CG 3.38Å; D170-R231 IonicContact OD2-NE 3.43Å; D170-R231 PolarHBondContact OD2-NE 3.19Å; D170-R231 VanDerWaalsContact OD2-NE 3.14Å
171	E	98.1	Very high	97.4	Very high	83 Å²	83	17.4 Å²	17.4	39%	0.388	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	18	-170.3	-47.8	172.6	110.9	0	0	113.6	R169 M209 Y211 R212	R169-E171 PolarHBondContact O-N 3.42Å; E171-M209 HydrophobicContact CG-CG 4.29Å; E171-M209 HydrophobicContact CG-SD 3.99Å; E171-Y211 WeakPolarHBondContact O-CA 3.47Å; E171-Y211 WeakPolarHBondContact O-CD2 3.38Å; E171-R212 HydrophobicContact CB-CB 3.58Å; E171-R212 HydrophobicContact CG-CB 4.32Å; E171-R212 PolarHBondContact O-N 3.2Å; E171-R212 WeakPolarHBondContact OE2-CD 3.32Å
172	S	98.3	Very high	96.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-26.5	170.8	75.7	0	0	0	0	112.7	G143 D170 R231	G143-S172 PolarHBondContact N-O 2.79Å; D170-S172 VanDerWaalsContact CG-CB 3.47Å; D170-S172 PolarHBondContact O-N 2.94Å; D170-S172 WeakPolarHBondContact OD1-CA 3.27Å; D170-S172 WeakPolarHBondContact OD1-CB 3.23Å; D170-S172 PolarHBondContact OD1-N 3.46Å; D170-S172 PolarHBondContact OD1-OG 2.88Å; D170-S172 WeakPolarHBondContact OD2-CB 3.25Å; D170-S172 PolarHBondContact OD2-OG 3.24Å; S172-R231 PolarHBondContact OG-NE 3.33Å; S172-R231 PolarHBondContact OG-NH2 3.43Å
173	A	98.5	Very high	95.1	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	14%	0.137	C	C	.	.	S	Bend	trans	-67.2	146.2	176.8	0	0	0	0	0	111.2	A144 A175 Y211	A144-A173 WeakPolarHBondContact O-CA 3.41Å; A144-A173 WeakPolarHBondContact O-CB 3.43Å; A173-A175 VanDerWaalsContact C-N 3.26Å; A173-A175 PolarHBondContact O-N 3.02Å; A173-Y211 VanDerWaalsContact O-CA 3.22Å; A173-Y211 WeakPolarHBondContact O-CA 3.3Å; A173-Y211 WeakPolarHBondContact O-CB 3.04Å; A173-Y211 PolarHBondContact O-N 2.87Å
174	S	97.6	Very high	93	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-57.7	-45	175.5	-109.2	0	0	0	0	111.3	G94 L95 F98 G143 A144 Y211	G94-S174 VanDerWaalsContact C-CB 3.42Å; G94-S174 WeakPolarHBondContact CA-O 3.41Å; G94-S174 WeakPolarHBondContact O-CB 3.29Å; G94-S174 PolarHBondContact O-OG 2.95Å; L95-S174 WeakPolarHBondContact CA-OG 3.4Å; L95-S174 PolarHBondContact N-OG 3.08Å; F98-S174 WeakPolarHBondContact CB-OG 3.22Å; G143-S174 WeakPolarHBondContact O-CB 3.41Å; G143-S174 PolarHBondContact O-OG 3Å; A144-S174 PolarHBondContact O-N 3.36Å; S174-Y211 PolarHBondContact O-N 2.8Å; S174-Y211 VanDerWaalsContact O-N 3.09Å
175	A	98.1	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	155.8	163.7	0	0	0	0	0	108.7	E90 Y91 A173 W208 M209 Y210	E90-A175 WeakPolarHBondContact O-CB 3.5Å; Y91-A175 HydrophobicContact CD1-CB 4.16Å; Y91-A175 VanDerWaalsContact CE1-O 3.25Å; Y91-A175 WeakPolarHBondContact CE1-O 3.39Å; A173-A175 VanDerWaalsContact C-N 3.26Å; A173-A175 PolarHBondContact O-N 3.02Å; A175-W208 HydrophobicContact CB-CE3 4Å; A175-W208 HydrophobicContact CB-CZ3 4.1Å; A175-M209 CarbonylContact C-O 3.57Å; A175-M209 VanDerWaalsContact CA-O 3.28Å; A175-M209 WeakPolarHBondContact CA-O 3.44Å; A175-Y210 HydrophobicContact CB-CD1 3.88Å; A175-Y210 HydrophobicContact CB-CE1 3.96Å
176	T	98.6	Very high	88.1	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	171.1	166.7	-174.6	0	0	0	0	108.1	E167 R169 W208 M209	E167-T176 WeakPolarHBondContact CG-OG1 3.44Å; E167-T176 VanDerWaalsContact OE1-CA 3.3Å; E167-T176 WeakPolarHBondContact OE1-CA 3.3Å; E167-T176 WeakPolarHBondContact OE1-CB 3.25Å; E167-T176 PolarHBondContact OE1-OG1 2.84Å; R169-T176 HydrophobicContact CG-CG2 4.01Å; R169-T176 PolarHBondContact NE-OG1 2.73Å; R169-T176 VanDerWaalsContact NE-OG1 3.1Å; T176-W208 CarbonylContact O-C 3.5Å; T176-W208 WeakPolarHBondContact O-CA 3.35Å; T176-W208 VanDerWaalsContact O-CE3 3.27Å; T176-M209 HydrophobicContact CG2-CB 3.83Å; T176-M209 HydrophobicContact CG2-CG 4.25Å; T176-M209 HydrophobicContact CG2-SD 4.03Å; T176-M209 PolarHBondContact N-O 3.24Å; T176-M209 PolarHBondContact O-N 2.82Å; T176-M209 VanDerWaalsContact O-O 3.12Å
177	F	98.3	Very high	85.5	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	162.2	173.2	69.6	-89.8	0	0	0	112.2	M58 F67 Y91 R169 F179 R206 E207 W208 L255	M58-F177 HydrophobicContact CE-CD2 3.82Å; M58-F177 HydrophobicContact CE-CE2 3.49Å; M58-F177 VanDerWaalsContact CE-CE2 3.49Å; M58-F177 HydrophobicContact CE-CZ 4.02Å; M58-F177 WeakPolarHBondContact CE-O 3.46Å; M58-F177 HydrophobicContact SD-CE2 4.44Å; F67-F177 HydrophobicContact CE1-CD1 4.07Å; F67-F177 AromaticContact CE1-CE1 3.72Å; F67-F177 HydrophobicContact CE1-CE1 3.72Å; F67-F177 AromaticContact CE1-CZ 3.97Å; F67-F177 HydrophobicContact CE1-CZ 3.97Å; F67-F177 HydrophobicContact CZ-CD1 4.39Å; F67-F177 AromaticContact CZ-CE1 3.59Å; F67-F177 HydrophobicContact CZ-CE1 3.59Å; F67-F177 HydrophobicContact CZ-CE2 4.35Å; F67-F177 AromaticContact CZ-CZ 3.56Å; F67-F177 HydrophobicContact CZ-CZ 3.56Å; Y91-F177 WeakPolarHBondContact OH-CD1 3.41Å; Y91-F177 WeakPolarHBondContact OH-CE1 3.45Å; R169-F177 PolarHBondContact NH2-O 2.88Å; F177-F179 HydrophobicContact CD2-CE2 4.25Å; F177-F179 HydrophobicContact CD2-CZ 4.41Å; F177-F179 AromaticContact CE2-CE2 3.88Å; F177-F179 HydrophobicContact CE2-CE2 3.88Å; F177-F179 HydrophobicContact CE2-CZ 4Å; F177-R206 HydrophobicContact CB-CG 3.95Å; F177-R206 HydrophobicContact CD2-CG 3.66Å; F177-R206 HydrophobicContact CE2-CG 4.45Å; F177-R206 HydrophobicContact CG-CG 3.99Å; F177-E207 WeakPolarHBondContact CA-O 3.49Å; F177-E207 VanDerWaalsContact CB-O 3.28Å; F177-E207 WeakPolarHBondContact CB-O 3.46Å; F177-W208 HydrophobicContact CB-CD2 3.96Å; F177-W208 HydrophobicContact CB-CE3 3.97Å; F177-W208 HydrophobicContact CB-CG 4.41Å; F177-W208 HydrophobicContact CB-CZ3 4.32Å; F177-W208 HydrophobicContact CD1-CE3 4.37Å; F177-W208 AromaticContact CD1-CH2 3.72Å; F177-W208 HydrophobicContact CD1-CH2 3.72Å; F177-W208 HydrophobicContact CD1-CZ2 4.13Å; F177-W208 AromaticContact CD1-CZ3 3.87Å; F177-W208 HydrophobicContact CD1-CZ3 3.87Å; F177-W208 HydrophobicContact CE1-CH2 4.38Å; F177-L255 HydrophobicContact CE2-CD2 3.96Å; F177-L255 HydrophobicContact CZ-CD2 4.08Å
178	Y	97.2	Very high	82.5	Confident	39 Å²	39	59.9 Å²	59.9	15%	0.153	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	-176.2	168.4	64.2	-84.9	0	0	0	108.1	A63 R206 E207 M209	A63-Y178 HydrophobicContact CB-CD1 3.81Å; A63-Y178 HydrophobicContact CB-CD2 4.04Å; A63-Y178 HydrophobicContact CB-CE1 3.9Å; A63-Y178 HydrophobicContact CB-CE2 4.17Å; A63-Y178 HydrophobicContact CB-CG 3.89Å; Y178-R206 WeakPolarHBondContact O-CA 3.37Å; Y178-E207 HydrophobicContact CE1-CB 4.36Å; Y178-E207 HydrophobicContact CE1-CG 4.41Å; Y178-E207 HydrophobicContact CE2-CB 4.28Å; Y178-E207 VanDerWaalsContact CZ-OE2 3.29Å; Y178-E207 PolarHBondContact N-O 3.26Å; Y178-E207 VanDerWaalsContact N-O 3.08Å; Y178-E207 PolarHBondContact O-N 3.03Å; Y178-E207 PolarHBondContact OH-OE1 2.83Å; Y178-E207 PolarHBondContact OH-OE2 2.89Å; Y178-M209 HydrophobicContact CD1-CE 4.33Å; Y178-M209 HydrophobicContact CE1-CE 3.95Å
179	F	95.1	Very high	79.8	Confident	5 Å²	5	69.1 Å²	69.1	2%	0.022	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	153.2	175.3	-57.7	-93.8	0	0	0	111.6	M58 H61 F177 L204 L205 R206 V254 L255	M58-F179 HydrophobicContact SD-CD2 3.74Å; M58-F179 HydrophobicContact SD-CE2 3.74Å; H61-F179 HydrophobicContact CB-CB 4.15Å; H61-F179 PolarHBondContact CD2-O 3Å; H61-F179 WeakPolarHBondContact O-CA 3.26Å; H61-F179 PolarHBondContact O-N 2.84Å; F177-F179 HydrophobicContact CD2-CE2 4.25Å; F177-F179 HydrophobicContact CD2-CZ 4.41Å; F177-F179 AromaticContact CE2-CE2 3.88Å; F177-F179 HydrophobicContact CE2-CE2 3.88Å; F177-F179 HydrophobicContact CE2-CZ 4Å; F179-L204 HydrophobicContact CB-CB 4.06Å; F179-L204 HydrophobicContact CB-CD1 4.28Å; F179-L204 HydrophobicContact CB-CD2 4.35Å; F179-L204 HydrophobicContact CB-CG 4.47Å; F179-L204 HydrophobicContact CD1-CB 4.09Å; F179-L204 HydrophobicContact CG-CB 4.36Å; F179-L205 WeakPolarHBondContact CA-O 3.46Å; F179-R206 HydrophobicContact CD1-CB 4Å; F179-R206 HydrophobicContact CE1-CB 3.8Å; F179-R206 HydrophobicContact CE1-CG 4.28Å; F179-V254 HydrophobicContact CD2-CG1 3.69Å; F179-V254 HydrophobicContact CE2-CG1 3.83Å; F179-V254 HydrophobicContact CG-CG1 4.4Å; F179-L255 HydrophobicContact CE2-CD2 3.95Å; F179-L255 HydrophobicContact CZ-CD2 4.24Å
180	H	89.8	Confident	76.9	Confident	79 Å²	79	77.9 Å²	77.9	37%	0.366	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.2	167.3	64.1	169.7	0	0	0	110.4	L204 L205 E207	H180-L204 WeakPolarHBondContact O-CA 3.42Å; H180-L205 VanDerWaalsContact CD2-CB 3.4Å; H180-L205 WeakPolarHBondContact CD2-CB 3.44Å; H180-L205 PolarHBondContact CD2-O 3.31Å; H180-L205 VanDerWaalsContact CD2-O 3.22Å; H180-L205 PolarHBondContact N-O 3.14Å; H180-L205 VanDerWaalsContact NE2-CB 3.29Å; H180-L205 WeakPolarHBondContact NE2-CB 3.42Å; H180-L205 PolarHBondContact O-N 2.78Å; H180-E207 IonicContact ND1-OE2 2.84Å
181	E	87.5	Confident	74.2	Confident	135 Å²	135	83.2 Å²	83.2	63%	0.631	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	138.6	176.5	-65.6	178.1	179.3	0	0	110.8	T183 G203 L204	E181-T183 PolarHBondContact O-N 3.4Å; E181-G203 CarbonylContact C-O 3.55Å; E181-G203 WeakPolarHBondContact CA-O 3.44Å; E181-L204 HydrophobicContact CG-CD2 4.01Å
182	K	79.8	Confident	71.3	Confident	89 Å²	89	89.7 Å²	89.7	39%	0.387	47%	0.471	S	S	.	.			trans	-64.1	106.6	169.8	-74.3	-175.9	-174.5	-173.2	0	107.7	E184 D200 G203 L205	K182-E184 PolarHBondContact O-N 2.92Å; K182-D200 WeakPolarHBondContact CE-OD1 3.4Å; K182-D200 VanDerWaalsContact NZ-CG 3.3Å; K182-D200 IonicContact NZ-OD1 3.63Å; K182-D200 PolarHBondContact NZ-OD1 3.04Å; K182-D200 IonicContact NZ-OD2 3.51Å; K182-G203 WeakPolarHBondContact CB-O 3.31Å; K182-G203 WeakPolarHBondContact CG-O 3.1Å; K182-G203 PolarHBondContact N-O 2.96Å; K182-L205 HydrophobicContact CD-CG 4.26Å; K182-L205 HydrophobicContact CG-CD1 3.75Å; K182-L205 HydrophobicContact CG-CD2 4.47Å; K182-L205 HydrophobicContact CG-CG 3.64Å
183	T	69.6	Low	68.4	Low	131 Å²	131	96.1 Å²	96.1	80%	0.804	51%	0.513	S	S	*	.			trans	-63.8	122.7	165.1	-10.1	0	0	0	0	107.9	E181 P185	E181-T183 PolarHBondContact O-N 3.4Å; T183-P185 VanDerWaalsContact O-CD 3.31Å; T183-P185 WeakPolarHBondContact O-CD 3.19Å; T183-P185 VanDerWaalsContact O-N 3.17Å
184	E	55.9	Low	65.6	Low	182 Å²	182	104 Å²	104	85%	0.85	55%	0.551	S	S	*	*			trans	-56	123	169.4	-75.8	-157.2	164	0	0	108.4	K182 G186	K182-E184 PolarHBondContact O-N 2.92Å; E184-G186 PolarHBondContact O-N 3.43Å
185	P	50.4	Low	62.8	Low	118 Å²	118	108.9 Å²	108.9	77%	0.766	59%	0.585	S	S	*	*			trans	-66.2	113.8	177	-15.4	28.4	0	0	0	108.4	T183 L187	T183-P185 VanDerWaalsContact O-CD 3.31Å; T183-P185 WeakPolarHBondContact O-CD 3.19Å; T183-P185 VanDerWaalsContact O-N 3.17Å; P185-L187 PolarHBondContact O-N 2.89Å
186	G	43.5	Very low	60	Low	66 Å²	66	114.4 Å²	114.4	68%	0.68	62%	0.621	S	S	*	*			trans	-50.3	124.3	151.2	0	0	0	0	0	107.7	E184 T188	E184-G186 PolarHBondContact O-N 3.43Å; G186-T188 PolarHBondContact O-N 3.12Å
187	L	43.8	Very low	57.4	Low	176 Å²	176	117.8 Å²	117.8	92%	0.921	65%	0.645	S	S	*	*	S	Bend	trans	-34.9	97.1	-178.7	-71	154.5	0	0	0	113.9	P185	P185-L187 PolarHBondContact O-N 2.89Å
188	T	35.8	Very low	55	Low	133 Å²	133	122.7 Å²	122.7	82%	0.816	69%	0.686	S	S	*	*			trans	-145.6	109.5	147.3	44.1	0	0	0	0	108.6	G186	G186-T188 PolarHBondContact O-N 3.12Å
189	Q	42.6	Very low	52.7	Low	194 Å²	194	122 Å²	122	91%	0.907	69%	0.688	S	S	*	*			trans	-55.3	131.9	169.9	-70.4	173.7	-24.9	0	0	110.1
190	E	37.2	Very low	50.6	Low	192 Å²	192	125.9 Å²	125.9	90%	0.897	71%	0.709	S	S	*	*				-164.3	125.6	122	-105.8	175.8	-160.8	0	0	110.3
191	S	42.9	Very low	49.3	Very low	116 Å²	116	126 Å²	126	81%	0.811	71%	0.706	S	S	*	*			trans	-65.7	129.5	-170.8	46.7	0	0	0	0	114.1
192	R	36	Very low	48.3	Very low	219 Å²	219	126.5 Å²	126.5	83%	0.826	71%	0.713	S	S	*	*			trans	-126.8	132.4	148.3	-77.5	-174.6	-179.1	171.2	2	109.4	M194	R192-M194 PolarHBondContact O-N 2.91Å; R192-M194 VanDerWaalsContact O-N 3.13Å
193	P	37.8	Very low	48.3	Very low	135 Å²	135	124.1 Å²	124.1	88%	0.877	71%	0.713	S	S	*	*			trans	-76.6	101.5	173.1	29.3	-27.4	0	0	0	108.4
194	M	40.4	Very low	49.1	Very low	167 Å²	167	119.2 Å²	119.2	82%	0.823	68%	0.682	S	S	*	*			trans	-91.4	123.3	161.1	-78.4	-173.1	-177.7	0	0	108.2	R192	R192-M194 PolarHBondContact O-N 2.91Å; R192-M194 VanDerWaalsContact O-N 3.13Å
195	S	38.4	Very low	50.8	Low	102 Å²	102	113.5 Å²	113.5	71%	0.713	66%	0.657	S	S	*	*			trans	-52.8	131.3	163.6	48.4	0	0	0	0	109.1	S197	S195-S197 PolarHBondContact O-N 2.93Å
196	P	39.6	Very low	52.9	Low	117 Å²	117	111.3 Å²	111.3	76%	0.76	63%	0.633	S	S	*	*			trans	-65.8	102.6	175	26.9	-30.9	0	0	0	107.8
197	S	44.7	Very low	55.3	Low	73 Å²	73	111.9 Å²	111.9	51%	0.51	62%	0.619	S	S	.	*			trans	-74	153	165.5	86.3	0	0	0	0	107.7	S195 S199	S195-S197 PolarHBondContact O-N 2.93Å; S197-S199 PolarHBondContact O-N 3Å; S197-S199 PolarHBondContact OG-OG 2.97Å
198	A	46.4	Very low	57.9	Low	108 Å²	108	105.6 Å²	105.6	89%	0.893	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	11	-178.4	0	0	0	0	0	115.1
199	S	48.9	Very low	60.8	Low	26 Å²	26	101 Å²	101	18%	0.182	55%	0.552	C	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	-5.8	-177.9	70.8	0	0	0	0	115	S197 R201	S197-S199 PolarHBondContact O-N 3Å; S197-S199 PolarHBondContact OG-OG 2.97Å; S199-R201 VanDerWaalsContact C-N 3.33Å; S199-R201 PolarHBondContact O-N 3.12Å
200	D	52.2	Low	63.5	Low	86 Å²	86	94.8 Å²	94.8	46%	0.46	52%	0.521	S	S	.	.			trans	-79.3	81.1	176.2	-84.9	-32.4	0	0	0	110	K182	K182-D200 WeakPolarHBondContact CE-OD1 3.4Å; K182-D200 VanDerWaalsContact NZ-CG 3.3Å; K182-D200 IonicContact NZ-OD1 3.63Å; K182-D200 PolarHBondContact NZ-OD1 3.04Å; K182-D200 IonicContact NZ-OD2 3.51Å
201	R	61.4	Low	66.3	Low	82 Å²	82	87.8 Å²	87.8	31%	0.309	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-106.3	125.5	176.6	-65.6	-142	-94.8	-155.2	-4.8	110	S199 G203 L204 L255	S199-R201 VanDerWaalsContact C-N 3.33Å; S199-R201 PolarHBondContact O-N 3.12Å; R201-G203 PolarHBondContact O-N 3.21Å; R201-L204 WeakPolarHBondContact O-CA 3.34Å; R201-L204 WeakPolarHBondContact O-CB 3.32Å; R201-L204 PolarHBondContact O-N 3.12Å; R201-L255 PolarHBondContact NH2-O 3.11Å
202	D	66.1	Low	68.8	Low	144 Å²	144	84.4 Å²	84.4	77%	0.77	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.6	57.3	168.1	-65.4	-24.5	0	0	0	116	L204	D202-L204 PolarHBondContact O-N 2.84Å; D202-L204 VanDerWaalsContact O-N 3.13Å
203	G	80.6	Confident	71.4	Confident	39 Å²	39	76.3 Å²	76.3	40%	0.402	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	11.2	176.5	0	0	0	0	0	115	E181 K182 R201	E181-G203 CarbonylContact C-O 3.55Å; E181-G203 WeakPolarHBondContact CA-O 3.44Å; K182-G203 WeakPolarHBondContact CB-O 3.31Å; K182-G203 WeakPolarHBondContact CG-O 3.1Å; K182-G203 PolarHBondContact N-O 2.96Å; R201-G203 PolarHBondContact O-N 3.21Å
204	L	87.1	Confident	74	Confident	29 Å²	29	72.8 Å²	72.8	15%	0.152	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.8	175.3	-66.6	179.3	0	0	0	110.8	H61 F179 H180 E181 R201 D202 V254	H61-L204 HydrophobicContact CB-CD1 4.14Å; F179-L204 HydrophobicContact CB-CB 4.06Å; F179-L204 HydrophobicContact CB-CD1 4.28Å; F179-L204 HydrophobicContact CB-CD2 4.35Å; F179-L204 HydrophobicContact CB-CG 4.47Å; F179-L204 HydrophobicContact CD1-CB 4.09Å; F179-L204 HydrophobicContact CG-CB 4.36Å; H180-L204 WeakPolarHBondContact O-CA 3.42Å; E181-L204 HydrophobicContact CG-CD2 4.01Å; R201-L204 WeakPolarHBondContact O-CA 3.34Å; R201-L204 WeakPolarHBondContact O-CB 3.32Å; R201-L204 PolarHBondContact O-N 3.12Å; D202-L204 PolarHBondContact O-N 2.84Å; D202-L204 VanDerWaalsContact O-N 3.13Å; L204-V254 HydrophobicContact CD1-CG1 3.94Å
205	L	90.6	Very high	76.6	Confident	62 Å²	62	71.5 Å²	71.5	33%	0.325	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.3	173.4	-75.6	169.2	0	0	0	109.3	F179 H180 K182	F179-L205 WeakPolarHBondContact CA-O 3.46Å; H180-L205 VanDerWaalsContact CD2-CB 3.4Å; H180-L205 WeakPolarHBondContact CD2-CB 3.44Å; H180-L205 PolarHBondContact CD2-O 3.31Å; H180-L205 VanDerWaalsContact CD2-O 3.22Å; H180-L205 PolarHBondContact N-O 3.14Å; H180-L205 VanDerWaalsContact NE2-CB 3.29Å; H180-L205 WeakPolarHBondContact NE2-CB 3.42Å; H180-L205 PolarHBondContact O-N 2.78Å; K182-L205 HydrophobicContact CD-CG 4.26Å; K182-L205 HydrophobicContact CG-CD1 3.75Å; K182-L205 HydrophobicContact CG-CD2 4.47Å; K182-L205 HydrophobicContact CG-CG 3.64Å
206	R	94.2	Very high	79.1	Confident	71 Å²	71	76.4 Å²	76.4	27%	0.268	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	126.8	176.5	-174.6	-175	-63.3	179.3	0.6	109.8	N88 F177 Y178 F179	N88-R206 PolarHBondContact OD1-NH1 3.34Å; F177-R206 HydrophobicContact CB-CG 3.95Å; F177-R206 HydrophobicContact CD2-CG 3.66Å; F177-R206 HydrophobicContact CE2-CG 4.45Å; F177-R206 HydrophobicContact CG-CG 3.99Å; Y178-R206 WeakPolarHBondContact O-CA 3.37Å; F179-R206 HydrophobicContact CD1-CB 4Å; F179-R206 HydrophobicContact CE1-CB 3.8Å; F179-R206 HydrophobicContact CE1-CG 4.28Å
207	E	95.5	Very high	81.6	Confident	79 Å²	79	74.6 Å²	74.6	37%	0.369	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.1	174.5	-171.9	175	-179.8	0	0	110.5	F177 Y178 H180	F177-E207 WeakPolarHBondContact CA-O 3.49Å; F177-E207 VanDerWaalsContact CB-O 3.28Å; F177-E207 WeakPolarHBondContact CB-O 3.46Å; Y178-E207 HydrophobicContact CE1-CB 4.36Å; Y178-E207 HydrophobicContact CE1-CG 4.41Å; Y178-E207 HydrophobicContact CE2-CB 4.28Å; Y178-E207 VanDerWaalsContact CZ-OE2 3.29Å; Y178-E207 PolarHBondContact N-O 3.26Å; Y178-E207 VanDerWaalsContact N-O 3.08Å; Y178-E207 PolarHBondContact O-N 3.03Å; Y178-E207 PolarHBondContact OH-OE1 2.83Å; Y178-E207 PolarHBondContact OH-OE2 2.89Å; H180-E207 IonicContact ND1-OE2 2.84Å
208	W	97.4	Very high	84	Confident	43 Å²	43	74.1 Å²	74.1	16%	0.163	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129	177.5	-74.5	98.4	0	0	0	111.2	N88 E90 Y91 A175 T176 F177 Y210	N88-W208 HydrophobicContact CB-CH2 3.74Å; N88-W208 HydrophobicContact CB-CZ2 3.88Å; E90-W208 HydrophobicContact CB-CD2 3.53Å; E90-W208 VanDerWaalsContact CB-CE2 3.45Å; E90-W208 HydrophobicContact CB-CE3 3.64Å; E90-W208 HydrophobicContact CB-CG 4.22Å; E90-W208 HydrophobicContact CB-CH2 3.69Å; E90-W208 HydrophobicContact CB-CZ2 3.55Å; E90-W208 HydrophobicContact CB-CZ3 3.72Å; E90-W208 HydrophobicContact CG-CD2 3.82Å; E90-W208 VanDerWaalsContact CG-CE2 3.42Å; E90-W208 HydrophobicContact CG-CE3 4.44Å; E90-W208 HydrophobicContact CG-CG 4.13Å; E90-W208 HydrophobicContact CG-CH2 4.42Å; E90-W208 HydrophobicContact CG-CZ2 3.77Å; E90-W208 PolarHBondContact OE1-NE1 3.05Å; E90-W208 WeakPolarHBondContact OE2-CZ2 3.48Å; Y91-W208 HydrophobicContact CD1-CZ3 4.35Å; Y91-W208 HydrophobicContact CD2-CH2 4.01Å; Y91-W208 HydrophobicContact CD2-CZ3 4.26Å; Y91-W208 HydrophobicContact CE1-CZ3 4.01Å; Y91-W208 AromaticContact CE2-CH2 3.58Å; Y91-W208 HydrophobicContact CE2-CH2 3.58Å; Y91-W208 AromaticContact CE2-CZ3 3.89Å; Y91-W208 HydrophobicContact CE2-CZ3 3.89Å; Y91-W208 HydrophobicContact CG-CZ3 4.44Å; Y91-W208 AromaticContact CZ-CH2 3.84Å; Y91-W208 AromaticContact CZ-CZ3 3.72Å; A175-W208 HydrophobicContact CB-CE3 4Å; A175-W208 HydrophobicContact CB-CZ3 4.1Å; T176-W208 CarbonylContact O-C 3.5Å; T176-W208 WeakPolarHBondContact O-CA 3.35Å; T176-W208 VanDerWaalsContact O-CE3 3.27Å; F177-W208 HydrophobicContact CB-CD2 3.96Å; F177-W208 HydrophobicContact CB-CE3 3.97Å; F177-W208 HydrophobicContact CB-CG 4.41Å; F177-W208 HydrophobicContact CB-CZ3 4.32Å; F177-W208 HydrophobicContact CD1-CE3 4.37Å; F177-W208 AromaticContact CD1-CH2 3.72Å; F177-W208 HydrophobicContact CD1-CH2 3.72Å; F177-W208 HydrophobicContact CD1-CZ2 4.13Å; F177-W208 AromaticContact CD1-CZ3 3.87Å; F177-W208 HydrophobicContact CD1-CZ3 3.87Å; F177-W208 HydrophobicContact CE1-CH2 4.38Å; W208-Y210 HydrophobicContact CB-CD2 4.44Å; W208-Y210 HydrophobicContact CB-CE2 3.64Å
209	M	97.7	Very high	86.3	Confident	37 Å²	37	72.7 Å²	72.7	18%	0.182	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.5	171.6	178.8	-169.8	-63.5	0	0	108.8	A63 R169 E171 A175 T176 Y178	A63-M209 HydrophobicContact CB-CE 4.29Å; R169-M209 HydrophobicContact CB-CE 4.44Å; R169-M209 HydrophobicContact CB-SD 4.36Å; E171-M209 HydrophobicContact CG-CG 4.29Å; E171-M209 HydrophobicContact CG-SD 3.99Å; A175-M209 CarbonylContact C-O 3.57Å; A175-M209 VanDerWaalsContact CA-O 3.28Å; A175-M209 WeakPolarHBondContact CA-O 3.44Å; T176-M209 HydrophobicContact CG2-CB 3.83Å; T176-M209 HydrophobicContact CG2-CG 4.25Å; T176-M209 HydrophobicContact CG2-SD 4.03Å; T176-M209 PolarHBondContact N-O 3.24Å; T176-M209 PolarHBondContact O-N 2.82Å; T176-M209 VanDerWaalsContact O-O 3.12Å; Y178-M209 HydrophobicContact CD1-CE 4.33Å; Y178-M209 HydrophobicContact CE1-CE 3.95Å
210	Y	97.6	Very high	88.5	Confident	63 Å²	63	75 Å²	75	25%	0.247	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	162.8	-176.3	-67.4	-88.7	0	0	0	111.9	A175 W208 R212	A175-Y210 HydrophobicContact CB-CD1 3.88Å; A175-Y210 HydrophobicContact CB-CE1 3.96Å; W208-Y210 HydrophobicContact CB-CD2 4.44Å; W208-Y210 HydrophobicContact CB-CE2 3.64Å; Y210-R212 PolarHBondContact O-N 2.73Å
211	Y	96.8	Very high	90.6	Very high	45 Å²	45	74.7 Å²	74.7	18%	0.176	39%	0.389	C	S	.	.			trans	-52.6	128.6	176.5	167.6	-115.1	0	0	0	113	F98 L142 E171 A173 S174 A213 R224	F98-Y211 HydrophobicContact CB-CD1 4.21Å; F98-Y211 AromaticContact CD2-CD1 3.69Å; F98-Y211 HydrophobicContact CD2-CD1 3.69Å; F98-Y211 HydrophobicContact CD2-CD2 4.24Å; F98-Y211 AromaticContact CD2-CE1 3.62Å; F98-Y211 HydrophobicContact CD2-CE1 3.62Å; F98-Y211 HydrophobicContact CD2-CE2 4.22Å; F98-Y211 AromaticContact CD2-CG 3.98Å; F98-Y211 HydrophobicContact CD2-CG 3.98Å; F98-Y211 AromaticContact CD2-CZ 3.9Å; F98-Y211 HydrophobicContact CE2-CE1 4.23Å; F98-Y211 HydrophobicContact CE2-CE2 4.37Å; F98-Y211 HydrophobicContact CG-CD1 4.45Å; L142-Y211 HydrophobicContact CD1-CD2 4.33Å; L142-Y211 HydrophobicContact CD1-CE2 3.76Å; L142-Y211 HydrophobicContact CD2-CE2 4.49Å; L142-Y211 HydrophobicContact CG-CE2 4.19Å; E171-Y211 WeakPolarHBondContact O-CA 3.47Å; E171-Y211 WeakPolarHBondContact O-CD2 3.38Å; A173-Y211 VanDerWaalsContact O-CA 3.22Å; A173-Y211 WeakPolarHBondContact O-CA 3.3Å; A173-Y211 WeakPolarHBondContact O-CB 3.04Å; A173-Y211 PolarHBondContact O-N 2.87Å; S174-Y211 PolarHBondContact O-N 2.8Å; S174-Y211 VanDerWaalsContact O-N 3.09Å; Y211-A213 HydrophobicContact CD1-CB 4.47Å; Y211-A213 HydrophobicContact CE1-CB 3.81Å; Y211-R224 PolarHBondContact OH-NH2 3.14Å; Y211-R224 VanDerWaalsContact OH-NH2 3.09Å
212	R	94.8	Very high	92.3	Very high	46 Å²	46	74.5 Å²	74.5	17%	0.174	40%	0.398	C	S	.	.			trans	-88.9	107	171	-176.6	179.8	179.3	-104.8	-11.4	111.1	E171 Y210 E218	E171-R212 HydrophobicContact CB-CB 3.58Å; E171-R212 HydrophobicContact CG-CB 4.32Å; E171-R212 PolarHBondContact O-N 3.2Å; E171-R212 WeakPolarHBondContact OE2-CD 3.32Å; Y210-R212 PolarHBondContact O-N 2.73Å; R212-E218 IonicContact CZ-OE1 3.26Å; R212-E218 VanDerWaalsContact CZ-OE1 3.26Å; R212-E218 IonicContact CZ-OE2 3.53Å; R212-E218 IonicContact NH1-OE1 2.86Å; R212-E218 PolarHBondContact NH1-OE1 2.91Å; R212-E218 IonicContact NH1-OE2 3.61Å; R212-E218 IonicContact NH2-OE1 2.69Å; R212-E218 PolarHBondContact NH2-OE1 3.47Å; R212-E218 IonicContact NH2-OE2 2.81Å; R212-E218 PolarHBondContact NH2-OE2 2.86Å
213	A	92.3	Very high	93.8	Very high	48 Å²	48	68.4 Å²	68.4	40%	0.397	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-69.4	148.9	169.3	0	0	0	0	0	112.1	Y211 K215	Y211-A213 HydrophobicContact CD1-CB 4.47Å; Y211-A213 HydrophobicContact CE1-CB 3.81Å; A213-K215 PolarHBondContact O-N 3.23Å
214	L	92	Very high	94.7	Very high	62 Å²	62	66.7 Å²	66.7	33%	0.325	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-59.1	129.2	170.4	-73.1	168.8	0	0	0	110.2	E218 E220 L223	L214-E218 HydrophobicContact CD2-CG 4.43Å; L214-E220 HydrophobicContact CD1-CB 3.85Å; L214-E220 HydrophobicContact CD1-CG 3.87Å; L214-E220 HydrophobicContact CD2-CB 4.27Å; L214-E220 HydrophobicContact CD2-CG 4.47Å; L214-L223 HydrophobicContact CD2-CB 4.47Å; L214-L223 HydrophobicContact CD2-CD2 3.62Å; L214-L223 HydrophobicContact CG-CD2 4.5Å
215	K	93.6	Very high	95.2	Very high	139 Å²	139	66.1 Å²	66.1	60%	0.604	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-74.6	155.8	175.8	-63.9	178.3	-178.5	175.7	0	110.3	A213 G217 E218	A213-K215 PolarHBondContact O-N 3.23Å; K215-G217 PolarHBondContact O-N 3.38Å; K215-E218 HydrophobicContact CB-CB 4.09Å; K215-E218 PolarHBondContact N-OE2 3.45Å; K215-E218 VanDerWaalsContact O-CB 3.32Å; K215-E218 WeakPolarHBondContact O-CB 3.24Å; K215-E218 PolarHBondContact O-N 2.82Å
216	H	92.6	Very high	95.6	Very high	206 Å²	206	70.3 Å²	70.3	95%	0.954	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	127.5	174.9	-173.4	77.9	0	0	0	110.3	E218	H216-E218 VanDerWaalsContact C-N 3.28Å; H216-E218 PolarHBondContact O-N 2.88Å
217	G	92.2	Very high	95.8	Very high	78 Å²	78	67.1 Å²	67.1	80%	0.804	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-2.7	-176.7	0	0	0	0	0	115.5	K215	K215-G217 PolarHBondContact O-N 3.38Å
218	E	94.8	Very high	96	Very high	64 Å²	64	63.4 Å²	63.4	30%	0.299	33%	0.33	S	S	.	.			trans	-78.4	131.9	176.4	-174.1	174.7	-156.5	0	0	110.9	R212 L214 K215 H216	R212-E218 IonicContact CZ-OE1 3.26Å; R212-E218 VanDerWaalsContact CZ-OE1 3.26Å; R212-E218 IonicContact CZ-OE2 3.53Å; R212-E218 IonicContact NH1-OE1 2.86Å; R212-E218 PolarHBondContact NH1-OE1 2.91Å; R212-E218 IonicContact NH1-OE2 3.61Å; R212-E218 IonicContact NH2-OE1 2.69Å; R212-E218 PolarHBondContact NH2-OE1 3.47Å; R212-E218 IonicContact NH2-OE2 2.81Å; R212-E218 PolarHBondContact NH2-OE2 2.86Å; L214-E218 HydrophobicContact CD2-CG 4.43Å; K215-E218 HydrophobicContact CB-CB 4.09Å; K215-E218 PolarHBondContact N-OE2 3.45Å; K215-E218 VanDerWaalsContact O-CB 3.32Å; K215-E218 WeakPolarHBondContact O-CB 3.24Å; K215-E218 PolarHBondContact O-N 2.82Å; H216-E218 VanDerWaalsContact C-N 3.28Å; H216-E218 PolarHBondContact O-N 2.88Å
219	S	94.4	Very high	96	Very high	78 Å²	78	64.6 Å²	64.6	55%	0.545	34%	0.337	S	S	.	.			trans	-71.7	134.4	171.7	-176	0	0	0	0	110.3	P222	S219-P222 WeakPolarHBondContact OG-CD 3.37Å
220	E	95.1	Very high	96.1	Very high	73 Å²	73	65.2 Å²	65.2	34%	0.341	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-43	-177	179.3	165.8	-133.8	0	0	112.4	L214 L223 R224 W304	L214-E220 HydrophobicContact CD1-CB 3.85Å; L214-E220 HydrophobicContact CD1-CG 3.87Å; L214-E220 HydrophobicContact CD2-CB 4.27Å; L214-E220 HydrophobicContact CD2-CG 4.47Å; E220-L223 PolarHBondContact O-N 3.4Å; E220-R224 HydrophobicContact CG-CG 3.6Å; E220-R224 WeakPolarHBondContact O-CG 3.36Å; E220-R224 PolarHBondContact O-N 2.92Å; E220-W304 WeakPolarHBondContact OE1-CH2 3.38Å; E220-W304 VanDerWaalsContact OE1-CZ2 3.29Å; E220-W304 WeakPolarHBondContact OE1-CZ2 3.47Å
221	F	96.5	Very high	96.2	Very high	81 Å²	81	62.2 Å²	62.2	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-59.1	-51.3	-170.5	176.2	-98.3	0	0	0	113.7	L223 R224 N225 V306 L308 D309	F221-L223 VanDerWaalsContact C-N 3.3Å; F221-L223 PolarHBondContact O-N 2.73Å; F221-R224 PolarHBondContact O-N 3.02Å; F221-N225 HydrophobicContact CE1-CB 4.28Å; F221-N225 HydrophobicContact CE2-CB 4.21Å; F221-N225 HydrophobicContact CZ-CB 4.06Å; F221-N225 WeakPolarHBondContact O-CB 3.44Å; F221-N225 PolarHBondContact O-N 2.96Å; F221-V306 VanDerWaalsContact CD2-O 3.25Å; F221-V306 WeakPolarHBondContact CD2-O 3.43Å; F221-V306 WeakPolarHBondContact CE2-O 3.27Å; F221-L308 WeakPolarHBondContact CE2-O 3.36Å; F221-D309 WeakPolarHBondContact CZ-OD1 3.45Å
222	P	97.6	Very high	96.3	Very high	78 Å²	78	60.1 Å²	60.1	51%	0.506	32%	0.319	S	S	.	.	H	α-helix	trans	-58.5	-39.5	-178.7	-25.9	35.7	0	0	0	113.6	S219 K226	S219-P222 WeakPolarHBondContact OG-CD 3.37Å; P222-K226 WeakPolarHBondContact O-CB 3.31Å; P222-K226 PolarHBondContact O-N 2.92Å; P222-K226 VanDerWaalsContact O-N 3.15Å
223	L	97.4	Very high	96.5	Very high	16 Å²	16	61.8 Å²	61.8	8%	0.084	33%	0.331	C	S	.	.	H	α-helix	trans	-65.1	-54.6	175.6	172.6	57.4	0	0	0	110.8	L214 E220 F221 N225 K226 Q227	L214-L223 HydrophobicContact CD2-CB 4.47Å; L214-L223 HydrophobicContact CD2-CD2 3.62Å; L214-L223 HydrophobicContact CG-CD2 4.5Å; E220-L223 PolarHBondContact O-N 3.4Å; F221-L223 VanDerWaalsContact C-N 3.3Å; F221-L223 PolarHBondContact O-N 2.73Å; L223-N225 VanDerWaalsContact C-N 3.28Å; L223-N225 PolarHBondContact O-N 2.66Å; L223-K226 PolarHBondContact O-N 3.34Å; L223-Q227 HydrophobicContact CD1-CG 4.12Å; L223-Q227 WeakPolarHBondContact O-CG 3.38Å; L223-Q227 PolarHBondContact O-N 2.97Å
224	R	98.1	Very high	96.8	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-32.8	-174.4	-60.7	-52.2	-176.5	-160.7	-0.3	112	Y211 E220 F221 Q227 V228 F280 W304 P307	Y211-R224 PolarHBondContact OH-NH2 3.14Å; Y211-R224 VanDerWaalsContact OH-NH2 3.09Å; E220-R224 HydrophobicContact CG-CG 3.6Å; E220-R224 WeakPolarHBondContact O-CG 3.36Å; E220-R224 PolarHBondContact O-N 2.92Å; F221-R224 PolarHBondContact O-N 3.02Å; R224-Q227 WeakPolarHBondContact O-CB 3.26Å; R224-Q227 PolarHBondContact O-N 3.42Å; R224-V228 PolarHBondContact O-N 2.84Å; R224-F280 HydrophobicContact CB-CZ 4.31Å; R224-F280 WeakPolarHBondContact O-CZ 3.41Å; R224-W304 HydrophobicContact CB-CH2 4.48Å; R224-W304 HydrophobicContact CG-CH2 3.66Å; R224-W304 HydrophobicContact CG-CZ2 4.5Å; R224-W304 HydrophobicContact CG-CZ3 4.19Å; R224-P307 HydrophobicContact CB-CB 3.94Å; R224-P307 HydrophobicContact CB-CG 4Å
225	N	98.6	Very high	97.1	Very high	17 Å²	17	57.5 Å²	57.5	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-68	-42.2	174.4	-178.3	-98.6	0	0	0	112.6	F221 L223 Q227 V228 K229 P307 D309	F221-N225 HydrophobicContact CE1-CB 4.28Å; F221-N225 HydrophobicContact CE2-CB 4.21Å; F221-N225 HydrophobicContact CZ-CB 4.06Å; F221-N225 WeakPolarHBondContact O-CB 3.44Å; F221-N225 PolarHBondContact O-N 2.96Å; L223-N225 VanDerWaalsContact C-N 3.28Å; L223-N225 PolarHBondContact O-N 2.66Å; N225-Q227 VanDerWaalsContact C-N 3.29Å; N225-Q227 PolarHBondContact O-N 3.01Å; N225-V228 WeakPolarHBondContact O-CG1 3.15Å; N225-V228 PolarHBondContact O-N 3.31Å; N225-K229 WeakPolarHBondContact O-CG 3.13Å; N225-K229 PolarHBondContact O-N 2.69Å; N225-K229 WeakPolarHBondContact OD1-CE 3.39Å; N225-K229 PolarHBondContact OD1-NZ 3.07Å; N225-P307 VanDerWaalsContact CA-O 3.24Å; N225-P307 WeakPolarHBondContact CA-O 3.08Å; N225-P307 WeakPolarHBondContact CB-O 3.4Å; N225-P307 PolarHBondContact ND2-O 2.8Å; N225-D309 VanDerWaalsContact ND2-CG 3.32Å; N225-D309 PolarHBondContact ND2-OD2 2.8Å; N225-D309 PolarHBondContact OD1-OD2 2.73Å
226	K	98.4	Very high	97.4	Very high	151 Å²	151	52 Å²	52	66%	0.657	28%	0.279	S	S	*	.	H	α-helix	trans	-58.9	-45.2	171.5	-176.2	-176	175.9	-171.6	0	110.9	P222 L223 K229 Q230	P222-K226 WeakPolarHBondContact O-CB 3.31Å; P222-K226 PolarHBondContact O-N 2.92Å; P222-K226 VanDerWaalsContact O-N 3.15Å; L223-K226 PolarHBondContact O-N 3.34Å; K226-K229 PolarHBondContact O-N 2.99Å; K226-Q230 PolarHBondContact O-N 3.44Å
227	Q	98.8	Very high	97.6	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.019	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-47.5	178.3	-76.1	-178.9	-31.4	0	0	112.4	D170 L223 R224 N225 K229 Q230 R231 F280	D170-Q227 HydrophobicContact CB-CB 4.19Å; D170-Q227 HydrophobicContact CB-CG 4.06Å; D170-Q227 WeakPolarHBondContact O-CG 3.29Å; D170-Q227 PolarHBondContact O-NE2 2.85Å; D170-Q227 WeakPolarHBondContact OD2-CB 3.39Å; L223-Q227 HydrophobicContact CD1-CG 4.12Å; L223-Q227 WeakPolarHBondContact O-CG 3.38Å; L223-Q227 PolarHBondContact O-N 2.97Å; R224-Q227 WeakPolarHBondContact O-CB 3.26Å; R224-Q227 PolarHBondContact O-N 3.42Å; N225-Q227 VanDerWaalsContact C-N 3.29Å; N225-Q227 PolarHBondContact O-N 3.01Å; Q227-K229 VanDerWaalsContact C-N 3.27Å; Q227-K229 PolarHBondContact O-N 3.05Å; Q227-Q230 PolarHBondContact O-N 3.33Å; Q227-Q230 VanDerWaalsContact O-N 3.16Å; Q227-R231 VanDerWaalsContact O-CG 3.22Å; Q227-R231 WeakPolarHBondContact O-CG 3.25Å; Q227-R231 PolarHBondContact O-N 3.37Å; Q227-F280 HydrophobicContact CB-CE1 4.02Å; Q227-F280 HydrophobicContact CB-CZ 3.62Å
228	V	98.9	Very high	98	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.4	-36	-178.8	85	0	0	0	0	112.6	R224 N225 R231 A232 F280 A283 E287 P307 L308	R224-V228 PolarHBondContact O-N 2.84Å; N225-V228 WeakPolarHBondContact O-CG1 3.15Å; N225-V228 PolarHBondContact O-N 3.31Å; V228-R231 PolarHBondContact O-N 3.4Å; V228-A232 PolarHBondContact O-N 2.93Å; V228-F280 HydrophobicContact CB-CE2 3.78Å; V228-F280 HydrophobicContact CB-CZ 4.43Å; V228-F280 HydrophobicContact CG2-CD2 4.42Å; V228-F280 HydrophobicContact CG2-CE2 3.91Å; V228-A283 HydrophobicContact CG2-CB 3.84Å; V228-E287 HydrophobicContact CG1-CG 4.45Å; V228-E287 HydrophobicContact CG2-CB 4.23Å; V228-P307 HydrophobicContact CB-CB 3.85Å; V228-P307 HydrophobicContact CG1-CB 4.12Å; V228-P307 WeakPolarHBondContact CG1-O 3.45Å; V228-P307 HydrophobicContact CG2-CB 4.22Å; V228-L308 HydrophobicContact CG1-CD2 4.09Å; V228-L308 HydrophobicContact CG2-CD2 3.92Å
229	K	98.8	Very high	98.2	Very high	69 Å²	69	38 Å²	38	30%	0.3	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-47.7	175.6	-75.2	168.8	178.4	163.9	0	110.9	N225 K226 Q227 A232 D233 K291 D309	N225-K229 WeakPolarHBondContact O-CG 3.13Å; N225-K229 PolarHBondContact O-N 2.69Å; N225-K229 WeakPolarHBondContact OD1-CE 3.39Å; N225-K229 PolarHBondContact OD1-NZ 3.07Å; K226-K229 PolarHBondContact O-N 2.99Å; Q227-K229 VanDerWaalsContact C-N 3.27Å; Q227-K229 PolarHBondContact O-N 3.05Å; K229-A232 PolarHBondContact O-N 3.02Å; K229-D233 VanDerWaalsContact O-CG 3.29Å; K229-D233 PolarHBondContact O-N 3.19Å; K229-D233 VanDerWaalsContact O-N 3.17Å; K229-D233 VanDerWaalsContact O-OD2 3.1Å; K229-K291 PolarHBondContact O-NZ 3.45Å; K229-D309 WeakPolarHBondContact CE-OD2 3.39Å; K229-D309 IonicContact NZ-OD2 3.75Å; K229-D309 PolarHBondContact NZ-OD2 3.08Å
230	Q	98.8	Very high	98.4	Very high	50 Å²	50	36.8 Å²	36.8	23%	0.234	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-44.8	174.5	178.8	178.6	-17.3	0	0	111.6	R169 D170 K226 Q227 A232 D233 E234	R169-Q230 PolarHBondContact O-NE2 2.76Å; D170-Q230 HydrophobicContact CB-CB 4.35Å; D170-Q230 HydrophobicContact CB-CG 4.17Å; K226-Q230 PolarHBondContact O-N 3.44Å; Q227-Q230 PolarHBondContact O-N 3.33Å; Q227-Q230 VanDerWaalsContact O-N 3.16Å; Q230-A232 VanDerWaalsContact C-N 3.28Å; Q230-A232 PolarHBondContact O-N 3.49Å; Q230-D233 WeakPolarHBondContact O-CB 3.42Å; Q230-D233 PolarHBondContact O-N 3.31Å; Q230-E234 HydrophobicContact CG-CG 4.36Å; Q230-E234 PolarHBondContact NE2-OE1 3.44Å; Q230-E234 WeakPolarHBondContact O-CG 3.21Å; Q230-E234 PolarHBondContact O-N 2.81Å
231	R	98.9	Very high	98.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-39.8	179.1	-69.2	167.9	123.6	-100	-10	112.5	S139 H140 H168 D170 S172 Q227 V228 E234 C235 F280 G281 T284	S139-R231 PolarHBondContact OG-NH1 2.84Å; H140-R231 PolarHBondContact ND1-NH2 3.05Å; H140-R231 PolarHBondContact O-NH1 3.03Å; H140-R231 VanDerWaalsContact O-NH1 3.13Å; H140-R231 PolarHBondContact O-NH2 3.23Å; H168-R231 HydrophobicContact CB-CG 4.16Å; H168-R231 VanDerWaalsContact CD2-CZ 3.45Å; H168-R231 PolarHBondContact CD2-NH2 3.4Å; H168-R231 VanDerWaalsContact CD2-NH2 3.26Å; H168-R231 PolarHBondContact CE1-O 3.4Å; D170-R231 HydrophobicContact CB-CG 4.25Å; D170-R231 WeakPolarHBondContact OD2-CD 3.44Å; D170-R231 WeakPolarHBondContact OD2-CG 3.38Å; D170-R231 IonicContact OD2-NE 3.43Å; D170-R231 PolarHBondContact OD2-NE 3.19Å; D170-R231 VanDerWaalsContact OD2-NE 3.14Å; S172-R231 PolarHBondContact OG-NE 3.33Å; S172-R231 PolarHBondContact OG-NH2 3.43Å; Q227-R231 VanDerWaalsContact O-CG 3.22Å; Q227-R231 WeakPolarHBondContact O-CG 3.25Å; Q227-R231 PolarHBondContact O-N 3.37Å; V228-R231 PolarHBondContact O-N 3.4Å; R231-E234 PolarHBondContact O-N 3.43Å; R231-C235 PolarHBondContact O-N 3.34Å; R231-C235 PolarHBondContact O-SG 2.96Å; R231-C235 VanDerWaalsContact O-SG 3.39Å; R231-F280 PolarHBondContact NH1-O 2.84Å; R231-G281 VanDerWaalsContact NH1-CA 3.35Å; R231-T284 HydrophobicContact CB-CG2 3.66Å; R231-T284 VanDerWaalsContact CB-OG1 3.28Å; R231-T284 WeakPolarHBondContact CB-OG1 3.49Å; R231-T284 WeakPolarHBondContact CD-OG1 3.42Å; R231-T284 PolarHBondContact NH1-OG1 3.3Å
232	A	98.9	Very high	98.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-40	175.4	0	0	0	0	0	111.9	V228 K229 Q230 E234 C235 I236 E287 S288 K291	V228-A232 PolarHBondContact O-N 2.93Å; K229-A232 PolarHBondContact O-N 3.02Å; Q230-A232 VanDerWaalsContact C-N 3.28Å; Q230-A232 PolarHBondContact O-N 3.49Å; A232-E234 VanDerWaalsContact C-N 3.32Å; A232-E234 PolarHBondContact O-N 3.04Å; A232-C235 PolarHBondContact O-N 3Å; A232-I236 VanDerWaalsContact O-CG1 3.28Å; A232-I236 WeakPolarHBondContact O-CG1 3.46Å; A232-I236 PolarHBondContact O-N 3.26Å; A232-E287 HydrophobicContact CB-CB 3.91Å; A232-E287 HydrophobicContact CB-CG 3.49Å; A232-E287 VanDerWaalsContact CB-CG 3.49Å; A232-S288 WeakPolarHBondContact CA-OG 3.15Å; A232-K291 HydrophobicContact CB-CD 3.95Å
233	D	98.9	Very high	98.7	Very high	82 Å²	82	28.5 Å²	28.5	44%	0.439	14%	0.14	S	C	.	.	H	α-helix	trans	-63.8	-38.4	175	-60.8	-30.5	0	0	0	111.2	K229 Q230 I236 L237 K291	K229-D233 VanDerWaalsContact O-CG 3.29Å; K229-D233 PolarHBondContact O-N 3.19Å; K229-D233 VanDerWaalsContact O-N 3.17Å; K229-D233 VanDerWaalsContact O-OD2 3.1Å; Q230-D233 WeakPolarHBondContact O-CB 3.42Å; Q230-D233 PolarHBondContact O-N 3.31Å; D233-I236 PolarHBondContact O-N 2.98Å; D233-L237 WeakPolarHBondContact O-CB 3.48Å; D233-L237 PolarHBondContact O-N 3.41Å; D233-K291 IonicContact OD1-NZ 2.67Å; D233-K291 PolarHBondContact OD1-NZ 3.32Å; D233-K291 IonicContact OD2-NZ 3.97Å; D233-K291 PolarHBondContact OD2-NZ 2.75Å; D233-K291 VanDerWaalsContact OD2-NZ 3.1Å
234	E	98.9	Very high	98.7	Very high	19 Å²	19	30.9 Å²	30.9	9%	0.089	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-36.5	174.7	-69.7	168	165.2	0	0	112.6	V166 H168 R169 Q230 R231 A232 L237 A238	V166-E234 HydrophobicContact CG1-CB 4.27Å; H168-E234 VanDerWaalsContact CA-OE2 3.24Å; H168-E234 WeakPolarHBondContact CA-OE2 3.48Å; H168-E234 VanDerWaalsContact CB-OE2 3.3Å; H168-E234 WeakPolarHBondContact CB-OE2 3.35Å; H168-E234 IonicContact CE1-OE2 3.38Å; H168-E234 IonicContact CG-OE2 2.61Å; H168-E234 IonicContact ND1-OE2 2.69Å; H168-E234 PolarHBondContact ND1-OE2 3.09Å; R169-E234 WeakPolarHBondContact CA-OE1 3.28Å; R169-E234 WeakPolarHBondContact CB-OE1 3.22Å; R169-E234 PolarHBondContact N-OE1 3.11Å; R169-E234 PolarHBondContact N-OE2 2.67Å; Q230-E234 HydrophobicContact CG-CG 4.36Å; Q230-E234 PolarHBondContact NE2-OE1 3.44Å; Q230-E234 WeakPolarHBondContact O-CG 3.21Å; Q230-E234 PolarHBondContact O-N 2.81Å; R231-E234 PolarHBondContact O-N 3.43Å; A232-E234 VanDerWaalsContact C-N 3.32Å; A232-E234 PolarHBondContact O-N 3.04Å; E234-L237 PolarHBondContact O-N 2.88Å; E234-A238 WeakPolarHBondContact O-CB 3.48Å; E234-A238 PolarHBondContact O-N 3.06Å
235	C	98.9	Very high	98.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-41.8	172.3	-75.2	0	0	0	0	112.2	I137 R231 A232 A238 L239	I137-C235 HydrophobicContact CG2-CB 3.81Å; R231-C235 PolarHBondContact O-N 3.34Å; R231-C235 PolarHBondContact O-SG 2.96Å; R231-C235 VanDerWaalsContact O-SG 3.39Å; A232-C235 PolarHBondContact O-N 3Å; C235-A238 PolarHBondContact O-N 3.17Å; C235-L239 PolarHBondContact O-N 3.39Å; C235-L239 VanDerWaalsContact O-N 3.11Å
236	I	98.9	Very high	98.6	Very high	25 Å²	25	31.2 Å²	31.2	13%	0.128	15%	0.152	C	C	.	.	H	α-helix	trans	-65.2	-44.2	175.7	-65.7	164.2	0	0	0	109.9	A232 D233 A238 L239 D240 K291 E292 F295	A232-I236 VanDerWaalsContact O-CG1 3.28Å; A232-I236 WeakPolarHBondContact O-CG1 3.46Å; A232-I236 PolarHBondContact O-N 3.26Å; D233-I236 PolarHBondContact O-N 2.98Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 3.48Å; I236-L239 WeakPolarHBondContact O-CB 3.37Å; I236-L239 PolarHBondContact O-N 3.29Å; I236-L239 VanDerWaalsContact O-N 3.12Å; I236-D240 PolarHBondContact O-N 3.47Å; I236-K291 HydrophobicContact CD1-CB 3.83Å; I236-K291 HydrophobicContact CD1-CD 4.43Å; I236-E292 HydrophobicContact CD1-CB 3.75Å; I236-E292 HydrophobicContact CG1-CB 3.71Å; I236-E292 HydrophobicContact CG1-CG 4.13Å; I236-F295 HydrophobicContact CG1-CE2 4.11Å
237	L	98.8	Very high	98.6	Very high	53 Å²	53	27.5 Å²	27.5	28%	0.277	15%	0.145	S	C	.	.	H	α-helix	trans	-60.5	-41.6	177	-177.7	62.4	0	0	0	111.8	Q64 D233 E234 D240 K241	Q64-L237 WeakPolarHBondContact O-CD2 3.46Å; D233-L237 WeakPolarHBondContact O-CB 3.48Å; D233-L237 PolarHBondContact O-N 3.41Å; E234-L237 PolarHBondContact O-N 2.88Å; L237-D240 PolarHBondContact O-N 3.09Å; L237-K241 WeakPolarHBondContact O-CG 3.28Å; L237-K241 PolarHBondContact O-N 3.25Å
238	A	98.9	Very high	98.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.2	0	0	0	0	0	111.8	F68 I137 V166 E234 C235 I236 D240 K241 L242	F68-A238 HydrophobicContact CD1-CB 3.94Å; F68-A238 HydrophobicContact CE1-CB 4.2Å; I137-A238 HydrophobicContact CD1-CB 4.22Å; V166-A238 HydrophobicContact CG2-CB 3.64Å; E234-A238 WeakPolarHBondContact O-CB 3.48Å; E234-A238 PolarHBondContact O-N 3.06Å; C235-A238 PolarHBondContact O-N 3.17Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 3.48Å; A238-D240 VanDerWaalsContact C-N 3.3Å; A238-D240 PolarHBondContact O-N 2.89Å; A238-K241 PolarHBondContact O-N 2.71Å; A238-L242 WeakPolarHBondContact O-CG 3.49Å; A238-L242 PolarHBondContact O-N 2.94Å
239	L	98.8	Very high	98.3	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-38.5	174.5	179	60.7	0	0	0	112.3	V135 I137 C235 I236 L242 T243 T273 K294 F295	V135-L239 HydrophobicContact CG1-CD1 4.29Å; I137-L239 HydrophobicContact CD1-CB 4.3Å; I137-L239 HydrophobicContact CG1-CB 4.24Å; C235-L239 PolarHBondContact O-N 3.39Å; C235-L239 VanDerWaalsContact O-N 3.11Å; I236-L239 WeakPolarHBondContact O-CB 3.37Å; I236-L239 PolarHBondContact O-N 3.29Å; I236-L239 VanDerWaalsContact O-N 3.12Å; L239-L242 PolarHBondContact O-N 2.91Å; L239-T243 WeakPolarHBondContact O-CB 3.44Å; L239-T243 PolarHBondContact O-N 3.45Å; L239-T243 PolarHBondContact O-OG1 2.93Å; L239-T273 HydrophobicContact CD1-CG2 3.59Å; L239-T273 HydrophobicContact CD2-CG2 3.98Å; L239-T273 HydrophobicContact CG-CG2 4.43Å; L239-K294 HydrophobicContact CD2-CB 3.84Å; L239-K294 HydrophobicContact CD2-CD 4.02Å; L239-F295 HydrophobicContact CB-CZ 4.3Å; L239-F295 HydrophobicContact CD2-CD1 4.42Å; L239-F295 HydrophobicContact CD2-CE1 3.91Å; L239-F295 HydrophobicContact CD2-CE2 4.47Å; L239-F295 HydrophobicContact CD2-CZ 3.93Å
240	D	98.4	Very high	98	Very high	52 Å²	52	34 Å²	34	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-65.8	-38.1	176.1	-73.5	-22.8	0	0	0	111.6	I236 L237 A238 T243 Q244 K294	I236-D240 PolarHBondContact O-N 3.47Å; L237-D240 PolarHBondContact O-N 3.09Å; A238-D240 VanDerWaalsContact C-N 3.3Å; A238-D240 PolarHBondContact O-N 2.89Å; D240-T243 WeakPolarHBondContact O-CB 3.27Å; D240-T243 PolarHBondContact O-N 2.77Å; D240-Q244 WeakPolarHBondContact O-CG 3.47Å; D240-Q244 PolarHBondContact O-N 2.78Å; D240-K294 IonicContact OD1-NZ 3.89Å; D240-K294 PolarHBondContact OD1-NZ 3.19Å
241	K	98.4	Very high	97.6	Very high	17 Å²	17	32.9 Å²	32.9	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-41.4	173.3	-61.9	-53.8	175	173.1	0	112.4	F57 M59 F68 L237 A238 T243 Q244 M245	F57-K241 HydrophobicContact CE1-CB 4.08Å; F57-K241 HydrophobicContact CE1-CG 4.18Å; M59-K241 HydrophobicContact SD-CD 3.96Å; F68-K241 HydrophobicContact CE1-CB 4.25Å; F68-K241 HydrophobicContact CZ-CB 4.48Å; L237-K241 WeakPolarHBondContact O-CG 3.28Å; L237-K241 PolarHBondContact O-N 3.25Å; A238-K241 PolarHBondContact O-N 2.71Å; K241-T243 VanDerWaalsContact C-N 3.3Å; K241-T243 PolarHBondContact O-N 3.25Å; K241-Q244 WeakPolarHBondContact O-CB 3.29Å; K241-Q244 PolarHBondContact O-N 3.26Å; K241-M245 WeakPolarHBondContact O-CG 3.4Å; K241-M245 PolarHBondContact O-N 2.87Å
242	L	98.6	Very high	97.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-37.8	172.7	-65.3	-176.8	0	0	0	111.9	F68 L70 V135 I137 A164 A238 L239 Q244 M245 N246 M268	F68-L242 HydrophobicContact CE2-CD2 4.14Å; F68-L242 HydrophobicContact CZ-CD2 4.05Å; L70-L242 HydrophobicContact CD1-CD2 3.75Å; V135-L242 HydrophobicContact CG1-CD1 3.53Å; I137-L242 HydrophobicContact CD1-CD1 3.76Å; A164-L242 HydrophobicContact CB-CD1 3.92Å; A238-L242 WeakPolarHBondContact O-CG 3.49Å; A238-L242 PolarHBondContact O-N 2.94Å; L239-L242 PolarHBondContact O-N 2.91Å; L242-Q244 VanDerWaalsContact C-N 3.34Å; L242-M245 HydrophobicContact CD2-SD 3.98Å; L242-M245 PolarHBondContact O-N 2.78Å; L242-N246 WeakPolarHBondContact O-CB 3.38Å; L242-N246 PolarHBondContact O-N 3.25Å; L242-M268 HydrophobicContact CB-CE 4.31Å; L242-M268 HydrophobicContact CB-SD 3.86Å; L242-M268 HydrophobicContact CD2-CE 4.01Å; L242-M268 HydrophobicContact CD2-SD 4.49Å
243	T	98.5	Very high	97.1	Very high	41 Å²	41	40.9 Å²	40.9	25%	0.252	24%	0.242	S	C	.	.	H	α-helix	trans	-63	-41.7	175.2	-59.7	0	0	0	0	111.3	L239 D240 K241 N246 S247 L270	L239-T243 WeakPolarHBondContact O-CB 3.44Å; L239-T243 PolarHBondContact O-N 3.45Å; L239-T243 PolarHBondContact O-OG1 2.93Å; D240-T243 WeakPolarHBondContact O-CB 3.27Å; D240-T243 PolarHBondContact O-N 2.77Å; K241-T243 VanDerWaalsContact C-N 3.3Å; K241-T243 PolarHBondContact O-N 3.25Å; T243-N246 PolarHBondContact O-N 3.26Å; T243-S247 WeakPolarHBondContact O-CB 3.45Å; T243-S247 PolarHBondContact O-N 3.14Å; T243-S247 PolarHBondContact O-OG 3.3Å; T243-L270 HydrophobicContact CG2-CD1 3.79Å
244	Q	98	Very high	96.9	Very high	65 Å²	65	38.1 Å²	38.1	30%	0.304	23%	0.229	S	C	.	.	H	α-helix	trans	-61.3	-51	174.9	-73.3	171.8	7.4	0	0	111.3	D240 K241 L242 N246 S247 G248 V249 V251	D240-Q244 WeakPolarHBondContact O-CG 3.47Å; D240-Q244 PolarHBondContact O-N 2.78Å; K241-Q244 WeakPolarHBondContact O-CB 3.29Å; K241-Q244 PolarHBondContact O-N 3.26Å; L242-Q244 VanDerWaalsContact C-N 3.34Å; Q244-N246 VanDerWaalsContact C-N 3.31Å; Q244-N246 PolarHBondContact O-N 2.87Å; Q244-S247 PolarHBondContact O-N 3.06Å; Q244-S247 VanDerWaalsContact O-N 3.07Å; Q244-S247 PolarHBondContact O-OG 3.5Å; Q244-G248 PolarHBondContact O-N 3.45Å; Q244-V249 HydrophobicContact CB-CB 4.2Å; Q244-V249 HydrophobicContact CB-CG1 4.44Å; Q244-V249 PolarHBondContact O-N 2.95Å; Q244-V249 VanDerWaalsContact O-N 3.13Å; Q244-V251 HydrophobicContact CB-CG1 4.34Å
245	M	97.6	Very high	96.6	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-54.1	-48.1	175.3	-66.3	169.1	-171.9	0	0	111.5	F57 F68 K241 L242 S247 G248 V251 Y261 L264	F57-M245 HydrophobicContact CD1-CE 3.88Å; F57-M245 HydrophobicContact CD2-CE 3.47Å; F57-M245 VanDerWaalsContact CD2-CE 3.47Å; F57-M245 HydrophobicContact CE1-CE 3.67Å; F57-M245 HydrophobicContact CE2-CE 3.26Å; F57-M245 HydrophobicContact CG-CE 3.76Å; F57-M245 HydrophobicContact CZ-CE 3.35Å; F68-M245 HydrophobicContact CZ-CE 4.05Å; K241-M245 WeakPolarHBondContact O-CG 3.4Å; K241-M245 PolarHBondContact O-N 2.87Å; L242-M245 HydrophobicContact CD2-SD 3.98Å; L242-M245 PolarHBondContact O-N 2.78Å; M245-S247 PolarHBondContact O-N 3.13Å; M245-G248 PolarHBondContact O-N 2.61Å; M245-G248 VanDerWaalsContact O-N 3.11Å; M245-V251 HydrophobicContact CE-CB 4.49Å; M245-V251 HydrophobicContact CE-CG1 4.4Å; M245-V251 HydrophobicContact CE-CG2 4.05Å; M245-V251 HydrophobicContact CG-CB 4.39Å; M245-V251 HydrophobicContact CG-CG1 3.74Å; M245-V251 HydrophobicContact CG-CG2 3.82Å; M245-Y261 HydrophobicContact CE-CD1 3.84Å; M245-Y261 HydrophobicContact CE-CE1 3.92Å; M245-Y261 HydrophobicContact SD-CD1 3.95Å; M245-Y261 HydrophobicContact SD-CE1 4.4Å; M245-L264 HydrophobicContact CB-CB 4.33Å; M245-L264 HydrophobicContact SD-CD1 3.94Å
246	N	98.3	Very high	96.3	Very high	23 Å²	23	43.3 Å²	43.3	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-27.1	-179.8	-171.5	53.7	0	0	0	113.4	L242 T243 Q244 G248 L264 N266 S267 M268 L270	L242-N246 WeakPolarHBondContact O-CB 3.38Å; L242-N246 PolarHBondContact O-N 3.25Å; T243-N246 PolarHBondContact O-N 3.26Å; Q244-N246 VanDerWaalsContact C-N 3.31Å; Q244-N246 PolarHBondContact O-N 2.87Å; N246-G248 VanDerWaalsContact C-N 3.33Å; N246-L264 WeakPolarHBondContact CA-O 3.39Å; N246-N266 PolarHBondContact O-N 2.82Å; N246-N266 VanDerWaalsContact OD1-CA 3.32Å; N246-N266 WeakPolarHBondContact OD1-CA 3.4Å; N246-N266 PolarHBondContact OD1-N 3.13Å; N246-S267 PolarHBondContact OD1-N 2.9Å; N246-M268 HydrophobicContact CB-CB 4.16Å; N246-M268 HydrophobicContact CB-CG 4.28Å; N246-M268 HydrophobicContact CB-SD 4.24Å; N246-M268 PolarHBondContact ND2-O 3.24Å; N246-M268 PolarHBondContact OD1-N 2.84Å; N246-L270 HydrophobicContact CB-CD1 4.3Å; N246-L270 WeakPolarHBondContact ND2-CD1 3.46Å
247	S	98.1	Very high	96	Very high	73 Å²	73	43.3 Å²	43.3	51%	0.51	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.6	177.1	67.5	0	0	0	0	114.6	T243 Q244 M245 V249	T243-S247 WeakPolarHBondContact O-CB 3.45Å; T243-S247 PolarHBondContact O-N 3.14Å; T243-S247 PolarHBondContact O-OG 3.3Å; Q244-S247 PolarHBondContact O-N 3.06Å; Q244-S247 VanDerWaalsContact O-N 3.07Å; Q244-S247 PolarHBondContact O-OG 3.5Å; M245-S247 PolarHBondContact O-N 3.13Å; S247-V249 VanDerWaalsContact C-N 3.28Å; S247-V249 PolarHBondContact O-N 3.42Å; S247-V249 WeakPolarHBondContact OG-CG2 3.26Å
248	G	96.1	Very high	95.7	Very high	37 Å²	37	46.3 Å²	46.3	38%	0.381	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	9.7	-176.9	0	0	0	0	0	114	Q244 M245 N246 A250	Q244-G248 PolarHBondContact O-N 3.45Å; M245-G248 PolarHBondContact O-N 2.61Å; M245-G248 VanDerWaalsContact O-N 3.11Å; N246-G248 VanDerWaalsContact C-N 3.33Å; G248-A250 PolarHBondContact O-N 3.3Å
249	V	95.5	Very high	95.5	Very high	75 Å²	75	46.7 Å²	46.7	46%	0.455	28%	0.279	S	S	.	.			trans	-70.1	125.4	173.1	173.5	0	0	0	0	108.4	Q244 S247 V251	Q244-V249 HydrophobicContact CB-CB 4.2Å; Q244-V249 HydrophobicContact CB-CG1 4.44Å; Q244-V249 PolarHBondContact O-N 2.95Å; Q244-V249 VanDerWaalsContact O-N 3.13Å; S247-V249 VanDerWaalsContact C-N 3.28Å; S247-V249 PolarHBondContact O-N 3.42Å; S247-V249 WeakPolarHBondContact OG-CG2 3.26Å; V249-V251 PolarHBondContact O-N 3.22Å
250	A	90.8	Very high	95.3	Very high	98 Å²	98	50.7 Å²	50.7	81%	0.81	30%	0.3	S	S	*	.			trans	-58.3	122.3	177.3	0	0	0	0	0	110.6	G248	G248-A250 PolarHBondContact O-N 3.3Å
251	V	91.9	Very high	95.1	Very high	25 Å²	25	49.4 Å²	49.4	15%	0.152	29%	0.292	C	S	.	.			trans	-104.9	134.4	175.2	-68	0	0	0	0	109.9	F57 M59 Q244 M245 V249 Y261	F57-V251 HydrophobicContact CE2-CB 3.97Å; F57-V251 HydrophobicContact CE2-CG2 3.95Å; F57-V251 HydrophobicContact CZ-CB 4.07Å; F57-V251 HydrophobicContact CZ-CG1 4.49Å; F57-V251 HydrophobicContact CZ-CG2 4.47Å; M59-V251 HydrophobicContact SD-CB 4.28Å; M59-V251 HydrophobicContact SD-CG1 4.38Å; Q244-V251 HydrophobicContact CB-CG1 4.34Å; M245-V251 HydrophobicContact CE-CB 4.49Å; M245-V251 HydrophobicContact CE-CG1 4.4Å; M245-V251 HydrophobicContact CE-CG2 4.05Å; M245-V251 HydrophobicContact CG-CB 4.39Å; M245-V251 HydrophobicContact CG-CG1 3.74Å; M245-V251 HydrophobicContact CG-CG2 3.82Å; V249-V251 PolarHBondContact O-N 3.22Å; V251-Y261 HydrophobicContact CG2-CD1 4.1Å; V251-Y261 HydrophobicContact CG2-CG 3.89Å
252	Q	91	Very high	95	Very high	154 Å²	154	53.2 Å²	53.2	72%	0.72	32%	0.317	S	S	*	.			trans	-99.9	97	177.7	-171.5	178.4	3.1	0	0	109.4	V254	Q252-V254 PolarHBondContact O-N 3.44Å
253	N	95.3	Very high	94.8	Very high	14 Å²	14	55.6 Å²	55.6	8%	0.075	33%	0.331	C	S	.	.			trans	-73.3	112.1	172.6	-174.3	10.9	0	0	0	109.9	D56 F57 M58 L255 Q256 T257 Y261	D56-N253 PolarHBondContact O-ND2 3.34Å; F57-N253 HydrophobicContact CD2-CB 3.79Å; F57-N253 HydrophobicContact CE2-CB 3.98Å; M58-N253 PolarHBondContact N-OD1 3.3Å; M58-N253 PolarHBondContact O-OD1 2.8Å; N253-L255 PolarHBondContact O-N 3.28Å; N253-L255 VanDerWaalsContact O-N 3.12Å; N253-L255 WeakPolarHBondContact OD1-CB 3.11Å; N253-L255 PolarHBondContact OD1-N 3.03Å; N253-L255 VanDerWaalsContact OD1-N 3.12Å; N253-Q256 PolarHBondContact O-N 2.97Å; N253-T257 PolarHBondContact ND2-OG1 2.68Å; N253-Y261 HydrophobicContact CB-CE2 3.89Å; N253-Y261 PolarHBondContact ND2-OH 3.05Å
254	V	94.9	Very high	94.7	Very high	25 Å²	25	53.7 Å²	53.7	15%	0.152	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.6	179.7	178.9	0	0	0	0	111.6	M58 H61 F179 L204 Q252 Q256	M58-V254 PolarHBondContact O-N 3.15Å; H61-V254 HydrophobicContact CB-CB 4.28Å; H61-V254 HydrophobicContact CB-CG1 3.74Å; H61-V254 HydrophobicContact CB-CG2 3.67Å; F179-V254 HydrophobicContact CD2-CG1 3.69Å; F179-V254 HydrophobicContact CE2-CG1 3.83Å; F179-V254 HydrophobicContact CG-CG1 4.4Å; L204-V254 HydrophobicContact CD1-CG1 3.94Å; Q252-V254 PolarHBondContact O-N 3.44Å; V254-Q256 VanDerWaalsContact C-N 3.28Å; V254-Q256 PolarHBondContact O-N 2.69Å
255	L	93.9	Very high	94.7	Very high	18 Å²	18	56.1 Å²	56.1	9%	0.094	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.8	176.6	-54.9	177.9	0	0	0	113.6	D56 M58 F67 F177 F179 R201 N253 T257	D56-L255 HydrophobicContact CB-CD1 3.72Å; M58-L255 HydrophobicContact CB-CD1 3.99Å; M58-L255 HydrophobicContact CB-CD2 4.26Å; M58-L255 HydrophobicContact CB-CG 3.8Å; M58-L255 HydrophobicContact CE-CD2 4.34Å; M58-L255 HydrophobicContact SD-CD2 4.47Å; F67-L255 HydrophobicContact CD2-CD1 4.4Å; F67-L255 HydrophobicContact CE2-CD1 3.69Å; F67-L255 HydrophobicContact CZ-CD1 4.42Å; F177-L255 HydrophobicContact CE2-CD2 3.96Å; F177-L255 HydrophobicContact CZ-CD2 4.08Å; F179-L255 HydrophobicContact CE2-CD2 3.95Å; F179-L255 HydrophobicContact CZ-CD2 4.24Å; R201-L255 PolarHBondContact NH2-O 3.11Å; N253-L255 PolarHBondContact O-N 3.28Å; N253-L255 VanDerWaalsContact O-N 3.12Å; N253-L255 WeakPolarHBondContact OD1-CB 3.11Å; N253-L255 PolarHBondContact OD1-N 3.03Å; N253-L255 VanDerWaalsContact OD1-N 3.12Å; L255-T257 HydrophobicContact CB-CG2 4.19Å; L255-T257 PolarHBondContact O-N 3.21Å
256	Q	91.3	Very high	94.7	Very high	109 Å²	109	60.6 Å²	60.6	51%	0.509	36%	0.355	S	S	.	.			trans	49.9	42.5	178.6	-57.1	175.7	2.2	0	0	112.7	N253 V254	N253-Q256 PolarHBondContact O-N 2.97Å; V254-Q256 VanDerWaalsContact C-N 3.28Å; V254-Q256 PolarHBondContact O-N 2.69Å
257	T	91.9	Very high	94.7	Very high	26 Å²	26	60 Å²	60	16%	0.16	35%	0.352	C	S	.	.			trans	-63.5	145.6	175.4	55.1	0	0	0	0	110.6	T55 D56 N253 L255 F259 Y261	T55-T257 PolarHBondContact OG1-OG1 3.14Å; D56-T257 VanDerWaalsContact O-CG2 3.28Å; D56-T257 WeakPolarHBondContact O-CG2 3.41Å; N253-T257 PolarHBondContact ND2-OG1 2.68Å; L255-T257 HydrophobicContact CB-CG2 4.19Å; L255-T257 PolarHBondContact O-N 3.21Å; T257-F259 PolarHBondContact O-N 3.45Å; T257-F259 VanDerWaalsContact O-N 3.11Å; T257-Y261 PolarHBondContact OG1-OH 3.38Å
258	P	93.1	Very high	94.7	Very high	115 Å²	115	56.7 Å²	56.7	75%	0.747	33%	0.329	S	S	*	.	S	Bend	trans	-61.6	-14	174.4	-23.8	33.2	0	0	0	115.4	D124 D260	D124-P258 HydrophobicContact CB-CB 4.44Å; D124-P258 WeakPolarHBondContact OD2-CD 3.15Å; P258-D260 PolarHBondContact O-N 2.88Å
259	F	94.7	Very high	94.8	Very high	9 Å²	9	56.8 Å²	56.8	4%	0.039	32%	0.32	C	S	.	.			trans	-58.7	127.8	179.9	-177.8	-100.5	0	0	0	112.6	T55 Y72 D124 F127 T257 Y261 L264	T55-F259 HydrophobicContact CG2-CB 4.15Å; T55-F259 HydrophobicContact CG2-CD1 3.84Å; T55-F259 HydrophobicContact CG2-CD2 4.46Å; T55-F259 HydrophobicContact CG2-CE1 4.35Å; T55-F259 HydrophobicContact CG2-CG 3.88Å; Y72-F259 HydrophobicContact CD2-CE2 4.44Å; Y72-F259 HydrophobicContact CE1-CD2 4.37Å; Y72-F259 AromaticContact CE1-CE2 3.9Å; Y72-F259 HydrophobicContact CE1-CE2 3.9Å; Y72-F259 HydrophobicContact CE1-CZ 4.19Å; Y72-F259 HydrophobicContact CE2-CD2 4.37Å; Y72-F259 AromaticContact CE2-CE2 3.56Å; Y72-F259 HydrophobicContact CE2-CE2 3.56Å; Y72-F259 HydrophobicContact CE2-CZ 4.23Å; Y72-F259 AromaticContact CZ-CD2 3.71Å; Y72-F259 AromaticContact CZ-CE2 3.24Å; Y72-F259 AromaticContact CZ-CZ 3.94Å; Y72-F259 WeakPolarHBondContact OH-CD2 3.38Å; Y72-F259 WeakPolarHBondContact OH-CE2 3.22Å; D124-F259 HydrophobicContact CB-CB 4.16Å; F127-F259 HydrophobicContact CB-CE2 4.25Å; F127-F259 HydrophobicContact CB-CZ 4.14Å; T257-F259 PolarHBondContact O-N 3.45Å; T257-F259 VanDerWaalsContact O-N 3.11Å; F259-Y261 HydrophobicContact CB-CE2 4.43Å; F259-Y261 AromaticContact CD1-CD1 3.83Å; F259-Y261 HydrophobicContact CD1-CD1 3.83Å; F259-Y261 AromaticContact CD1-CD2 3.98Å; F259-Y261 HydrophobicContact CD1-CD2 3.98Å; F259-Y261 AromaticContact CD1-CE1 3.75Å; F259-Y261 HydrophobicContact CD1-CE1 3.75Å; F259-Y261 AromaticContact CD1-CE2 3.88Å; F259-Y261 HydrophobicContact CD1-CE2 3.88Å; F259-Y261 AromaticContact CD1-CG 3.93Å; F259-Y261 HydrophobicContact CD1-CG 3.93Å; F259-Y261 AromaticContact CD1-CZ 3.75Å; F259-Y261 AromaticContact CE1-CD1 3.88Å; F259-Y261 HydrophobicContact CE1-CD1 3.88Å; F259-Y261 HydrophobicContact CE1-CE1 4.06Å; F259-Y261 HydrophobicContact CE1-CG 4.19Å; F259-Y261 VanDerWaalsContact O-CD2 3.31Å; F259-Y261 WeakPolarHBondContact O-CD2 3.13Å; F259-Y261 PolarHBondContact O-N 3.07Å; F259-L264 HydrophobicContact CE1-CD1 3.84Å; F259-L264 HydrophobicContact CE1-CG 4.12Å; F259-L264 HydrophobicContact CZ-CD1 4.21Å; F259-L264 HydrophobicContact CZ-CD2 4.36Å; F259-L264 HydrophobicContact CZ-CG 4.14Å
260	D	94.4	Very high	94.9	Very high	84 Å²	84	55.4 Å²	55.4	45%	0.449	31%	0.31	S	S	.	.			trans	-84.2	98.1	177.7	-179.1	5.3	0	0	0	111.2	P258 T262 T263	P258-D260 PolarHBondContact O-N 2.88Å; D260-T262 PolarHBondContact O-N 2.76Å; D260-T262 WeakPolarHBondContact OD1-CB 3.41Å; D260-T262 WeakPolarHBondContact OD1-CG2 3.29Å; D260-T262 PolarHBondContact OD1-N 3.37Å; D260-T262 PolarHBondContact OD1-OG1 3.13Å; D260-T262 PolarHBondContact OD2-OG1 2.98Å; D260-T263 HydrophobicContact CB-CG2 4.11Å; D260-T263 WeakPolarHBondContact O-CB 3.11Å; D260-T263 PolarHBondContact O-N 3.27Å; D260-T263 PolarHBondContact O-OG1 3.44Å
261	Y	95.4	Very high	95.3	Very high	26 Å²	26	55.4 Å²	55.4	10%	0.102	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-65.1	-17.6	179.2	-68.6	-87.4	0	0	0	113.9	T55 F57 M245 V251 N253 T257 F259 T263 L264	T55-Y261 HydrophobicContact CG2-CE1 4.4Å; F57-Y261 HydrophobicContact CB-CE1 4.33Å; F57-Y261 HydrophobicContact CD2-CD1 4.28Å; F57-Y261 AromaticContact CD2-CE1 3.49Å; F57-Y261 HydrophobicContact CD2-CE1 3.49Å; F57-Y261 VanDerWaalsContact CD2-CE1 3.49Å; F57-Y261 HydrophobicContact CD2-CE2 4.4Å; F57-Y261 AromaticContact CD2-CZ 3.59Å; F57-Y261 HydrophobicContact CE2-CE1 4.19Å; F57-Y261 HydrophobicContact CG-CE1 4.24Å; M245-Y261 HydrophobicContact CE-CD1 3.84Å; M245-Y261 HydrophobicContact CE-CE1 3.92Å; M245-Y261 HydrophobicContact SD-CD1 3.95Å; M245-Y261 HydrophobicContact SD-CE1 4.4Å; V251-Y261 HydrophobicContact CG2-CD1 4.1Å; V251-Y261 HydrophobicContact CG2-CG 3.89Å; N253-Y261 HydrophobicContact CB-CE2 3.89Å; N253-Y261 PolarHBondContact ND2-OH 3.05Å; T257-Y261 PolarHBondContact OG1-OH 3.38Å; F259-Y261 HydrophobicContact CB-CE2 4.43Å; F259-Y261 AromaticContact CD1-CD1 3.83Å; F259-Y261 HydrophobicContact CD1-CD1 3.83Å; F259-Y261 AromaticContact CD1-CD2 3.98Å; F259-Y261 HydrophobicContact CD1-CD2 3.98Å; F259-Y261 AromaticContact CD1-CE1 3.75Å; F259-Y261 HydrophobicContact CD1-CE1 3.75Å; F259-Y261 AromaticContact CD1-CE2 3.88Å; F259-Y261 HydrophobicContact CD1-CE2 3.88Å; F259-Y261 AromaticContact CD1-CG 3.93Å; F259-Y261 HydrophobicContact CD1-CG 3.93Å; F259-Y261 AromaticContact CD1-CZ 3.75Å; F259-Y261 AromaticContact CE1-CD1 3.88Å; F259-Y261 HydrophobicContact CE1-CD1 3.88Å; F259-Y261 HydrophobicContact CE1-CE1 4.06Å; F259-Y261 HydrophobicContact CE1-CG 4.19Å; F259-Y261 VanDerWaalsContact O-CD2 3.31Å; F259-Y261 WeakPolarHBondContact O-CD2 3.13Å; F259-Y261 PolarHBondContact O-N 3.07Å; Y261-T263 PolarHBondContact O-N 2.98Å; Y261-L264 HydrophobicContact CD1-CD1 4.23Å; Y261-L264 WeakPolarHBondContact O-CB 3.19Å; Y261-L264 PolarHBondContact O-N 3.03Å; Y261-L264 VanDerWaalsContact O-N 3.09Å
262	T	94.6	Very high	95.6	Very high	97 Å²	97	57.1 Å²	57.1	60%	0.595	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-66.9	-24.7	176.9	70.9	0	0	0	0	111.8	D260 L264 E265	D260-T262 PolarHBondContact O-N 2.76Å; D260-T262 WeakPolarHBondContact OD1-CB 3.41Å; D260-T262 WeakPolarHBondContact OD1-CG2 3.29Å; D260-T262 PolarHBondContact OD1-N 3.37Å; D260-T262 PolarHBondContact OD1-OG1 3.13Å; D260-T262 PolarHBondContact OD2-OG1 2.98Å; T262-L264 PolarHBondContact O-N 2.87Å; T262-L264 VanDerWaalsContact O-N 3.14Å; T262-E265 VanDerWaalsContact O-CB 3.31Å; T262-E265 WeakPolarHBondContact O-CB 3.45Å; T262-E265 PolarHBondContact O-N 3.12Å
263	T	95	Very high	96	Very high	50 Å²	50	49.9 Å²	49.9	31%	0.307	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-65.1	-13.9	173.6	65.6	0	0	0	0	113.6	F127 D260 Y261	F127-T263 VanDerWaalsContact CD1-O 3.32Å; F127-T263 WeakPolarHBondContact CD1-O 3.44Å; D260-T263 HydrophobicContact CB-CG2 4.11Å; D260-T263 WeakPolarHBondContact O-CB 3.11Å; D260-T263 PolarHBondContact O-N 3.27Å; D260-T263 PolarHBondContact O-OG1 3.44Å; Y261-T263 PolarHBondContact O-N 2.98Å
264	L	97.2	Very high	96.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-89	-3.7	174.7	-63.3	178.4	0	0	0	113.5	L70 F127 I162 M245 N246 F259 Y261 T262 N266 S267 M268	L70-L264 HydrophobicContact CD2-CD1 3.8Å; F127-L264 HydrophobicContact CB-CD2 4.25Å; F127-L264 HydrophobicContact CD1-CD2 4.24Å; F127-L264 HydrophobicContact CD2-CD2 3.83Å; F127-L264 HydrophobicContact CE2-CD2 4.24Å; F127-L264 HydrophobicContact CG-CD2 3.82Å; I162-L264 HydrophobicContact CD1-CD2 3.91Å; M245-L264 HydrophobicContact CB-CB 4.33Å; M245-L264 HydrophobicContact SD-CD1 3.94Å; N246-L264 WeakPolarHBondContact CA-O 3.39Å; F259-L264 HydrophobicContact CE1-CD1 3.84Å; F259-L264 HydrophobicContact CE1-CG 4.12Å; F259-L264 HydrophobicContact CZ-CD1 4.21Å; F259-L264 HydrophobicContact CZ-CD2 4.36Å; F259-L264 HydrophobicContact CZ-CG 4.14Å; Y261-L264 HydrophobicContact CD1-CD1 4.23Å; Y261-L264 WeakPolarHBondContact O-CB 3.19Å; Y261-L264 PolarHBondContact O-N 3.03Å; Y261-L264 VanDerWaalsContact O-N 3.09Å; T262-L264 PolarHBondContact O-N 2.87Å; T262-L264 VanDerWaalsContact O-N 3.14Å; L264-N266 PolarHBondContact O-N 3.49Å; L264-S267 WeakPolarHBondContact CA-OG 3.33Å; L264-S267 PolarHBondContact O-N 3.25Å; L264-S267 PolarHBondContact O-OG 3.26Å; L264-M268 HydrophobicContact CB-CE 4.13Å; L264-M268 HydrophobicContact CD1-CE 4.06Å; L264-M268 HydrophobicContact CD2-CE 4.23Å; L264-M268 HydrophobicContact CG-CE 4.39Å
265	E	97.3	Very high	96.3	Very high	117 Å²	117	48 Å²	48	55%	0.547	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	128.7	174.4	-175.8	177.8	175.4	0	0	110.2	T262 S267	T262-E265 VanDerWaalsContact O-CB 3.31Å; T262-E265 WeakPolarHBondContact O-CB 3.45Å; T262-E265 PolarHBondContact O-N 3.12Å; E265-S267 PolarHBondContact O-N 3.09Å
266	N	97.6	Very high	96.6	Very high	98 Å²	98	47.2 Å²	47.2	52%	0.524	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	24.1	179.4	-169.3	44.4	0	0	0	114.2	K132 N246 L264	K132-N266 VanDerWaalsContact CE-O 3.31Å; K132-N266 WeakPolarHBondContact CE-O 3.35Å; K132-N266 WeakPolarHBondContact CE-OD1 3.48Å; K132-N266 PolarHBondContact NZ-OD1 2.92Å; N246-N266 PolarHBondContact O-N 2.82Å; N246-N266 VanDerWaalsContact OD1-CA 3.32Å; N246-N266 WeakPolarHBondContact OD1-CA 3.4Å; N246-N266 PolarHBondContact OD1-N 3.13Å; L264-N266 PolarHBondContact O-N 3.49Å
267	S	98.1	Very high	96.9	Very high	10 Å²	10	42 Å²	42	7%	0.07	23%	0.234	C	C	.	.			trans	-96.4	-12.1	-177.5	78.8	0	0	0	0	114.5	F127 K132 C133 N246 L264 E265	F127-S267 VanDerWaalsContact CE1-CB 3.47Å; K132-S267 CarbonylContact C-O 3.57Å; K132-S267 VanDerWaalsContact CA-O 3.26Å; K132-S267 WeakPolarHBondContact CA-O 3.43Å; C133-S267 PolarHBondContact N-O 3.27Å; N246-S267 PolarHBondContact OD1-N 2.9Å; L264-S267 WeakPolarHBondContact CA-OG 3.33Å; L264-S267 PolarHBondContact O-N 3.25Å; L264-S267 PolarHBondContact O-OG 3.26Å; E265-S267 PolarHBondContact O-N 3.09Å
268	M	98.5	Very high	97.2	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.4	-174.6	-56.5	-178.5	-161.2	0	0	112.1	C133 V135 I162 L242 N246 L264 L270	C133-M268 WeakPolarHBondContact O-CA 3.49Å; V135-M268 HydrophobicContact CG2-CB 3.83Å; V135-M268 HydrophobicContact CG2-CG 4.02Å; V135-M268 HydrophobicContact CG2-SD 3.86Å; I162-M268 HydrophobicContact CD1-CE 3.95Å; I162-M268 HydrophobicContact CD1-CG 3.9Å; I162-M268 HydrophobicContact CD1-SD 4.49Å; I162-M268 HydrophobicContact CG2-CE 4.29Å; L242-M268 HydrophobicContact CB-CE 4.31Å; L242-M268 HydrophobicContact CB-SD 3.86Å; L242-M268 HydrophobicContact CD2-CE 4.01Å; L242-M268 HydrophobicContact CD2-SD 4.49Å; N246-M268 HydrophobicContact CB-CB 4.16Å; N246-M268 HydrophobicContact CB-CG 4.28Å; N246-M268 HydrophobicContact CB-SD 4.24Å; N246-M268 PolarHBondContact ND2-O 3.24Å; N246-M268 PolarHBondContact OD1-N 2.84Å; L264-M268 HydrophobicContact CB-CE 4.13Å; L264-M268 HydrophobicContact CD1-CE 4.06Å; L264-M268 HydrophobicContact CD2-CE 4.23Å; L264-M268 HydrophobicContact CG-CE 4.39Å; M268-L270 HydrophobicContact CB-CD2 3.99Å; M268-L270 HydrophobicContact CB-CG 4.31Å; M268-L270 PolarHBondContact O-N 3.3Å; M268-L270 HydrophobicContact SD-CD2 4.42Å
269	D	98.3	Very high	97.5	Very high	39 Å²	39	35.9 Å²	35.9	21%	0.209	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	88.2	164.9	-171.6	-11.9	0	0	0	109.5	K132 C133 C271 R272	K132-D269 HydrophobicContact CB-CB 4Å; C133-D269 PolarHBondContact O-N 2.9Å; D269-C271 PolarHBondContact O-N 3.15Å; D269-C271 VanDerWaalsContact OD1-CB 3.31Å; D269-C271 WeakPolarHBondContact OD1-CB 3.15Å; D269-C271 PolarHBondContact OD1-N 3.49Å; D269-R272 HydrophobicContact CB-CB 4.39Å; D269-R272 HydrophobicContact CB-CG 4.4Å; D269-R272 CarbonylContact O-C 3.56Å; D269-R272 PolarHBondContact O-N 3.23Å; D269-R272 WeakPolarHBondContact OD2-CD 3.4Å; D269-R272 WeakPolarHBondContact OD2-CG 3.36Å; D269-R272 IonicContact OD2-CZ 3.72Å; D269-R272 IonicContact OD2-NE 3.75Å; D269-R272 PolarHBondContact OD2-NE 3.1Å
270	L	98	Very high	97.7	Very high	47 Å²	47	35.5 Å²	35.5	25%	0.246	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	-12.7	-179.1	-59.9	175.5	0	0	0	113.4	V135 T243 N246 M268 R272 T273	V135-L270 HydrophobicContact CG2-CD2 4.14Å; T243-L270 HydrophobicContact CG2-CD1 3.79Å; N246-L270 HydrophobicContact CB-CD1 4.3Å; N246-L270 WeakPolarHBondContact ND2-CD1 3.46Å; M268-L270 HydrophobicContact CB-CD2 3.99Å; M268-L270 HydrophobicContact CB-CG 4.31Å; M268-L270 PolarHBondContact O-N 3.3Å; M268-L270 HydrophobicContact SD-CD2 4.42Å; L270-R272 PolarHBondContact O-N 3.05Å; L270-T273 PolarHBondContact O-OG1 3.16Å
271	C	98.1	Very high	97.9	Very high	98 Å²	98	31.5 Å²	31.5	66%	0.662	17%	0.171	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	-16.9	170.6	-64.1	0	0	0	0	111.7	D269 K296	D269-C271 PolarHBondContact O-N 3.15Å; D269-C271 VanDerWaalsContact OD1-CB 3.31Å; D269-C271 WeakPolarHBondContact OD1-CB 3.15Å; D269-C271 PolarHBondContact OD1-N 3.49Å; C271-K296 VanDerWaalsContact O-CG 3.32Å; C271-K296 WeakPolarHBondContact O-CG 3.46Å
272	R	98.6	Very high	98.1	Very high	61 Å²	61	30.2 Å²	30.2	23%	0.23	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	63	-178.1	-58.5	-179.6	-171.8	-133.7	-10.6	110.3	P134 V135 D269 L270 L402 H403	P134-R272 WeakPolarHBondContact CA-O 3.01Å; P134-R272 HydrophobicContact CB-CB 3.88Å; P134-R272 WeakPolarHBondContact CB-O 3.41Å; V135-R272 PolarHBondContact N-O 2.91Å; D269-R272 HydrophobicContact CB-CB 4.39Å; D269-R272 HydrophobicContact CB-CG 4.4Å; D269-R272 CarbonylContact O-C 3.56Å; D269-R272 PolarHBondContact O-N 3.23Å; D269-R272 WeakPolarHBondContact OD2-CD 3.4Å; D269-R272 WeakPolarHBondContact OD2-CG 3.36Å; D269-R272 IonicContact OD2-CZ 3.72Å; D269-R272 IonicContact OD2-NE 3.75Å; D269-R272 PolarHBondContact OD2-NE 3.1Å; L270-R272 PolarHBondContact O-N 3.05Å; R272-L402 HydrophobicContact CB-CB 4.19Å; R272-L402 HydrophobicContact CG-CB 4.5Å; R272-H403 PolarHBondContact NH1-O 3.41Å; R272-H403 PolarHBondContact NH2-O 3.4Å
273	T	98.8	Very high	98.3	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.9	-178.3	-53.8	0	0	0	0	111.2	V135 L239 L270 F295 K296	V135-T273 HydrophobicContact CB-CG2 4.27Å; V135-T273 HydrophobicContact CG1-CG2 4.26Å; V135-T273 CarbonylContact O-C 3.56Å; V135-T273 VanDerWaalsContact O-CA 3.31Å; V135-T273 WeakPolarHBondContact O-CA 3.33Å; L239-T273 HydrophobicContact CD1-CG2 3.59Å; L239-T273 HydrophobicContact CD2-CG2 3.98Å; L239-T273 HydrophobicContact CG-CG2 4.43Å; L270-T273 PolarHBondContact O-OG1 3.16Å; T273-F295 HydrophobicContact CG2-CD1 3.7Å; T273-F295 HydrophobicContact CG2-CE1 3.83Å; T273-K296 PolarHBondContact O-N 3.31Å
274	A	98.9	Very high	98.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	162.7	174.2	0	0	0	0	0	112.2	V135 V136 I137 C297 L398 L402	V135-A274 PolarHBondContact O-N 2.68Å; V136-A274 WeakPolarHBondContact CA-O 3.34Å; V136-A274 HydrophobicContact CG2-CB 4.48Å; I137-A274 PolarHBondContact N-O 2.95Å; A274-C297 WeakPolarHBondContact CA-O 2.83Å; A274-L398 HydrophobicContact CB-CD2 3.52Å; A274-L402 HydrophobicContact CB-CD1 4.18Å
275	V	98.9	Very high	98.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131	172.2	61.1	0	0	0	0	110	I137 V285 L289 F295 C297 G298 V299	I137-V275 HydrophobicContact CB-CG2 4.46Å; I137-V275 CarbonylContact O-C 3.47Å; I137-V275 WeakPolarHBondContact O-CA 3.4Å; V275-V285 HydrophobicContact CG1-CB 4.41Å; V275-V285 HydrophobicContact CG1-CG1 4.13Å; V275-V285 HydrophobicContact CG1-CG2 4.39Å; V275-V285 HydrophobicContact CG2-CG2 4.06Å; V275-L289 HydrophobicContact CG1-CD2 3.88Å; V275-L289 HydrophobicContact CG1-CG 4.02Å; V275-F295 HydrophobicContact CB-CD1 3.83Å; V275-F295 HydrophobicContact CB-CE1 3.96Å; V275-F295 HydrophobicContact CB-CG 4.18Å; V275-F295 HydrophobicContact CB-CZ 4.41Å; V275-F295 HydrophobicContact CG1-CB 4.34Å; V275-F295 HydrophobicContact CG1-CD1 4.23Å; V275-F295 HydrophobicContact CG1-CD2 4.47Å; V275-F295 HydrophobicContact CG1-CG 4.1Å; V275-C297 PolarHBondContact N-O 3.35Å; V275-G298 CarbonylContact O-C 3.57Å; V275-G298 WeakPolarHBondContact O-CA 3.18Å; V275-V299 PolarHBondContact O-N 2.7Å
276	I	98.9	Very high	98.6	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	-179.5	-56.5	-175.6	0	0	0	108.4	V136 I137 F138 S139 L156 V285 V299 L301 T394 L398	V136-I276 HydrophobicContact CG1-CB 4.17Å; V136-I276 HydrophobicContact CG1-CD1 3.76Å; V136-I276 HydrophobicContact CG1-CG1 3.79Å; V136-I276 HydrophobicContact CG2-CD1 4.5Å; I137-I276 PolarHBondContact O-N 3.42Å; F138-I276 CarbonylContact C-O 3.54Å; F138-I276 VanDerWaalsContact CA-O 3.25Å; F138-I276 WeakPolarHBondContact CA-O 3.12Å; F138-I276 HydrophobicContact CD2-CB 3.98Å; F138-I276 HydrophobicContact CD2-CG2 3.81Å; F138-I276 HydrophobicContact CE2-CB 4.45Å; F138-I276 HydrophobicContact CE2-CG2 3.78Å; S139-I276 PolarHBondContact N-O 3.21Å; L156-I276 HydrophobicContact CD1-CD1 3.89Å; I276-V285 VanDerWaalsContact C-CG2 3.4Å; I276-V299 VanDerWaalsContact CA-O 3.3Å; I276-V299 WeakPolarHBondContact CA-O 3.4Å; I276-V299 HydrophobicContact CD1-CB 4.38Å; I276-V299 HydrophobicContact CD1-CG2 4.47Å; I276-V299 HydrophobicContact CG1-CB 4.02Å; I276-V299 HydrophobicContact CG1-CG2 4.37Å; I276-V299 HydrophobicContact CG2-CB 4.2Å; I276-L301 HydrophobicContact CG2-CD1 4.17Å; I276-L301 HydrophobicContact CG2-CG 4.33Å; I276-T394 HydrophobicContact CD1-CG2 3.72Å; I276-L398 HydrophobicContact CD1-CD1 4.22Å
277	G	98.9	Very high	98.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	155	174.3	0	0	0	0	0	113.9	S139 G281 G282 V285 V299 L301	S139-G277 WeakPolarHBondContact O-CA 3.37Å; G277-G281 VanDerWaalsContact C-C 3.49Å; G277-G282 WeakPolarHBondContact O-CA 3.38Å; G277-G282 PolarHBondContact O-N 2.96Å; G277-V285 VanDerWaalsContact N-CG2 3.26Å; G277-V299 PolarHBondContact N-O 3.28Å; G277-V299 VanDerWaalsContact N-O 3.08Å; G277-L301 PolarHBondContact O-N 3.18Å
278	H	98.8	Very high	98.7	Very high	3 Å²	3	13 Å²	13	1%	0.014	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.9	-177.3	172.4	-112	0	0	0	112.4	S139 G141 Y149 F280 G281 L301 H357 F360	S139-H278 PolarHBondContact O-N 3.05Å; S139-H278 VanDerWaalsContact O-N 3.13Å; G141-H278 WeakPolarHBondContact CA-O 3.33Å; G141-H278 PolarHBondContact N-O 3.05Å; Y149-H278 HydrophobicContact CD1-CB 4.25Å; Y149-H278 HydrophobicContact CE1-CB 3.43Å; Y149-H278 VanDerWaalsContact CE1-CB 3.43Å; Y149-H278 AromaticContact CE1-CG 3.59Å; Y149-H278 AromaticContact CE1-ND1 3.41Å; Y149-H278 WeakPolarHBondContact CE1-ND1 3.23Å; Y149-H278 AromaticContact CZ-ND1 3.54Å; Y149-H278 PolarHBondContact OH-ND1 3.37Å; H278-F280 PolarHBondContact O-N 3.38Å; H278-F280 VanDerWaalsContact O-N 3.11Å; H278-G281 WeakPolarHBondContact O-CA 3.46Å; H278-G281 PolarHBondContact O-N 3.43Å; H278-L301 CarbonylContact C-O 3.56Å; H278-L301 VanDerWaalsContact CA-O 3.26Å; H278-L301 WeakPolarHBondContact CA-O 3.43Å; H278-L301 HydrophobicContact CB-CB 4.14Å; H278-L301 PolarHBondContact CD2-O 3.37Å; H278-L301 VanDerWaalsContact CD2-O 3.26Å; H278-H357 AromaticContact CE1-CE1 3.64Å; H278-H357 AromaticContact CE1-NE2 3.67Å; H278-H357 AromaticContact NE2-CE1 3.32Å; H278-H357 PolarHBondContact NE2-CE1 2.9Å; H278-H357 VanDerWaalsContact NE2-CE1 3.32Å; H278-H357 AromaticContact NE2-ND1 3.55Å; H278-H357 AromaticContact NE2-NE2 3.83Å; H278-H357 PolarHBondContact NE2-O 3.21Å; H278-F360 AromaticContact CD2-CD2 3.7Å; H278-F360 AromaticContact CD2-CG 3.82Å; H278-F360 AromaticContact NE2-CD2 3.65Å
279	S	98.4	Very high	98.7	Very high	10 Å²	10	13 Å²	13	7%	0.07	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	-113.2	174.9	-169.8	0	0	0	0	111.3	G281 G282 A283 L301 D302 W304 H357	S279-G281 PolarHBondContact O-N 3.05Å; S279-G282 WeakPolarHBondContact O-CA 3.34Å; S279-G282 PolarHBondContact O-N 2.78Å; S279-A283 PolarHBondContact O-N 3.04Å; S279-L301 PolarHBondContact N-O 3.48Å; S279-D302 WeakPolarHBondContact CA-O 3.39Å; S279-W304 PolarHBondContact O-N 3.18Å; S279-H357 WeakPolarHBondContact CB-CE1 3.39Å; S279-H357 VanDerWaalsContact CB-NE2 3.27Å; S279-H357 WeakPolarHBondContact CB-NE2 3.26Å; S279-H357 PolarHBondContact OG-CE1 3.32Å; S279-H357 VanDerWaalsContact OG-CE1 3.26Å; S279-H357 PolarHBondContact OG-NE2 3.37Å
280	F	98.8	Very high	98.7	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.9	-35.5	170.3	-157.9	177.2	0	0	0	112	L142 R224 Q227 V228 R231 H278 G282 A283 T284 W304 P307	L142-F280 HydrophobicContact CB-CB 4.23Å; L142-F280 HydrophobicContact CB-CD1 4.09Å; L142-F280 HydrophobicContact CD1-CD1 3.89Å; L142-F280 HydrophobicContact CD1-CE1 4.19Å; R224-F280 HydrophobicContact CB-CZ 4.31Å; R224-F280 WeakPolarHBondContact O-CZ 3.41Å; Q227-F280 HydrophobicContact CB-CE1 4.02Å; Q227-F280 HydrophobicContact CB-CZ 3.62Å; V228-F280 HydrophobicContact CB-CE2 3.78Å; V228-F280 HydrophobicContact CB-CZ 4.43Å; V228-F280 HydrophobicContact CG2-CD2 4.42Å; V228-F280 HydrophobicContact CG2-CE2 3.91Å; R231-F280 PolarHBondContact NH1-O 2.84Å; H278-F280 PolarHBondContact O-N 3.38Å; H278-F280 VanDerWaalsContact O-N 3.11Å; F280-G282 PolarHBondContact O-N 2.98Å; F280-A283 HydrophobicContact CD2-CB 4.19Å; F280-A283 WeakPolarHBondContact O-CA 3.35Å; F280-A283 VanDerWaalsContact O-CB 3.27Å; F280-A283 WeakPolarHBondContact O-CB 3.48Å; F280-A283 PolarHBondContact O-N 3.36Å; F280-T284 PolarHBondContact O-N 2.94Å; F280-T284 PolarHBondContact O-OG1 3.17Å; F280-W304 HydrophobicContact CB-CE3 4.07Å; F280-W304 HydrophobicContact CD1-CE3 4.46Å; F280-W304 HydrophobicContact CD1-CZ3 4.16Å; F280-W304 HydrophobicContact CD2-CE3 4.19Å; F280-W304 HydrophobicContact CD2-CZ3 4.44Å; F280-W304 HydrophobicContact CE1-CZ3 4.42Å; F280-W304 HydrophobicContact CG-CE3 4.01Å; F280-W304 HydrophobicContact CG-CZ3 4.16Å; F280-P307 HydrophobicContact CD2-CB 4.26Å; F280-P307 HydrophobicContact CD2-CG 3.66Å; F280-P307 HydrophobicContact CE2-CB 3.53Å; F280-P307 HydrophobicContact CE2-CG 3.33Å; F280-P307 HydrophobicContact CZ-CB 4.27Å; F280-P307 HydrophobicContact CZ-CG 4.12Å
281	G	98.9	Very high	98.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.2	-29.3	171.1	0	0	0	0	0	113.8	S139 H140 R231 G277 H278 S279 A283 T284 V285	S139-G281 WeakPolarHBondContact O-CA 3.44Å; S139-G281 VanDerWaalsContact OG-CA 3.27Å; S139-G281 WeakPolarHBondContact OG-CA 3.28Å; H140-G281 WeakPolarHBondContact O-CA 3.38Å; H140-G281 PolarHBondContact O-N 3.16Å; R231-G281 VanDerWaalsContact NH1-CA 3.35Å; G277-G281 VanDerWaalsContact C-C 3.49Å; H278-G281 WeakPolarHBondContact O-CA 3.46Å; H278-G281 PolarHBondContact O-N 3.43Å; S279-G281 PolarHBondContact O-N 3.05Å; G281-A283 VanDerWaalsContact C-N 3.33Å; G281-T284 WeakPolarHBondContact O-CB 3.41Å; G281-T284 PolarHBondContact O-N 3.48Å; G281-V285 WeakPolarHBondContact O-CG2 3.28Å; G281-V285 PolarHBondContact O-N 3.46Å
282	G	98.8	Very high	98.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-68.4	-32.3	171.6	0	0	0	0	0	112.6	G277 S279 F280 V285	G277-G282 WeakPolarHBondContact O-CA 3.38Å; G277-G282 PolarHBondContact O-N 2.96Å; S279-G282 WeakPolarHBondContact O-CA 3.34Å; S279-G282 PolarHBondContact O-N 2.78Å; F280-G282 PolarHBondContact O-N 2.98Å; G282-V285 WeakPolarHBondContact O-CB 3.27Å
283	A	98.9	Very high	98.6	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-68.5	-42.6	169.3	0	0	0	0	0	111.1	V228 S279 F280 G281 V285 I286 E287 W304 P307 L308	V228-A283 HydrophobicContact CG2-CB 3.84Å; S279-A283 PolarHBondContact O-N 3.04Å; F280-A283 HydrophobicContact CD2-CB 4.19Å; F280-A283 WeakPolarHBondContact O-CA 3.35Å; F280-A283 VanDerWaalsContact O-CB 3.27Å; F280-A283 WeakPolarHBondContact O-CB 3.48Å; F280-A283 PolarHBondContact O-N 3.36Å; G281-A283 VanDerWaalsContact C-N 3.33Å; A283-V285 VanDerWaalsContact C-N 3.28Å; A283-V285 PolarHBondContact O-N 3.34Å; A283-I286 PolarHBondContact O-N 3.34Å; A283-I286 VanDerWaalsContact O-N 3.09Å; A283-E287 PolarHBondContact O-N 3.21Å; A283-W304 WeakPolarHBondContact CB-O 3.33Å; A283-P307 HydrophobicContact CB-CB 4.43Å; A283-P307 HydrophobicContact CB-CG 4.23Å; A283-L308 HydrophobicContact CB-CD1 4.14Å; A283-L308 HydrophobicContact CB-CD2 4.01Å; A283-L308 HydrophobicContact CB-CG 4.03Å; A283-L308 WeakPolarHBondContact O-CD2 3.17Å
284	T	98.9	Very high	98.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.4	-37.1	175.9	-62.1	0	0	0	0	112.5	R231 F280 G281 I286 E287 S288	R231-T284 HydrophobicContact CB-CG2 3.66Å; R231-T284 VanDerWaalsContact CB-OG1 3.28Å; R231-T284 WeakPolarHBondContact CB-OG1 3.49Å; R231-T284 WeakPolarHBondContact CD-OG1 3.42Å; R231-T284 PolarHBondContact NH1-OG1 3.3Å; F280-T284 PolarHBondContact O-N 2.94Å; F280-T284 PolarHBondContact O-OG1 3.17Å; G281-T284 WeakPolarHBondContact O-CB 3.41Å; G281-T284 PolarHBondContact O-N 3.48Å; T284-I286 VanDerWaalsContact C-N 3.33Å; T284-I286 PolarHBondContact O-N 2.86Å; T284-E287 PolarHBondContact O-N 3.14Å; T284-S288 WeakPolarHBondContact O-CB 3.43Å; T284-S288 PolarHBondContact O-N 2.7Å; T284-S288 PolarHBondContact O-OG 3.41Å
285	V	98.9	Very high	98.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-53.3	-51.5	171.4	162.9	0	0	0	0	110.6	V275 I276 G277 G281 G282 A283 S288 L289 A300 I320	V275-V285 HydrophobicContact CG1-CB 4.41Å; V275-V285 HydrophobicContact CG1-CG1 4.13Å; V275-V285 HydrophobicContact CG1-CG2 4.39Å; V275-V285 HydrophobicContact CG2-CG2 4.06Å; I276-V285 VanDerWaalsContact C-CG2 3.4Å; G277-V285 VanDerWaalsContact N-CG2 3.26Å; G281-V285 WeakPolarHBondContact O-CG2 3.28Å; G281-V285 PolarHBondContact O-N 3.46Å; G282-V285 WeakPolarHBondContact O-CB 3.27Å; A283-V285 VanDerWaalsContact C-N 3.28Å; A283-V285 PolarHBondContact O-N 3.34Å; V285-S288 PolarHBondContact O-N 2.94Å; V285-L289 HydrophobicContact CG1-CD1 4.16Å; V285-L289 VanDerWaalsContact O-CG 3.29Å; V285-L289 WeakPolarHBondContact O-CG 3.3Å; V285-L289 PolarHBondContact O-N 2.93Å; V285-A300 HydrophobicContact CG1-CB 4.37Å; V285-I320 HydrophobicContact CG1-CD1 4.05Å; V285-I320 HydrophobicContact CG1-CG1 4.41Å
286	I	98.8	Very high	98.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-45.9	-176.5	-60.8	161.1	0	0	0	110.8	A283 T284 S288 L289 C290 M305 L308 I312 F313 V316 I320 F322 L340	A283-I286 PolarHBondContact O-N 3.34Å; A283-I286 VanDerWaalsContact O-N 3.09Å; T284-I286 VanDerWaalsContact C-N 3.33Å; T284-I286 PolarHBondContact O-N 2.86Å; I286-S288 VanDerWaalsContact C-N 3.34Å; I286-S288 PolarHBondContact O-N 3.13Å; I286-L289 PolarHBondContact O-N 2.97Å; I286-C290 PolarHBondContact O-N 3.13Å; I286-M305 HydrophobicContact CD1-CE 3.47Å; I286-M305 VanDerWaalsContact CD1-CE 3.47Å; I286-M305 HydrophobicContact CD1-SD 3.53Å; I286-M305 VanDerWaalsContact CD1-SD 3.53Å; I286-L308 HydrophobicContact CB-CD1 3.95Å; I286-L308 HydrophobicContact CD1-CD1 3.56Å; I286-L308 HydrophobicContact CG1-CD1 4.36Å; I286-L308 HydrophobicContact CG2-CD1 4.03Å; I286-I312 HydrophobicContact CG2-CD1 3.76Å; I286-I312 HydrophobicContact CG2-CG1 4.28Å; I286-F313 HydrophobicContact CG2-CD1 4.36Å; I286-F313 HydrophobicContact CG2-CE1 4.48Å; I286-V316 HydrophobicContact CG2-CG2 3.96Å; I286-I320 HydrophobicContact CD1-CD1 4.3Å; I286-I320 HydrophobicContact CG1-CD1 3.47Å; I286-I320 VanDerWaalsContact CG1-CD1 3.47Å; I286-F322 HydrophobicContact CD1-CE1 4.1Å; I286-F322 HydrophobicContact CD1-CZ 4.13Å; I286-L340 HydrophobicContact CD1-CD1 4.01Å; I286-L340 HydrophobicContact CG1-CD1 4.19Å; I286-L340 HydrophobicContact CG2-CD1 4.18Å; I286-L340 HydrophobicContact CG2-CD2 4.43Å
287	E	98.8	Very high	98.6	Very high	9 Å²	9	21 Å²	21	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-62.8	-41	177.1	-173.7	67.9	-167.8	0	0	111.5	V228 A232 A283 T284 C290 K291 L308 I312	V228-E287 HydrophobicContact CG1-CG 4.45Å; V228-E287 HydrophobicContact CG2-CB 4.23Å; A232-E287 HydrophobicContact CB-CB 3.91Å; A232-E287 HydrophobicContact CB-CG 3.49Å; A232-E287 VanDerWaalsContact CB-CG 3.49Å; A283-E287 PolarHBondContact O-N 3.21Å; T284-E287 PolarHBondContact O-N 3.14Å; E287-C290 WeakPolarHBondContact O-CB 3.24Å; E287-C290 PolarHBondContact O-N 3.36Å; E287-K291 HydrophobicContact CG-CD 4.38Å; E287-K291 WeakPolarHBondContact O-CG 3.05Å; E287-K291 PolarHBondContact O-N 3.44Å; E287-K291 VanDerWaalsContact OE1-CE 3.26Å; E287-K291 WeakPolarHBondContact OE1-CE 3.35Å; E287-L308 HydrophobicContact CB-CD2 4.15Å; E287-I312 WeakPolarHBondContact OE2-CD1 3.41Å
288	S	98.8	Very high	98.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.3	-43.3	178.3	-57.3	0	0	0	0	111.8	A232 T284 V285 I286 C290 K291 E292	A232-S288 WeakPolarHBondContact CA-OG 3.15Å; T284-S288 WeakPolarHBondContact O-CB 3.43Å; T284-S288 PolarHBondContact O-N 2.7Å; T284-S288 PolarHBondContact O-OG 3.41Å; V285-S288 PolarHBondContact O-N 2.94Å; I286-S288 VanDerWaalsContact C-N 3.34Å; I286-S288 PolarHBondContact O-N 3.13Å; S288-C290 VanDerWaalsContact C-N 3.27Å; S288-C290 PolarHBondContact O-N 3.38Å; S288-K291 PolarHBondContact O-N 3.16Å; S288-E292 PolarHBondContact O-N 3.43Å
289	L	98.6	Very high	98.6	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	11%	0.105	C	C	.	.	H	α-helix	trans	-62.6	-36	174.7	-68.1	176.5	0	0	0	111.8	V275 V285 I286 K291 F295 V316 Q318 I320	V275-L289 HydrophobicContact CG1-CD2 3.88Å; V275-L289 HydrophobicContact CG1-CG 4.02Å; V285-L289 HydrophobicContact CG1-CD1 4.16Å; V285-L289 VanDerWaalsContact O-CG 3.29Å; V285-L289 WeakPolarHBondContact O-CG 3.3Å; V285-L289 PolarHBondContact O-N 2.93Å; I286-L289 PolarHBondContact O-N 2.97Å; L289-K291 VanDerWaalsContact C-N 3.34Å; L289-F295 HydrophobicContact CD2-CB 3.67Å; L289-V316 HydrophobicContact CB-CG1 3.91Å; L289-V316 HydrophobicContact CD1-CG1 4.1Å; L289-Q318 HydrophobicContact CD2-CB 4.03Å; L289-Q318 HydrophobicContact CD2-CG 4.39Å; L289-Q318 PolarHBondContact O-NE2 2.73Å; L289-Q318 PolarHBondContact O-OE1 2.9Å; L289-I320 HydrophobicContact CD1-CB 4.39Å; L289-I320 HydrophobicContact CD1-CD1 4.31Å; L289-I320 HydrophobicContact CD1-CG1 4.41Å
290	C	97.9	Very high	98.6	Very high	29 Å²	29	20.4 Å²	20.4	20%	0.196	10%	0.102	C	C	.	.	H	α-helix	trans	-67.4	-34.7	175.8	-173.8	0	0	0	0	112.5	I286 E287 S288 I312 R315 V316	I286-C290 PolarHBondContact O-N 3.13Å; E287-C290 WeakPolarHBondContact O-CB 3.24Å; E287-C290 PolarHBondContact O-N 3.36Å; S288-C290 VanDerWaalsContact C-N 3.27Å; S288-C290 PolarHBondContact O-N 3.38Å; C290-I312 HydrophobicContact CB-CB 4.46Å; C290-R315 VanDerWaalsContact SG-CB 3.56Å; C290-V316 HydrophobicContact CB-CG2 3.95Å
291	K	98.2	Very high	98.6	Very high	80 Å²	80	20.4 Å²	20.4	35%	0.348	10%	0.102	S	C	.	.	H	α-helix	trans	-88.5	-32.5	-175.5	-75.5	-175.9	170.4	-171.3	0	114.1	K229 A232 D233 I236 E287 S288 L289	K229-K291 PolarHBondContact O-NZ 3.45Å; A232-K291 HydrophobicContact CB-CD 3.95Å; D233-K291 IonicContact OD1-NZ 2.67Å; D233-K291 PolarHBondContact OD1-NZ 3.32Å; D233-K291 IonicContact OD2-NZ 3.97Å; D233-K291 PolarHBondContact OD2-NZ 2.75Å; D233-K291 VanDerWaalsContact OD2-NZ 3.1Å; I236-K291 HydrophobicContact CD1-CB 3.83Å; I236-K291 HydrophobicContact CD1-CD 4.43Å; E287-K291 HydrophobicContact CG-CD 4.38Å; E287-K291 WeakPolarHBondContact O-CG 3.05Å; E287-K291 PolarHBondContact O-N 3.44Å; E287-K291 VanDerWaalsContact OE1-CE 3.26Å; E287-K291 WeakPolarHBondContact OE1-CE 3.35Å; S288-K291 PolarHBondContact O-N 3.16Å; L289-K291 VanDerWaalsContact C-N 3.34Å
292	E	98.1	Very high	98.6	Very high	30 Å²	30	20.4 Å²	20.4	14%	0.14	10%	0.102	C	C	.	.			trans	-132.4	121.2	-168.8	176	57.2	-91.2	0	0	112.6	I236 S288 K294 F295 Q318	I236-E292 HydrophobicContact CD1-CB 3.75Å; I236-E292 HydrophobicContact CG1-CB 3.71Å; I236-E292 HydrophobicContact CG1-CG 4.13Å; S288-E292 PolarHBondContact O-N 3.43Å; E292-K294 HydrophobicContact CG-CB 3.95Å; E292-K294 HydrophobicContact CG-CG 4.5Å; E292-K294 WeakPolarHBondContact OE1-CB 3.49Å; E292-K294 VanDerWaalsContact OE1-CG 3.29Å; E292-K294 WeakPolarHBondContact OE1-CG 3.49Å; E292-K294 PolarHBondContact OE1-N 2.89Å; E292-F295 HydrophobicContact CB-CD2 3.79Å; E292-F295 HydrophobicContact CB-CE2 4.03Å; E292-F295 HydrophobicContact CG-CD2 3.78Å; E292-F295 HydrophobicContact CG-CE2 3.94Å; E292-Q318 PolarHBondContact O-NE2 2.77Å; E292-Q318 VanDerWaalsContact O-NE2 3.14Å
293	V	97.3	Very high	98.5	Very high	111 Å²	111	20.4 Å²	20.4	67%	0.673	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.7	-177.2	-61.7	0	0	0	0	113.4	F295 K296	V293-F295 VanDerWaalsContact C-N 3.29Å; V293-K296 PolarHBondContact O-NZ 3.26Å
294	K	98.3	Very high	98.5	Very high	80 Å²	80	21.6 Å²	21.6	35%	0.348	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-34.7	172.1	-69.3	173	-171.4	168	0	111.4	L239 D240 E292 K296	L239-K294 HydrophobicContact CD2-CB 3.84Å; L239-K294 HydrophobicContact CD2-CD 4.02Å; D240-K294 IonicContact OD1-NZ 3.89Å; D240-K294 PolarHBondContact OD1-NZ 3.19Å; E292-K294 HydrophobicContact CG-CB 3.95Å; E292-K294 HydrophobicContact CG-CG 4.5Å; E292-K294 WeakPolarHBondContact OE1-CB 3.49Å; E292-K294 VanDerWaalsContact OE1-CG 3.29Å; E292-K294 WeakPolarHBondContact OE1-CG 3.49Å; E292-K294 PolarHBondContact OE1-N 2.89Å; K294-K296 WeakPolarHBondContact O-CE 3.27Å; K294-K296 PolarHBondContact O-N 2.77Å
295	F	98.8	Very high	98.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.1	169.1	-63.6	-58.6	0	0	0	109.6	I137 I236 L239 T273 V275 L289 E292 V293 Q318	I137-F295 HydrophobicContact CB-CE1 4.04Å; I137-F295 HydrophobicContact CB-CZ 4.32Å; I137-F295 HydrophobicContact CG1-CE1 3.64Å; I137-F295 HydrophobicContact CG1-CZ 3.96Å; I236-F295 HydrophobicContact CG1-CE2 4.11Å; L239-F295 HydrophobicContact CB-CZ 4.3Å; L239-F295 HydrophobicContact CD2-CD1 4.42Å; L239-F295 HydrophobicContact CD2-CE1 3.91Å; L239-F295 HydrophobicContact CD2-CE2 4.47Å; L239-F295 HydrophobicContact CD2-CZ 3.93Å; T273-F295 HydrophobicContact CG2-CD1 3.7Å; T273-F295 HydrophobicContact CG2-CE1 3.83Å; V275-F295 HydrophobicContact CB-CD1 3.83Å; V275-F295 HydrophobicContact CB-CE1 3.96Å; V275-F295 HydrophobicContact CB-CG 4.18Å; V275-F295 HydrophobicContact CB-CZ 4.41Å; V275-F295 HydrophobicContact CG1-CB 4.34Å; V275-F295 HydrophobicContact CG1-CD1 4.23Å; V275-F295 HydrophobicContact CG1-CD2 4.47Å; V275-F295 HydrophobicContact CG1-CG 4.1Å; L289-F295 HydrophobicContact CD2-CB 3.67Å; E292-F295 HydrophobicContact CB-CD2 3.79Å; E292-F295 HydrophobicContact CB-CE2 4.03Å; E292-F295 HydrophobicContact CG-CD2 3.78Å; E292-F295 HydrophobicContact CG-CE2 3.94Å; V293-F295 VanDerWaalsContact C-N 3.29Å; F295-Q318 WeakPolarHBondContact O-CG 3.44Å; F295-Q318 PolarHBondContact O-NE2 3.11Å; F295-Q318 VanDerWaalsContact O-NE2 3.15Å
296	K	98.7	Very high	98.4	Very high	86 Å²	86	23.5 Å²	23.5	37%	0.374	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-24.2	-174.8	-57.1	-51.3	175.9	-167.4	0	113.9	C271 T273 V293 K294 Q318 P319 L402	C271-K296 VanDerWaalsContact O-CG 3.32Å; C271-K296 WeakPolarHBondContact O-CG 3.46Å; T273-K296 PolarHBondContact O-N 3.31Å; V293-K296 PolarHBondContact O-NZ 3.26Å; K294-K296 WeakPolarHBondContact O-CE 3.27Å; K294-K296 PolarHBondContact O-N 2.77Å; K296-Q318 WeakPolarHBondContact O-CB 3.44Å; K296-P319 WeakPolarHBondContact O-CD 3.09Å; K296-L402 HydrophobicContact CB-CD2 3.62Å; K296-L402 HydrophobicContact CG-CD2 4.27Å
297	C	98.8	Very high	98.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	169.4	171.3	63.9	0	0	0	0	110	A274 V275 P319 F397 H401	A274-C297 WeakPolarHBondContact CA-O 2.83Å; V275-C297 PolarHBondContact N-O 3.35Å; C297-P319 VanDerWaalsContact CA-O 3.3Å; C297-P319 WeakPolarHBondContact CA-O 3.34Å; C297-P319 HydrophobicContact CB-CB 4.16Å; C297-F397 HydrophobicContact CB-CE1 3.96Å; C297-H401 HydrophobicContact CB-CB 3.79Å
298	G	98.8	Very high	98.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.1	172.7	0	0	0	0	0	115	V275 P319 I320 F321 F397	V275-G298 CarbonylContact O-C 3.57Å; V275-G298 WeakPolarHBondContact O-CA 3.18Å; G298-P319 PolarHBondContact N-O 3.07Å; G298-I320 VanDerWaalsContact O-CA 3.3Å; G298-I320 WeakPolarHBondContact O-CA 3.49Å; G298-F321 PolarHBondContact O-N 3.21Å; G298-F397 WeakPolarHBondContact O-CE1 3.39Å
299	V	98.9	Very high	98.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.9	177.3	-175	0	0	0	0	109.3	V275 I276 G277 L301 F321 I323 T394 F397	V275-V299 PolarHBondContact O-N 2.7Å; I276-V299 VanDerWaalsContact CA-O 3.3Å; I276-V299 WeakPolarHBondContact CA-O 3.4Å; I276-V299 HydrophobicContact CD1-CB 4.38Å; I276-V299 HydrophobicContact CD1-CG2 4.47Å; I276-V299 HydrophobicContact CG1-CB 4.02Å; I276-V299 HydrophobicContact CG1-CG2 4.37Å; I276-V299 HydrophobicContact CG2-CB 4.2Å; G277-V299 PolarHBondContact N-O 3.28Å; G277-V299 VanDerWaalsContact N-O 3.08Å; V299-L301 HydrophobicContact CG1-CD2 3.81Å; V299-F321 CarbonylContact C-O 3.54Å; V299-F321 WeakPolarHBondContact CA-O 3.43Å; V299-F321 HydrophobicContact CG1-CB 4.38Å; V299-F321 HydrophobicContact CG1-CD1 4.34Å; V299-F321 HydrophobicContact CG2-CB 4.26Å; V299-I323 HydrophobicContact CG1-CD1 3.93Å; V299-I323 HydrophobicContact CG1-CG1 4.22Å; V299-T394 HydrophobicContact CG2-CG2 4.22Å; V299-F397 HydrophobicContact CG2-CD1 3.68Å; V299-F397 HydrophobicContact CG2-CE1 4.12Å
300	A	98.8	Very high	97.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	103.9	-177.3	0	0	0	0	0	109.5	V285 D302 A303 I320 F321 F322 I323	V285-A300 HydrophobicContact CG1-CB 4.37Å; A300-D302 PolarHBondContact O-N 3.47Å; A300-A303 HydrophobicContact CB-CB 3.93Å; A300-I320 HydrophobicContact CB-CD1 4.36Å; A300-F321 PolarHBondContact N-O 2.84Å; A300-F322 HydrophobicContact CB-CD1 3.79Å; A300-F322 HydrophobicContact CB-CE1 3.82Å; A300-F322 WeakPolarHBondContact O-CA 3.49Å; A300-I323 PolarHBondContact O-N 3.16Å; A300-I323 VanDerWaalsContact O-N 3.09Å
301	L	98.8	Very high	97.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	111.6	-179.7	-50.4	176.4	0	0	0	108.8	F138 I152 I276 G277 H278 S279 V299 A303 I323 F360	F138-L301 HydrophobicContact CE2-CD1 4.3Å; I152-L301 HydrophobicContact CD1-CD1 3.58Å; I276-L301 HydrophobicContact CG2-CD1 4.17Å; I276-L301 HydrophobicContact CG2-CG 4.33Å; G277-L301 PolarHBondContact O-N 3.18Å; H278-L301 CarbonylContact C-O 3.56Å; H278-L301 VanDerWaalsContact CA-O 3.26Å; H278-L301 WeakPolarHBondContact CA-O 3.43Å; H278-L301 HydrophobicContact CB-CB 4.14Å; H278-L301 PolarHBondContact CD2-O 3.37Å; H278-L301 VanDerWaalsContact CD2-O 3.26Å; S279-L301 PolarHBondContact N-O 3.48Å; V299-L301 HydrophobicContact CG1-CD2 3.81Å; L301-A303 VanDerWaalsContact C-N 3.3Å; L301-A303 PolarHBondContact O-N 3.14Å; L301-I323 CarbonylContact C-O 3.58Å; L301-I323 WeakPolarHBondContact CA-O 3.36Å; L301-I323 HydrophobicContact CD2-CB 3.87Å; L301-I323 HydrophobicContact CD2-CD1 3.9Å; L301-I323 HydrophobicContact CD2-CG1 4.21Å; L301-F360 HydrophobicContact CB-CD1 4.02Å; L301-F360 HydrophobicContact CB-CE1 4.19Å; L301-F360 HydrophobicContact CB-CG 4.36Å; L301-F360 HydrophobicContact CD1-CD1 4.24Å; L301-F360 HydrophobicContact CD2-CD1 4.45Å; L301-F360 HydrophobicContact CD2-CE1 4.31Å; L301-F360 HydrophobicContact CG-CD1 4.47Å
302	D	97.8	Very high	97.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	48.8	176.5	-142.6	23	0	0	0	113.3	S279 A300 W304 I323 S325 F328 Q329 H357 F360	S279-D302 WeakPolarHBondContact CA-O 3.39Å; A300-D302 PolarHBondContact O-N 3.47Å; D302-W304 PolarHBondContact O-N 3.06Å; D302-I323 PolarHBondContact N-O 2.69Å; D302-S325 PolarHBondContact OD1-N 3.1Å; D302-S325 PolarHBondContact OD1-OG 2.58Å; D302-S325 WeakPolarHBondContact OD2-CB 3.33Å; D302-S325 PolarHBondContact OD2-OG 3.03Å; D302-F328 HydrophobicContact CB-CD1 4.35Å; D302-F328 WeakPolarHBondContact O-CE1 3.16Å; D302-F328 WeakPolarHBondContact OD1-CD1 3.13Å; D302-F328 WeakPolarHBondContact OD2-CB 3.19Å; D302-F328 VanDerWaalsContact OD2-CD1 3.24Å; D302-F328 WeakPolarHBondContact OD2-CD1 3.33Å; D302-F328 WeakPolarHBondContact OD2-CG 3.47Å; D302-Q329 PolarHBondContact OD1-NE2 3.46Å; D302-H357 WeakPolarHBondContact OD2-CA 3.49Å; D302-H357 IonicContact OD2-CE1 2.98Å; D302-H357 IonicContact OD2-CG 3.7Å; D302-H357 IonicContact OD2-ND1 3.49Å; D302-H357 PolarHBondContact OD2-ND1 3.45Å; D302-F360 HydrophobicContact CB-CD2 4Å; D302-F360 HydrophobicContact CB-CE2 3.55Å; D302-F360 HydrophobicContact CB-CZ 4.29Å
303	A	98.4	Very high	97.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.148	C	C	.	.			trans	-59.7	136.7	-165.3	0	0	0	0	0	112.8	A300 L301 M305 F322 N333 M337	A300-A303 HydrophobicContact CB-CB 3.93Å; L301-A303 VanDerWaalsContact C-N 3.3Å; L301-A303 PolarHBondContact O-N 3.14Å; A303-M305 HydrophobicContact CB-SD 3.9Å; A303-F322 HydrophobicContact CB-CD1 4.27Å; A303-F322 HydrophobicContact CB-CE1 4.15Å; A303-N333 PolarHBondContact O-ND2 3.08Å; A303-M337 HydrophobicContact CB-CE 4.01Å; A303-M337 WeakPolarHBondContact O-CE 3.46Å
304	W	98.3	Very high	97.1	Very high	26 Å²	26	28.6 Å²	28.6	10%	0.098	14%	0.144	C	C	.	.			trans	-94.7	102.2	172.2	178.5	37.2	0	0	0	109.9	L142 E220 R224 S279 F280 A283 D302 V306 P307 W330	L142-W304 HydrophobicContact CD2-CH2 4.39Å; L142-W304 HydrophobicContact CD2-CZ3 4.12Å; E220-W304 WeakPolarHBondContact OE1-CH2 3.38Å; E220-W304 VanDerWaalsContact OE1-CZ2 3.29Å; E220-W304 WeakPolarHBondContact OE1-CZ2 3.47Å; R224-W304 HydrophobicContact CB-CH2 4.48Å; R224-W304 HydrophobicContact CG-CH2 3.66Å; R224-W304 HydrophobicContact CG-CZ2 4.5Å; R224-W304 HydrophobicContact CG-CZ3 4.19Å; S279-W304 PolarHBondContact O-N 3.18Å; F280-W304 HydrophobicContact CB-CE3 4.07Å; F280-W304 HydrophobicContact CD1-CE3 4.46Å; F280-W304 HydrophobicContact CD1-CZ3 4.16Å; F280-W304 HydrophobicContact CD2-CE3 4.19Å; F280-W304 HydrophobicContact CD2-CZ3 4.44Å; F280-W304 HydrophobicContact CE1-CZ3 4.42Å; F280-W304 HydrophobicContact CG-CE3 4.01Å; F280-W304 HydrophobicContact CG-CZ3 4.16Å; A283-W304 WeakPolarHBondContact CB-O 3.33Å; D302-W304 PolarHBondContact O-N 3.06Å; W304-V306 HydrophobicContact CZ2-CB 4.05Å; W304-V306 HydrophobicContact CZ2-CG1 4.23Å; W304-V306 PolarHBondContact O-N 2.74Å; W304-P307 HydrophobicContact CD2-CG 4.2Å; W304-P307 HydrophobicContact CE3-CG 3.85Å; W304-P307 HydrophobicContact CZ3-CG 4.05Å; W304-P307 WeakPolarHBondContact O-CD 3.39Å; W304-W330 AromaticContact CD1-CH2 3.79Å
305	M	98.1	Very high	96.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.			trans	-84	-7.1	-165.9	-56.3	-66.4	-69.6	0	0	114.8	I286 A303 L308 F313 F322 N333 R336 M337 L340	I286-M305 HydrophobicContact CD1-CE 3.47Å; I286-M305 VanDerWaalsContact CD1-CE 3.47Å; I286-M305 HydrophobicContact CD1-SD 3.53Å; I286-M305 VanDerWaalsContact CD1-SD 3.53Å; A303-M305 HydrophobicContact CB-SD 3.9Å; M305-L308 HydrophobicContact CE-CD1 3.95Å; M305-L308 PolarHBondContact O-N 3.22Å; M305-L308 HydrophobicContact SD-CD1 4.25Å; M305-F313 HydrophobicContact CE-CE1 3.82Å; M305-F313 HydrophobicContact CE-CZ 4.19Å; M305-F322 HydrophobicContact SD-CE1 4.23Å; M305-N333 WeakPolarHBondContact CB-OD1 3.48Å; M305-N333 WeakPolarHBondContact CG-OD1 3.4Å; M305-N333 PolarHBondContact N-OD1 3.27Å; M305-R336 HydrophobicContact CB-CB 3.78Å; M305-R336 HydrophobicContact CE-CB 4.31Å; M305-R336 HydrophobicContact CG-CB 4.22Å; M305-R336 PolarHBondContact O-NE 2.98Å; M305-R336 PolarHBondContact O-NH2 2.69Å; M305-M337 HydrophobicContact CE-CG 4.09Å; M305-M337 HydrophobicContact CG-CE 4.22Å; M305-M337 HydrophobicContact CG-CG 3.73Å; M305-M337 HydrophobicContact SD-CG 3.79Å; M305-L340 HydrophobicContact CE-CD1 4.41Å
306	V	96.9	Very high	96.8	Very high	39 Å²	39	31.2 Å²	31.2	24%	0.236	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-41.7	-178.6	172.4	0	0	0	0	113.5	F221 W304 L308 W330	F221-V306 VanDerWaalsContact CD2-O 3.25Å; F221-V306 WeakPolarHBondContact CD2-O 3.43Å; F221-V306 WeakPolarHBondContact CE2-O 3.27Å; W304-V306 HydrophobicContact CZ2-CB 4.05Å; W304-V306 HydrophobicContact CZ2-CG1 4.23Å; W304-V306 PolarHBondContact O-N 2.74Å; V306-L308 PolarHBondContact O-N 2.86Å; V306-L308 VanDerWaalsContact O-N 3.13Å; V306-W330 HydrophobicContact CG2-CZ2 4.29Å
307	P	98.1	Very high	96.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-14	-174.7	-22.9	35.9	0	0	0	115.7	R224 N225 V228 F280 A283 W304	R224-P307 HydrophobicContact CB-CB 3.94Å; R224-P307 HydrophobicContact CB-CG 4Å; N225-P307 VanDerWaalsContact CA-O 3.24Å; N225-P307 WeakPolarHBondContact CA-O 3.08Å; N225-P307 WeakPolarHBondContact CB-O 3.4Å; N225-P307 PolarHBondContact ND2-O 2.8Å; V228-P307 HydrophobicContact CB-CB 3.85Å; V228-P307 HydrophobicContact CG1-CB 4.12Å; V228-P307 WeakPolarHBondContact CG1-O 3.45Å; V228-P307 HydrophobicContact CG2-CB 4.22Å; F280-P307 HydrophobicContact CD2-CB 4.26Å; F280-P307 HydrophobicContact CD2-CG 3.66Å; F280-P307 HydrophobicContact CE2-CB 3.53Å; F280-P307 HydrophobicContact CE2-CG 3.33Å; F280-P307 HydrophobicContact CZ-CB 4.27Å; F280-P307 HydrophobicContact CZ-CG 4.12Å; A283-P307 HydrophobicContact CB-CB 4.43Å; A283-P307 HydrophobicContact CB-CG 4.23Å; W304-P307 HydrophobicContact CD2-CG 4.2Å; W304-P307 HydrophobicContact CE3-CG 3.85Å; W304-P307 HydrophobicContact CZ3-CG 4.05Å; W304-P307 WeakPolarHBondContact O-CD 3.39Å
308	L	98.3	Very high	96.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.168	C	C	.	.	S	Bend	trans	-90	143.1	-167.9	-58.4	169.7	0	0	0	112.6	F221 V228 A283 I286 E287 M305 V306 I312 F313 R336	F221-L308 WeakPolarHBondContact CE2-O 3.36Å; V228-L308 HydrophobicContact CG1-CD2 4.09Å; V228-L308 HydrophobicContact CG2-CD2 3.92Å; A283-L308 HydrophobicContact CB-CD1 4.14Å; A283-L308 HydrophobicContact CB-CD2 4.01Å; A283-L308 HydrophobicContact CB-CG 4.03Å; A283-L308 WeakPolarHBondContact O-CD2 3.17Å; I286-L308 HydrophobicContact CB-CD1 3.95Å; I286-L308 HydrophobicContact CD1-CD1 3.56Å; I286-L308 HydrophobicContact CG1-CD1 4.36Å; I286-L308 HydrophobicContact CG2-CD1 4.03Å; E287-L308 HydrophobicContact CB-CD2 4.15Å; M305-L308 HydrophobicContact CE-CD1 3.95Å; M305-L308 PolarHBondContact O-N 3.22Å; M305-L308 HydrophobicContact SD-CD1 4.25Å; V306-L308 PolarHBondContact O-N 2.86Å; V306-L308 VanDerWaalsContact O-N 3.13Å; L308-I312 HydrophobicContact CB-CD1 3.71Å; L308-I312 HydrophobicContact CD1-CD1 4.14Å; L308-I312 HydrophobicContact CD2-CD1 3.46Å; L308-I312 VanDerWaalsContact CD2-CD1 3.46Å; L308-I312 HydrophobicContact CG-CD1 3.93Å; L308-F313 HydrophobicContact CB-CE1 4.19Å; L308-F313 HydrophobicContact CB-CZ 4.21Å; L308-F313 HydrophobicContact CD1-CE1 3.95Å; L308-R336 PolarHBondContact O-NH2 2.9Å
309	D	94.8	Very high	96.6	Very high	40 Å²	40	35.9 Å²	35.9	21%	0.214	18%	0.175	C	C	.	.			trans	-74.6	141.2	167.1	-69	-62.6	0	0	0	109.8	F221 N225 K229 E311 I312	F221-D309 WeakPolarHBondContact CZ-OD1 3.45Å; N225-D309 VanDerWaalsContact ND2-CG 3.32Å; N225-D309 PolarHBondContact ND2-OD2 2.8Å; N225-D309 PolarHBondContact OD1-OD2 2.73Å; K229-D309 WeakPolarHBondContact CE-OD2 3.39Å; K229-D309 IonicContact NZ-OD2 3.75Å; K229-D309 PolarHBondContact NZ-OD2 3.08Å; D309-E311 PolarHBondContact O-N 3.34Å; D309-E311 VanDerWaalsContact O-N 3.16Å; D309-I312 HydrophobicContact CB-CG2 4.22Å; D309-I312 WeakPolarHBondContact O-CG1 3.25Å; D309-I312 PolarHBondContact O-N 2.74Å
310	D	92.9	Very high	96.6	Very high	78 Å²	78	35.9 Å²	35.9	42%	0.417	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-61.3	-26.9	178	-82.6	-4.7	0	0	0	112.7	I312 F313 R336 K339	D310-I312 PolarHBondContact O-N 3.32Å; D310-F313 HydrophobicContact CB-CD2 4.49Å; D310-F313 HydrophobicContact CB-CE2 4.33Å; D310-F313 VanDerWaalsContact O-CD2 3.23Å; D310-F313 WeakPolarHBondContact O-CD2 3.3Å; D310-F313 PolarHBondContact O-N 3.37Å; D310-F313 WeakPolarHBondContact OD1-CE2 3.44Å; D310-R336 IonicContact OD1-CZ 2.79Å; D310-R336 IonicContact OD1-NH1 3.71Å; D310-R336 PolarHBondContact OD1-NH1 3.34Å; D310-R336 IonicContact OD1-NH2 3.9Å; D310-K339 IonicContact OD1-NZ 2.63Å; D310-K339 PolarHBondContact OD1-NZ 3.05Å; D310-K339 IonicContact OD2-NZ 2.65Å; D310-K339 PolarHBondContact OD2-NZ 2.85Å
311	E	93.5	Very high	96.6	Very high	152 Å²	152	35.9 Å²	35.9	71%	0.71	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-69.1	-14.4	-178.2	-59.7	-179.5	178.2	0	0	113.8	D309 R315	D309-E311 PolarHBondContact O-N 3.34Å; D309-E311 VanDerWaalsContact O-N 3.16Å; E311-R315 PolarHBondContact O-NE 2.65Å; E311-R315 PolarHBondContact O-NH2 3.48Å
312	I	94.2	Very high	96.6	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.015	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-79	-29.5	178.9	78.2	178.6	0	0	0	111.7	I286 E287 C290 L308 D309 D310 R315 V316	I286-I312 HydrophobicContact CG2-CD1 3.76Å; I286-I312 HydrophobicContact CG2-CG1 4.28Å; E287-I312 WeakPolarHBondContact OE2-CD1 3.41Å; C290-I312 HydrophobicContact CB-CB 4.46Å; L308-I312 HydrophobicContact CB-CD1 3.71Å; L308-I312 HydrophobicContact CD1-CD1 4.14Å; L308-I312 HydrophobicContact CD2-CD1 3.46Å; L308-I312 VanDerWaalsContact CD2-CD1 3.46Å; L308-I312 HydrophobicContact CG-CD1 3.93Å; D309-I312 HydrophobicContact CB-CG2 4.22Å; D309-I312 WeakPolarHBondContact O-CG1 3.25Å; D309-I312 PolarHBondContact O-N 2.74Å; D310-I312 PolarHBondContact O-N 3.32Å; I312-R315 WeakPolarHBondContact O-CB 3.28Å; I312-R315 PolarHBondContact O-N 3.21Å; I312-V316 PolarHBondContact O-N 2.87Å
313	F	94.5	Very high	96.6	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.026	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-59.5	-44.7	-169.2	-53.6	-50.1	0	0	0	113.4	I286 M305 L308 D310 R315 V316 R336 K339 L340	I286-F313 HydrophobicContact CG2-CD1 4.36Å; I286-F313 HydrophobicContact CG2-CE1 4.48Å; M305-F313 HydrophobicContact CE-CE1 3.82Å; M305-F313 HydrophobicContact CE-CZ 4.19Å; L308-F313 HydrophobicContact CB-CE1 4.19Å; L308-F313 HydrophobicContact CB-CZ 4.21Å; L308-F313 HydrophobicContact CD1-CE1 3.95Å; D310-F313 HydrophobicContact CB-CD2 4.49Å; D310-F313 HydrophobicContact CB-CE2 4.33Å; D310-F313 VanDerWaalsContact O-CD2 3.23Å; D310-F313 WeakPolarHBondContact O-CD2 3.3Å; D310-F313 PolarHBondContact O-N 3.37Å; D310-F313 WeakPolarHBondContact OD1-CE2 3.44Å; F313-R315 PolarHBondContact O-N 3.36Å; F313-V316 PolarHBondContact O-N 3.26Å; F313-R336 HydrophobicContact CZ-CB 4.44Å; F313-K339 HydrophobicContact CB-CB 4.19Å; F313-K339 HydrophobicContact CD2-CB 3.52Å; F313-K339 HydrophobicContact CD2-CD 3.66Å; F313-K339 HydrophobicContact CD2-CG 4.23Å; F313-K339 HydrophobicContact CE2-CB 4.07Å; F313-K339 HydrophobicContact CE2-CD 3.62Å; F313-K339 HydrophobicContact CE2-CG 4.45Å; F313-K339 HydrophobicContact CG-CB 3.98Å; F313-L340 HydrophobicContact CB-CD2 3.92Å; F313-L340 HydrophobicContact CB-CG 4.11Å; F313-L340 HydrophobicContact CD1-CD1 4.14Å; F313-L340 HydrophobicContact CD1-CD2 3.98Å; F313-L340 HydrophobicContact CD1-CG 3.81Å; F313-L340 HydrophobicContact CG-CD2 4.41Å; F313-L340 HydrophobicContact CG-CG 4.27Å; F313-L340 WeakPolarHBondContact O-CD2 3.39Å
314	P	93	Very high	96.6	Very high	90 Å²	90	36.1 Å²	36.1	58%	0.584	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-67.7	-17.2	177.6	-19.7	34	0	0	0	114	K317	P314-K317 PolarHBondContact O-NZ 3.2Å
315	R	94.8	Very high	96.6	Very high	132 Å²	132	34.9 Å²	34.9	50%	0.498	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-87.5	-19.4	-177.2	-68.3	-176.4	-79.6	167.9	-5.1	113.2	C290 E311 I312 F313 K317	C290-R315 VanDerWaalsContact SG-CB 3.56Å; E311-R315 PolarHBondContact O-NE 2.65Å; E311-R315 PolarHBondContact O-NH2 3.48Å; I312-R315 WeakPolarHBondContact O-CB 3.28Å; I312-R315 PolarHBondContact O-N 3.21Å; F313-R315 PolarHBondContact O-N 3.36Å; R315-K317 WeakPolarHBondContact O-CG 3.2Å; R315-K317 PolarHBondContact O-N 3.24Å
316	V	96.4	Very high	96.5	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	18%	0.183	C	C	.	.			trans	-71.2	111.8	174.7	179.1	0	0	0	0	109.6	I286 L289 C290 I312 F313 L340 R347	I286-V316 HydrophobicContact CG2-CG2 3.96Å; L289-V316 HydrophobicContact CB-CG1 3.91Å; L289-V316 HydrophobicContact CD1-CG1 4.1Å; C290-V316 HydrophobicContact CB-CG2 3.95Å; I312-V316 PolarHBondContact O-N 2.87Å; F313-V316 PolarHBondContact O-N 3.26Å; V316-L340 HydrophobicContact CB-CD2 3.84Å; V316-L340 HydrophobicContact CG1-CD2 4.29Å; V316-L340 HydrophobicContact CG2-CD2 4.02Å; V316-R347 PolarHBondContact O-NH2 3.47Å
317	K	95.9	Very high	96.3	Very high	139 Å²	139	40.9 Å²	40.9	60%	0.604	20%	0.195	S	C	*	.			trans	-103.7	-12.5	-175.3	-59.6	-48.3	-173.8	-173	0	114.3	P314 R315 I345	P314-K317 PolarHBondContact O-NZ 3.2Å; R315-K317 WeakPolarHBondContact O-CG 3.2Å; R315-K317 PolarHBondContact O-N 3.24Å; K317-I345 HydrophobicContact CD-CD1 4.43Å; K317-I345 VanDerWaalsContact O-CD1 3.25Å; K317-I345 WeakPolarHBondContact O-CD1 3.36Å
318	Q	97.8	Very high	96	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.098	21%	0.206	C	C	.	.	S	Bend	trans	-93.1	148.3	-176.4	-56.6	99	-52.1	0	0	110.8	L289 E292 F295 K296 R347	L289-Q318 HydrophobicContact CD2-CB 4.03Å; L289-Q318 HydrophobicContact CD2-CG 4.39Å; L289-Q318 PolarHBondContact O-NE2 2.73Å; L289-Q318 PolarHBondContact O-OE1 2.9Å; E292-Q318 PolarHBondContact O-NE2 2.77Å; E292-Q318 VanDerWaalsContact O-NE2 3.14Å; F295-Q318 WeakPolarHBondContact O-CG 3.44Å; F295-Q318 PolarHBondContact O-NE2 3.11Å; F295-Q318 VanDerWaalsContact O-NE2 3.15Å; K296-Q318 WeakPolarHBondContact O-CB 3.44Å; Q318-R347 PolarHBondContact O-NH1 3.23Å; Q318-R347 PolarHBondContact O-NH2 3.43Å
319	P	98.4	Very high	95.8	Very high	23 Å²	23	44.1 Å²	44.1	15%	0.149	21%	0.21	C	C	.	.			trans	-51.5	142.2	174.8	-27.7	35.7	0	0	0	113.4	K296 C297 G298 I345 D346 F397 H401	K296-P319 WeakPolarHBondContact O-CD 3.09Å; C297-P319 VanDerWaalsContact CA-O 3.3Å; C297-P319 WeakPolarHBondContact CA-O 3.34Å; C297-P319 HydrophobicContact CB-CB 4.16Å; G298-P319 PolarHBondContact N-O 3.07Å; P319-I345 HydrophobicContact CG-CG2 4.31Å; P319-D346 WeakPolarHBondContact CA-O 3.38Å; P319-F397 HydrophobicContact CB-CE2 4.46Å; P319-F397 HydrophobicContact CB-CZ 3.78Å; P319-H401 HydrophobicContact CB-CB 4.42Å; P319-H401 HydrophobicContact CG-CB 4.32Å; P319-H401 WeakPolarHBondContact CG-ND1 3.37Å
320	I	98.2	Very high	95.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.8	175.7	-165.5	173	0	0	0	110.7	V285 I286 L289 G298 A300 F322 L340 D346 K348	V285-I320 HydrophobicContact CG1-CD1 4.05Å; V285-I320 HydrophobicContact CG1-CG1 4.41Å; I286-I320 HydrophobicContact CD1-CD1 4.3Å; I286-I320 HydrophobicContact CG1-CD1 3.47Å; I286-I320 VanDerWaalsContact CG1-CD1 3.47Å; L289-I320 HydrophobicContact CD1-CB 4.39Å; L289-I320 HydrophobicContact CD1-CD1 4.31Å; L289-I320 HydrophobicContact CD1-CG1 4.41Å; G298-I320 VanDerWaalsContact O-CA 3.3Å; G298-I320 WeakPolarHBondContact O-CA 3.49Å; A300-I320 HydrophobicContact CB-CD1 4.36Å; I320-F322 HydrophobicContact CD1-CE1 4.26Å; I320-F322 HydrophobicContact CD1-CE2 4.23Å; I320-F322 HydrophobicContact CD1-CZ 3.78Å; I320-F322 HydrophobicContact CG1-CE2 4.41Å; I320-F322 HydrophobicContact CG1-CZ 4.39Å; I320-F322 HydrophobicContact CG2-CD2 4.5Å; I320-F322 HydrophobicContact CG2-CE2 3.82Å; I320-F322 HydrophobicContact CG2-CZ 4.37Å; I320-L340 HydrophobicContact CD1-CD1 4.5Å; I320-D346 PolarHBondContact N-O 3.43Å; I320-K348 PolarHBondContact O-N 2.84Å; I320-K348 VanDerWaalsContact O-N 3.15Å
321	F	98.8	Very high	96	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.3	176	-172.3	-161.3	0	0	0	111.3	G298 V299 A300 I323 K348 I350 A393 F397 I415	G298-F321 PolarHBondContact O-N 3.21Å; V299-F321 CarbonylContact C-O 3.54Å; V299-F321 WeakPolarHBondContact CA-O 3.43Å; V299-F321 HydrophobicContact CG1-CB 4.38Å; V299-F321 HydrophobicContact CG1-CD1 4.34Å; V299-F321 HydrophobicContact CG2-CB 4.26Å; A300-F321 PolarHBondContact N-O 2.84Å; F321-I323 HydrophobicContact CD1-CD1 3.91Å; F321-I323 HydrophobicContact CD1-CG1 3.88Å; F321-I323 HydrophobicContact CD2-CG1 4.34Å; F321-I323 HydrophobicContact CE1-CD1 3.62Å; F321-I323 HydrophobicContact CE1-CG1 3.68Å; F321-I323 HydrophobicContact CE2-CG1 4.18Å; F321-I323 HydrophobicContact CG-CG1 4.22Å; F321-I323 HydrophobicContact CZ-CD1 4.2Å; F321-I323 HydrophobicContact CZ-CG1 3.85Å; F321-K348 HydrophobicContact CD2-CB 3.37Å; F321-K348 WeakPolarHBondContact CD2-O 3.42Å; F321-K348 HydrophobicContact CE2-CB 3.74Å; F321-K348 HydrophobicContact CG-CB 4.17Å; F321-I350 HydrophobicContact CE1-CD1 4.44Å; F321-I350 HydrophobicContact CE2-CB 4.37Å; F321-I350 HydrophobicContact CE2-CD1 4.24Å; F321-I350 HydrophobicContact CE2-CG1 3.75Å; F321-I350 HydrophobicContact CE2-CG2 4.04Å; F321-I350 HydrophobicContact CZ-CB 4.5Å; F321-I350 HydrophobicContact CZ-CD1 3.59Å; F321-I350 HydrophobicContact CZ-CG1 3.62Å; F321-I350 HydrophobicContact CZ-CG2 4.18Å; F321-A393 HydrophobicContact CE1-CB 3.77Å; F321-A393 HydrophobicContact CZ-CB 4.1Å; F321-F397 HydrophobicContact CB-CD1 3.76Å; F321-F397 HydrophobicContact CB-CD2 3.71Å; F321-F397 HydrophobicContact CB-CE1 3.72Å; F321-F397 HydrophobicContact CB-CE2 3.68Å; F321-F397 HydrophobicContact CB-CG 3.75Å; F321-F397 HydrophobicContact CB-CZ 3.69Å; F321-F397 HydrophobicContact CD1-CB 3.73Å; F321-F397 HydrophobicContact CD1-CD1 4.36Å; F321-F397 HydrophobicContact CD1-CD2 4.07Å; F321-F397 AromaticContact CD1-CG 3.79Å; F321-F397 HydrophobicContact CD1-CG 3.79Å; F321-F397 HydrophobicContact CE1-CB 4.29Å; F321-F397 HydrophobicContact CG-CB 4.49Å; F321-F397 HydrophobicContact CG-CD2 4.01Å; F321-F397 HydrophobicContact CG-CE2 4.37Å; F321-F397 HydrophobicContact CG-CG 4.08Å; F321-I415 HydrophobicContact CE1-CG1 4.43Å; F321-I415 HydrophobicContact CE2-CG2 4.43Å; F321-I415 HydrophobicContact CZ-CB 4.46Å; F321-I415 HydrophobicContact CZ-CG2 4.31Å
322	F	98.8	Very high	96.1	Very high	5 Å²	5	40.3 Å²	40.3	2%	0.022	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.6	171.9	-66.7	-79.2	0	0	0	110.7	I286 A300 A303 M305 I320 M337 L340 K348 M349 I350	I286-F322 HydrophobicContact CD1-CE1 4.1Å; I286-F322 HydrophobicContact CD1-CZ 4.13Å; A300-F322 HydrophobicContact CB-CD1 3.79Å; A300-F322 HydrophobicContact CB-CE1 3.82Å; A300-F322 WeakPolarHBondContact O-CA 3.49Å; A303-F322 HydrophobicContact CB-CD1 4.27Å; A303-F322 HydrophobicContact CB-CE1 4.15Å; M305-F322 HydrophobicContact SD-CE1 4.23Å; I320-F322 HydrophobicContact CD1-CE1 4.26Å; I320-F322 HydrophobicContact CD1-CE2 4.23Å; I320-F322 HydrophobicContact CD1-CZ 3.78Å; I320-F322 HydrophobicContact CG1-CE2 4.41Å; I320-F322 HydrophobicContact CG1-CZ 4.39Å; I320-F322 HydrophobicContact CG2-CD2 4.5Å; I320-F322 HydrophobicContact CG2-CE2 3.82Å; I320-F322 HydrophobicContact CG2-CZ 4.37Å; F322-M337 HydrophobicContact CD1-CE 4.18Å; F322-M337 HydrophobicContact CD1-CG 4.07Å; F322-M337 HydrophobicContact CD1-SD 3.86Å; F322-M337 HydrophobicContact CE1-CB 4.33Å; F322-M337 HydrophobicContact CE1-CG 3.86Å; F322-M337 HydrophobicContact CE1-SD 4.27Å; F322-M337 HydrophobicContact CE2-CB 4.3Å; F322-M337 HydrophobicContact CG-SD 4.19Å; F322-M337 HydrophobicContact CZ-CB 4.17Å; F322-M337 HydrophobicContact CZ-CG 4.18Å; F322-L340 HydrophobicContact CE2-CD1 4.13Å; F322-L340 HydrophobicContact CZ-CD1 3.65Å; F322-K348 PolarHBondContact N-O 3.43Å; F322-M349 HydrophobicContact CB-CB 4.12Å; F322-M349 HydrophobicContact CB-CE 4.23Å; F322-M349 HydrophobicContact CB-CG 3.88Å; F322-M349 HydrophobicContact CD2-CE 4.1Å; F322-M349 HydrophobicContact CG-CE 4.25Å; F322-M349 CarbonylContact O-C 3.41Å; F322-M349 VanDerWaalsContact O-CA 3.28Å; F322-M349 WeakPolarHBondContact O-CA 3.4Å; F322-I350 PolarHBondContact O-N 2.71Å
323	I	98.8	Very high	96.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.4	172.5	-54.2	-179	0	0	0	107.5	V299 A300 L301 D302 F321 I350 I352 F360 A393 T394	V299-I323 HydrophobicContact CG1-CD1 3.93Å; V299-I323 HydrophobicContact CG1-CG1 4.22Å; A300-I323 PolarHBondContact O-N 3.16Å; A300-I323 VanDerWaalsContact O-N 3.09Å; L301-I323 CarbonylContact C-O 3.58Å; L301-I323 WeakPolarHBondContact CA-O 3.36Å; L301-I323 HydrophobicContact CD2-CB 3.87Å; L301-I323 HydrophobicContact CD2-CD1 3.9Å; L301-I323 HydrophobicContact CD2-CG1 4.21Å; D302-I323 PolarHBondContact N-O 2.69Å; F321-I323 HydrophobicContact CD1-CD1 3.91Å; F321-I323 HydrophobicContact CD1-CG1 3.88Å; F321-I323 HydrophobicContact CD2-CG1 4.34Å; F321-I323 HydrophobicContact CE1-CD1 3.62Å; F321-I323 HydrophobicContact CE1-CG1 3.68Å; F321-I323 HydrophobicContact CE2-CG1 4.18Å; F321-I323 HydrophobicContact CG-CG1 4.22Å; F321-I323 HydrophobicContact CZ-CD1 4.2Å; F321-I323 HydrophobicContact CZ-CG1 3.85Å; I323-I350 HydrophobicContact CB-CG1 4.33Å; I323-I350 HydrophobicContact CG1-CD1 4.24Å; I323-I350 HydrophobicContact CG1-CG1 4.1Å; I323-I350 HydrophobicContact CG2-CD1 4.14Å; I323-I350 HydrophobicContact CG2-CG1 4.12Å; I323-I352 HydrophobicContact CG2-CD1 3.82Å; I323-I352 HydrophobicContact CG2-CG1 4.08Å; I323-F360 HydrophobicContact CG2-CE1 4.01Å; I323-F360 HydrophobicContact CG2-CZ 4.25Å; I323-F360 WeakPolarHBondContact O-CZ 3.5Å; I323-A393 HydrophobicContact CD1-CB 4.37Å; I323-T394 WeakPolarHBondContact CD1-OG1 3.34Å
324	N	98.6	Very high	96.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	154.1	-171.8	-66.1	-34.2	0	0	0	112.4	Q329 I350 T351 I352	N324-Q329 HydrophobicContact CB-CG 3.85Å; N324-Q329 PolarHBondContact OD1-NE2 3.46Å; N324-I350 PolarHBondContact N-O 3.39Å; N324-T351 HydrophobicContact CB-CG2 4.36Å; N324-T351 WeakPolarHBondContact O-CA 3.22Å; N324-I352 PolarHBondContact O-N 3.08Å
325	S	97.4	Very high	96.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	148.7	162.3	73.9	0	0	0	0	111.5	D302 K327 F328 T355 V356 H357	D302-S325 PolarHBondContact OD1-N 3.1Å; D302-S325 PolarHBondContact OD1-OG 2.58Å; D302-S325 WeakPolarHBondContact OD2-CB 3.33Å; D302-S325 PolarHBondContact OD2-OG 3.03Å; S325-K327 VanDerWaalsContact C-N 3.3Å; S325-K327 PolarHBondContact O-N 2.89Å; S325-F328 WeakPolarHBondContact OG-CB 3.48Å; S325-F328 PolarHBondContact OG-N 3.3Å; S325-T355 WeakPolarHBondContact CA-OG1 3.32Å; S325-T355 VanDerWaalsContact CB-OG1 3.22Å; S325-T355 WeakPolarHBondContact CB-OG1 3.38Å; S325-V356 VanDerWaalsContact CB-C 3.5Å; S325-V356 WeakPolarHBondContact CB-O 3.31Å; S325-H357 PolarHBondContact OG-N 2.71Å
326	E	96.3	Very high	96.6	Very high	54 Å²	54	34.2 Å²	34.2	25%	0.252	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-32.7	-177	-170.6	176.3	-161.3	0	0	113	T351 I352 R353 G354 T355 N427	E326-T351 HydrophobicContact CB-CG2 4.07Å; E326-I352 PolarHBondContact N-O 3.36Å; E326-R353 WeakPolarHBondContact OE2-CA 3.48Å; E326-G354 PolarHBondContact OE2-N 2.79Å; E326-T355 PolarHBondContact N-OG1 3.02Å; E326-N427 VanDerWaalsContact CG-ND2 3.27Å; E326-N427 WeakPolarHBondContact CG-ND2 3.39Å; E326-N427 PolarHBondContact O-ND2 3.49Å; E326-N427 VanDerWaalsContact O-ND2 3.08Å
327	K	92.9	Very high	96.6	Very high	111 Å²	111	34 Å²	34	48%	0.483	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-6	-169.4	-65.2	179.8	177.9	-178.4	0	115	S325 T355 V356 E380	S325-K327 VanDerWaalsContact C-N 3.3Å; S325-K327 PolarHBondContact O-N 2.89Å; K327-T355 WeakPolarHBondContact CB-O 3.48Å; K327-T355 WeakPolarHBondContact CG-O 3.05Å; K327-T355 PolarHBondContact N-O 3.08Å; K327-V356 HydrophobicContact CB-CG1 4.19Å; K327-V356 HydrophobicContact CD-CG1 3.71Å; K327-V356 HydrophobicContact CG-CG1 4.46Å; K327-E380 IonicContact NZ-OE1 2.69Å; K327-E380 PolarHBondContact NZ-OE1 3Å
328	F	91.3	Very high	96.6	Very high	51 Å²	51	31.9 Å²	31.9	22%	0.224	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-33.5	-177.5	-179.2	-113.1	0	0	0	113.9	D302 S325 W330 H357	D302-F328 HydrophobicContact CB-CD1 4.35Å; D302-F328 WeakPolarHBondContact O-CE1 3.16Å; D302-F328 WeakPolarHBondContact OD1-CD1 3.13Å; D302-F328 WeakPolarHBondContact OD2-CB 3.19Å; D302-F328 VanDerWaalsContact OD2-CD1 3.24Å; D302-F328 WeakPolarHBondContact OD2-CD1 3.33Å; D302-F328 WeakPolarHBondContact OD2-CG 3.47Å; S325-F328 WeakPolarHBondContact OG-CB 3.48Å; S325-F328 PolarHBondContact OG-N 3.3Å; F328-W330 HydrophobicContact CE1-CZ3 4.31Å; F328-W330 HydrophobicContact CZ-CZ3 4.26Å; F328-H357 HydrophobicContact CB-CB 3.99Å; F328-H357 AromaticContact CD1-CE1 3.83Å; F328-H357 AromaticContact CD1-ND1 3.43Å; F328-H357 WeakPolarHBondContact CD1-ND1 3.41Å; F328-H357 HydrophobicContact CD2-CB 3.63Å; F328-H357 AromaticContact CD2-CG 3.45Å; F328-H357 VanDerWaalsContact CD2-CG 3.45Å; F328-H357 AromaticContact CD2-ND1 3.52Å; F328-H357 AromaticContact CE1-CE1 3.47Å; F328-H357 VanDerWaalsContact CE1-CE1 3.47Å; F328-H357 WeakPolarHBondContact CE1-CE1 3.42Å; F328-H357 AromaticContact CE1-ND1 3.59Å; F328-H357 HydrophobicContact CE2-CB 4.29Å; F328-H357 AromaticContact CE2-CD2 3.77Å; F328-H357 AromaticContact CE2-CE1 3.76Å; F328-H357 AromaticContact CE2-CG 3.67Å; F328-H357 AromaticContact CE2-ND1 3.67Å; F328-H357 AromaticContact CE2-NE2 3.82Å; F328-H357 HydrophobicContact CG-CB 3.9Å; F328-H357 AromaticContact CG-CG 3.75Å; F328-H357 AromaticContact CG-ND1 3.39Å; F328-H357 WeakPolarHBondContact CG-ND1 3.5Å; F328-H357 AromaticContact CZ-CE1 3.43Å; F328-H357 VanDerWaalsContact CZ-CE1 3.43Å; F328-H357 WeakPolarHBondContact CZ-CE1 3.43Å; F328-H357 AromaticContact CZ-ND1 3.69Å; F328-H357 AromaticContact CZ-NE2 3.73Å
329	Q	94.7	Very high	96.5	Very high	18 Å²	18	35.6 Å²	35.6	8%	0.084	18%	0.18	C	C	.	.			trans	-75.1	149.7	-168.1	-64.5	-62.4	-28.3	0	0	113.8	D302 N324 N333 I334 V428	D302-Q329 PolarHBondContact OD1-NE2 3.46Å; N324-Q329 HydrophobicContact CB-CG 3.85Å; N324-Q329 PolarHBondContact OD1-NE2 3.46Å; Q329-N333 PolarHBondContact OE1-ND2 2.78Å; Q329-I334 HydrophobicContact CB-CD1 3.97Å; Q329-I334 HydrophobicContact CB-CG1 4.17Å; Q329-I334 HydrophobicContact CG-CD1 3.97Å; Q329-V428 HydrophobicContact CB-CG2 3.77Å
330	W	95.3	Very high	96.3	Very high	108 Å²	108	34.7 Å²	34.7	41%	0.409	17%	0.174	S	C	.	.			trans	-138.3	161.3	173.8	70	99.6	0	0	0	111.4	W304 V306 F328 G332 N333 I334	W304-W330 AromaticContact CD1-CH2 3.79Å; V306-W330 HydrophobicContact CG2-CZ2 4.29Å; F328-W330 HydrophobicContact CE1-CZ3 4.31Å; F328-W330 HydrophobicContact CZ-CZ3 4.26Å; W330-G332 VanDerWaalsContact C-N 3.34Å; W330-G332 PolarHBondContact O-N 2.8Å; W330-N333 HydrophobicContact CD2-CB 3.63Å; W330-N333 HydrophobicContact CE3-CB 3.88Å; W330-N333 HydrophobicContact CG-CB 4.22Å; W330-N333 HydrophobicContact CH2-CB 3.96Å; W330-N333 HydrophobicContact CZ2-CB 3.7Å; W330-N333 HydrophobicContact CZ3-CB 4.03Å; W330-N333 WeakPolarHBondContact O-CB 3.39Å; W330-N333 PolarHBondContact O-N 3.13Å; W330-I334 PolarHBondContact O-N 2.93Å; W330-I334 VanDerWaalsContact O-N 3.08Å
331	A	96.2	Very high	96	Very high	44 Å²	44	39.4 Å²	39.4	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-54	-45.9	-171.2	0	0	0	0	0	113.4	N333 I334 S335 V428 L430	A331-N333 VanDerWaalsContact C-N 3.32Å; A331-N333 PolarHBondContact O-N 3.06Å; A331-I334 PolarHBondContact O-N 3.48Å; A331-S335 WeakPolarHBondContact O-CB 3.37Å; A331-S335 PolarHBondContact O-N 3.09Å; A331-S335 PolarHBondContact O-OG 3.16Å; A331-S335 VanDerWaalsContact O-OG 3.05Å; A331-V428 HydrophobicContact CB-CG1 4.12Å; A331-L430 HydrophobicContact CB-CD2 4.01Å; A331-L430 WeakPolarHBondContact O-CD2 3.32Å
332	G	95.5	Very high	95.5	Very high	39 Å²	39	42 Å²	42	40%	0.402	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-35.5	178.3	0	0	0	0	0	114	W330 R336	W330-G332 VanDerWaalsContact C-N 3.34Å; W330-G332 PolarHBondContact O-N 2.8Å; G332-R336 WeakPolarHBondContact O-CG 3.43Å; G332-R336 PolarHBondContact O-N 3.4Å
333	N	96.7	Very high	94.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-71.5	-47.4	177.7	-155.4	52.1	0	0	0	111.2	A303 M305 Q329 W330 A331 S335 R336 M337	A303-N333 PolarHBondContact O-ND2 3.08Å; M305-N333 WeakPolarHBondContact CB-OD1 3.48Å; M305-N333 WeakPolarHBondContact CG-OD1 3.4Å; M305-N333 PolarHBondContact N-OD1 3.27Å; Q329-N333 PolarHBondContact OE1-ND2 2.78Å; W330-N333 HydrophobicContact CD2-CB 3.63Å; W330-N333 HydrophobicContact CE3-CB 3.88Å; W330-N333 HydrophobicContact CG-CB 4.22Å; W330-N333 HydrophobicContact CH2-CB 3.96Å; W330-N333 HydrophobicContact CZ2-CB 3.7Å; W330-N333 HydrophobicContact CZ3-CB 4.03Å; W330-N333 WeakPolarHBondContact O-CB 3.39Å; W330-N333 PolarHBondContact O-N 3.13Å; A331-N333 VanDerWaalsContact C-N 3.32Å; A331-N333 PolarHBondContact O-N 3.06Å; N333-S335 PolarHBondContact O-N 2.95Å; N333-R336 WeakPolarHBondContact O-CB 3.29Å; N333-R336 PolarHBondContact O-N 2.61Å; N333-R336 VanDerWaalsContact O-N 3.1Å; N333-M337 PolarHBondContact O-N 2.63Å
334	I	97.6	Very high	94.5	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-42.8	177.5	-65	-57.4	0	0	0	111	Q329 W330 A331 R336 M337 K338 M349 T426 V428 L430	Q329-I334 HydrophobicContact CB-CD1 3.97Å; Q329-I334 HydrophobicContact CB-CG1 4.17Å; Q329-I334 HydrophobicContact CG-CD1 3.97Å; W330-I334 PolarHBondContact O-N 2.93Å; W330-I334 VanDerWaalsContact O-N 3.08Å; A331-I334 PolarHBondContact O-N 3.48Å; I334-R336 PolarHBondContact O-N 3.5Å; I334-M337 HydrophobicContact CD1-CE 4.38Å; I334-M337 HydrophobicContact CD1-SD 3.69Å; I334-M337 WeakPolarHBondContact O-CB 3.24Å; I334-M337 PolarHBondContact O-N 3.09Å; I334-K338 HydrophobicContact CG2-CG 4.48Å; I334-K338 PolarHBondContact O-N 2.81Å; I334-M349 HydrophobicContact CD1-SD 4.48Å; I334-T426 HydrophobicContact CD1-CG2 4.31Å; I334-T426 HydrophobicContact CG1-CG2 4.33Å; I334-T426 HydrophobicContact CG2-CG2 3.83Å; I334-V428 HydrophobicContact CG1-CB 3.97Å; I334-V428 HydrophobicContact CG1-CG1 4.18Å; I334-V428 HydrophobicContact CG1-CG2 4.05Å; I334-L430 HydrophobicContact CB-CD2 4.13Å; I334-L430 HydrophobicContact CG2-CD1 4Å; I334-L430 HydrophobicContact CG2-CD2 3.94Å; I334-L430 HydrophobicContact CG2-CG 4.21Å
335	S	96.4	Very high	94.1	Very high	54 Å²	54	56.6 Å²	56.6	38%	0.378	31%	0.305	S	S	.	.	H	α-helix	trans	-57.4	-33.4	175.6	-70	0	0	0	0	112.1	A331 N333 K339	A331-S335 WeakPolarHBondContact O-CB 3.37Å; A331-S335 PolarHBondContact O-N 3.09Å; A331-S335 PolarHBondContact O-OG 3.16Å; A331-S335 VanDerWaalsContact O-OG 3.05Å; N333-S335 PolarHBondContact O-N 2.95Å; S335-K339 PolarHBondContact O-N 2.95Å
336	R	96.5	Very high	93.6	Very high	47 Å²	47	58.8 Å²	58.8	18%	0.177	32%	0.317	C	S	.	.	H	α-helix	trans	-73.8	-39.8	174.2	-67.8	172.8	67.3	71.5	9.6	112.1	M305 L308 D310 F313 G332 N333 I334 K338 K339	M305-R336 HydrophobicContact CB-CB 3.78Å; M305-R336 HydrophobicContact CE-CB 4.31Å; M305-R336 HydrophobicContact CG-CB 4.22Å; M305-R336 PolarHBondContact O-NE 2.98Å; M305-R336 PolarHBondContact O-NH2 2.69Å; L308-R336 PolarHBondContact O-NH2 2.9Å; D310-R336 IonicContact OD1-CZ 2.79Å; D310-R336 IonicContact OD1-NH1 3.71Å; D310-R336 PolarHBondContact OD1-NH1 3.34Å; D310-R336 IonicContact OD1-NH2 3.9Å; F313-R336 HydrophobicContact CZ-CB 4.44Å; G332-R336 WeakPolarHBondContact O-CG 3.43Å; G332-R336 PolarHBondContact O-N 3.4Å; N333-R336 WeakPolarHBondContact O-CB 3.29Å; N333-R336 PolarHBondContact O-N 2.61Å; N333-R336 VanDerWaalsContact O-N 3.1Å; I334-R336 PolarHBondContact O-N 3.5Å; R336-K338 VanDerWaalsContact C-N 3.3Å; R336-K338 PolarHBondContact O-N 3.49Å; R336-K339 WeakPolarHBondContact O-CB 3.11Å; R336-K339 PolarHBondContact O-N 2.75Å; R336-K339 VanDerWaalsContact O-N 3.15Å
337	M	97.1	Very high	93.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.5	-45	173.3	-64.7	176.9	-179.5	0	0	111.1	A303 M305 F322 N333 I334 K339 L340 M349	A303-M337 HydrophobicContact CB-CE 4.01Å; A303-M337 WeakPolarHBondContact O-CE 3.46Å; M305-M337 HydrophobicContact CE-CG 4.09Å; M305-M337 HydrophobicContact CG-CE 4.22Å; M305-M337 HydrophobicContact CG-CG 3.73Å; M305-M337 HydrophobicContact SD-CG 3.79Å; F322-M337 HydrophobicContact CD1-CE 4.18Å; F322-M337 HydrophobicContact CD1-CG 4.07Å; F322-M337 HydrophobicContact CD1-SD 3.86Å; F322-M337 HydrophobicContact CE1-CB 4.33Å; F322-M337 HydrophobicContact CE1-CG 3.86Å; F322-M337 HydrophobicContact CE1-SD 4.27Å; F322-M337 HydrophobicContact CE2-CB 4.3Å; F322-M337 HydrophobicContact CG-SD 4.19Å; F322-M337 HydrophobicContact CZ-CB 4.17Å; F322-M337 HydrophobicContact CZ-CG 4.18Å; N333-M337 PolarHBondContact O-N 2.63Å; I334-M337 HydrophobicContact CD1-CE 4.38Å; I334-M337 HydrophobicContact CD1-SD 3.69Å; I334-M337 WeakPolarHBondContact O-CB 3.24Å; I334-M337 PolarHBondContact O-N 3.09Å; M337-K339 PolarHBondContact O-N 3.17Å; M337-K339 VanDerWaalsContact O-N 3.16Å; M337-L340 WeakPolarHBondContact O-CB 3.23Å; M337-L340 PolarHBondContact O-N 3.48Å; M337-M349 HydrophobicContact CB-CE 3.69Å; M337-M349 HydrophobicContact CG-CE 4.37Å; M337-M349 HydrophobicContact SD-CE 3.76Å
338	K	95.6	Very high	93.8	Very high	94 Å²	94	54.8 Å²	54.8	41%	0.409	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-65.5	-14.7	178.9	-68.8	-161.1	178.4	-166.1	0	114.7	I334 R336 L340 D341 L430	I334-K338 HydrophobicContact CG2-CG 4.48Å; I334-K338 PolarHBondContact O-N 2.81Å; R336-K338 VanDerWaalsContact C-N 3.3Å; R336-K338 PolarHBondContact O-N 3.49Å; K338-L340 PolarHBondContact O-N 2.79Å; K338-D341 WeakPolarHBondContact O-CB 3.5Å; K338-D341 VanDerWaalsContact O-CG 3.24Å; K338-D341 PolarHBondContact O-N 3.36Å; K338-L430 HydrophobicContact CD-CD1 3.66Å
339	K	95.4	Very high	94.2	Very high	98 Å²	98	53.7 Å²	53.7	43%	0.426	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-66.3	-15.4	171	-67	179.8	-178.5	-179.3	0	112.8	D310 F313 S335 R336 M337	D310-K339 IonicContact OD1-NZ 2.63Å; D310-K339 PolarHBondContact OD1-NZ 3.05Å; D310-K339 IonicContact OD2-NZ 2.65Å; D310-K339 PolarHBondContact OD2-NZ 2.85Å; F313-K339 HydrophobicContact CB-CB 4.19Å; F313-K339 HydrophobicContact CD2-CB 3.52Å; F313-K339 HydrophobicContact CD2-CD 3.66Å; F313-K339 HydrophobicContact CD2-CG 4.23Å; F313-K339 HydrophobicContact CE2-CB 4.07Å; F313-K339 HydrophobicContact CE2-CD 3.62Å; F313-K339 HydrophobicContact CE2-CG 4.45Å; F313-K339 HydrophobicContact CG-CB 3.98Å; S335-K339 PolarHBondContact O-N 2.95Å; R336-K339 WeakPolarHBondContact O-CB 3.11Å; R336-K339 PolarHBondContact O-N 2.75Å; R336-K339 VanDerWaalsContact O-N 3.15Å; M337-K339 PolarHBondContact O-N 3.17Å; M337-K339 VanDerWaalsContact O-N 3.16Å
340	L	94.8	Very high	94.3	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.026	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-86.3	-8.6	172.6	-71.5	157.8	0	0	0	113	I286 M305 F313 V316 I320 F322 M337 K338 C342 R347	I286-L340 HydrophobicContact CD1-CD1 4.01Å; I286-L340 HydrophobicContact CG1-CD1 4.19Å; I286-L340 HydrophobicContact CG2-CD1 4.18Å; I286-L340 HydrophobicContact CG2-CD2 4.43Å; M305-L340 HydrophobicContact CE-CD1 4.41Å; F313-L340 HydrophobicContact CB-CD2 3.92Å; F313-L340 HydrophobicContact CB-CG 4.11Å; F313-L340 HydrophobicContact CD1-CD1 4.14Å; F313-L340 HydrophobicContact CD1-CD2 3.98Å; F313-L340 HydrophobicContact CD1-CG 3.81Å; F313-L340 HydrophobicContact CG-CD2 4.41Å; F313-L340 HydrophobicContact CG-CG 4.27Å; F313-L340 WeakPolarHBondContact O-CD2 3.39Å; V316-L340 HydrophobicContact CB-CD2 3.84Å; V316-L340 HydrophobicContact CG1-CD2 4.29Å; V316-L340 HydrophobicContact CG2-CD2 4.02Å; I320-L340 HydrophobicContact CD1-CD1 4.5Å; F322-L340 HydrophobicContact CE2-CD1 4.13Å; F322-L340 HydrophobicContact CZ-CD1 3.65Å; M337-L340 WeakPolarHBondContact O-CB 3.23Å; M337-L340 PolarHBondContact O-N 3.48Å; K338-L340 PolarHBondContact O-N 2.79Å; L340-C342 PolarHBondContact O-N 3.1Å; L340-R347 VanDerWaalsContact O-CD 3.32Å; L340-R347 WeakPolarHBondContact O-CD 3.35Å; L340-R347 WeakPolarHBondContact O-CG 3.37Å; L340-R347 PolarHBondContact O-NE 3.28Å
341	D	91.8	Very high	94.5	Very high	98 Å²	98	47.7 Å²	47.7	52%	0.524	27%	0.27	S	S	.	.			trans	-54.7	131	-179.1	-71.9	-9.7	0	0	0	109.9	K338	K338-D341 WeakPolarHBondContact O-CB 3.5Å; K338-D341 VanDerWaalsContact O-CG 3.24Å; K338-D341 PolarHBondContact O-N 3.36Å
342	C	88	Confident	94.6	Very high	54 Å²	54	45.7 Å²	45.7	37%	0.365	25%	0.253	S	S	.	.			trans	-144.2	139.2	-176.1	-174.3	0	0	0	0	108.6	L340 V344 I345 R347	L340-C342 PolarHBondContact O-N 3.1Å; C342-V344 VanDerWaalsContact C-N 3.31Å; C342-V344 PolarHBondContact SG-N 2.99Å; C342-I345 HydrophobicContact CB-CB 4.17Å; C342-R347 HydrophobicContact CB-CG 4.29Å
343	T	86.9	Confident	94.7	Very high	150 Å²	150	49 Å²	49	92%	0.92	25%	0.253	S	S	*	.	S	Bend	trans	-79.3	-16.5	177.5	52.3	0	0	0	0	113.2
344	V	89.3	Confident	94.6	Very high	129 Å²	129	49.2 Å²	49.2	78%	0.782	26%	0.256	S	S	*	.	S	Bend	trans	-102.9	-34.7	-174.4	-175.8	0	0	0	0	111.9	C342	C342-V344 VanDerWaalsContact C-N 3.31Å; C342-V344 PolarHBondContact SG-N 2.99Å
345	I	90.4	Very high	94.5	Very high	33 Å²	33	49.3 Å²	49.3	17%	0.169	26%	0.256	C	S	.	.	S	Bend	trans	-103.6	135.1	-177.1	-57.6	159.5	0	0	0	108.1	K317 P319 C342 R347	K317-I345 HydrophobicContact CD-CD1 4.43Å; K317-I345 VanDerWaalsContact O-CD1 3.25Å; K317-I345 WeakPolarHBondContact O-CD1 3.36Å; P319-I345 HydrophobicContact CG-CG2 4.31Å; C342-I345 HydrophobicContact CB-CB 4.17Å; I345-R347 VanDerWaalsContact CG2-NH1 3.27Å; I345-R347 PolarHBondContact O-N 2.92Å
346	D	88	Confident	94.3	Very high	47 Å²	47	47.4 Å²	47.4	25%	0.251	24%	0.243	S	C	.	.			trans	-64.1	124.2	178.2	-157.9	2.9	0	0	0	110.9	P319 I320 K348 R400 H401	P319-D346 WeakPolarHBondContact CA-O 3.38Å; I320-D346 PolarHBondContact N-O 3.43Å; D346-K348 WeakPolarHBondContact OD1-CE 3.21Å; D346-K348 WeakPolarHBondContact OD1-CG 3.42Å; D346-K348 IonicContact OD1-NZ 2.82Å; D346-R400 IonicContact OD2-NH1 3.61Å; D346-R400 PolarHBondContact OD2-NH1 3.13Å; D346-H401 IonicContact OD2-CE1 2.86Å; D346-H401 IonicContact OD2-NE2 3.47Å
347	R	95	Very high	94.1	Very high	34 Å²	34	46.8 Å²	46.8	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	104.1	179.6	-62.2	-63	-179.3	-131.9	6.8	107	V316 Q318 L340 C342 I345	V316-R347 PolarHBondContact O-NH2 3.47Å; Q318-R347 PolarHBondContact O-NH1 3.23Å; Q318-R347 PolarHBondContact O-NH2 3.43Å; L340-R347 VanDerWaalsContact O-CD 3.32Å; L340-R347 WeakPolarHBondContact O-CD 3.35Å; L340-R347 WeakPolarHBondContact O-CG 3.37Å; L340-R347 PolarHBondContact O-NE 3.28Å; C342-R347 HydrophobicContact CB-CG 4.29Å; I345-R347 VanDerWaalsContact CG2-NH1 3.27Å; I345-R347 PolarHBondContact O-N 2.92Å
348	K	97.6	Very high	93.7	Very high	47 Å²	47	49.6 Å²	49.6	20%	0.204	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.1	-177.8	-64.5	-65.4	-168.5	-178	0	110.2	I320 F321 F322 D346 F397 I415 D416	I320-K348 PolarHBondContact O-N 2.84Å; I320-K348 VanDerWaalsContact O-N 3.15Å; F321-K348 HydrophobicContact CD2-CB 3.37Å; F321-K348 WeakPolarHBondContact CD2-O 3.42Å; F321-K348 HydrophobicContact CE2-CB 3.74Å; F321-K348 HydrophobicContact CG-CB 4.17Å; F322-K348 PolarHBondContact N-O 3.43Å; D346-K348 WeakPolarHBondContact OD1-CE 3.21Å; D346-K348 WeakPolarHBondContact OD1-CG 3.42Å; D346-K348 IonicContact OD1-NZ 2.82Å; K348-F397 HydrophobicContact CG-CE2 4.45Å; K348-I415 HydrophobicContact CB-CG2 3.87Å; K348-I415 HydrophobicContact CD-CG2 3.89Å; K348-I415 HydrophobicContact CG-CG2 3.5Å; K348-D416 WeakPolarHBondContact CE-OD1 3.49Å; K348-D416 IonicContact NZ-OD1 3.61Å; K348-D416 PolarHBondContact NZ-OD1 3.37Å
349	M	98.6	Very high	93.6	Very high	28 Å²	28	45.3 Å²	45.3	14%	0.138	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	131.2	175.1	-176.8	-178.1	-63.3	0	0	108.7	F322 I334 M337 G425 T426	F322-M349 HydrophobicContact CB-CB 4.12Å; F322-M349 HydrophobicContact CB-CE 4.23Å; F322-M349 HydrophobicContact CB-CG 3.88Å; F322-M349 HydrophobicContact CD2-CE 4.1Å; F322-M349 HydrophobicContact CG-CE 4.25Å; F322-M349 CarbonylContact O-C 3.41Å; F322-M349 VanDerWaalsContact O-CA 3.28Å; F322-M349 WeakPolarHBondContact O-CA 3.4Å; I334-M349 HydrophobicContact CD1-SD 4.48Å; M337-M349 HydrophobicContact CB-CE 3.69Å; M337-M349 HydrophobicContact CG-CE 4.37Å; M337-M349 HydrophobicContact SD-CE 3.76Å; M349-G425 WeakPolarHBondContact O-CA 3.24Å; M349-G425 PolarHBondContact O-N 2.99Å; M349-T426 HydrophobicContact SD-CG2 4.29Å
350	I	98.7	Very high	93.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.1	168.8	60.7	170.3	0	0	0	109.9	F321 F322 I323 N324 A393 I415 L422 I423 G425	F321-I350 HydrophobicContact CE1-CD1 4.44Å; F321-I350 HydrophobicContact CE2-CB 4.37Å; F321-I350 HydrophobicContact CE2-CD1 4.24Å; F321-I350 HydrophobicContact CE2-CG1 3.75Å; F321-I350 HydrophobicContact CE2-CG2 4.04Å; F321-I350 HydrophobicContact CZ-CB 4.5Å; F321-I350 HydrophobicContact CZ-CD1 3.59Å; F321-I350 HydrophobicContact CZ-CG1 3.62Å; F321-I350 HydrophobicContact CZ-CG2 4.18Å; F322-I350 PolarHBondContact O-N 2.71Å; I323-I350 HydrophobicContact CB-CG1 4.33Å; I323-I350 HydrophobicContact CG1-CD1 4.24Å; I323-I350 HydrophobicContact CG1-CG1 4.1Å; I323-I350 HydrophobicContact CG2-CD1 4.14Å; I323-I350 HydrophobicContact CG2-CG1 4.12Å; N324-I350 PolarHBondContact N-O 3.39Å; I350-A393 HydrophobicContact CD1-CB 3.98Å; I350-I415 WeakPolarHBondContact CG2-O 3.14Å; I350-L422 HydrophobicContact CD1-CD1 4.18Å; I350-L422 HydrophobicContact CD1-CD2 4.11Å; I350-I423 WeakPolarHBondContact CA-O 3.43Å; I350-G425 CarbonylContact C-O 3.56Å
351	T	98.8	Very high	93.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.6	170.4	-58.8	0	0	0	0	110	N324 E326 L422 I423 G425 T426	N324-T351 HydrophobicContact CB-CG2 4.36Å; N324-T351 WeakPolarHBondContact O-CA 3.22Å; E326-T351 HydrophobicContact CB-CG2 4.07Å; T351-L422 CarbonylContact O-C 3.58Å; T351-L422 WeakPolarHBondContact O-CA 3.34Å; T351-I423 HydrophobicContact CG2-CD1 4.47Å; T351-I423 PolarHBondContact N-O 2.95Å; T351-I423 PolarHBondContact O-N 3.48Å; T351-G425 PolarHBondContact N-O 3.38Å; T351-G425 PolarHBondContact OG1-O 3.44Å; T351-T426 WeakPolarHBondContact OG1-CA 3.49Å
352	I	98.6	Very high	93.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.7	-179.3	-47.8	179.5	0	0	0	109.3	I323 N324 E326 T355 F360 I381 L389 L422	I323-I352 HydrophobicContact CG2-CD1 3.82Å; I323-I352 HydrophobicContact CG2-CG1 4.08Å; N324-I352 PolarHBondContact O-N 3.08Å; E326-I352 PolarHBondContact N-O 3.36Å; I352-T355 HydrophobicContact CB-CG2 3.67Å; I352-T355 HydrophobicContact CG2-CG2 3.47Å; I352-T355 VanDerWaalsContact CG2-CG2 3.47Å; I352-T355 PolarHBondContact O-N 3.23Å; I352-T355 PolarHBondContact O-OG1 3.01Å; I352-F360 HydrophobicContact CD1-CE1 4.41Å; I352-I381 HydrophobicContact CG2-CD1 4.21Å; I352-L389 HydrophobicContact CG2-CD1 4.13Å; I352-L422 HydrophobicContact CB-CD2 4.18Å; I352-L422 HydrophobicContact CG1-CD2 3.76Å; I352-L422 HydrophobicContact CG2-CD2 4.24Å
353	R	98.1	Very high	93.5	Very high	109 Å²	109	34.7 Å²	34.7	41%	0.411	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	144.8	-179	-64.9	-178.8	-173.5	-87.7	4.9	111.8	E326 T355 K420 N421 L422 I423	E326-R353 WeakPolarHBondContact OE2-CA 3.48Å; R353-T355 PolarHBondContact O-N 3.47Å; R353-T355 VanDerWaalsContact O-N 3.11Å; R353-K420 WeakPolarHBondContact CD-O 3.29Å; R353-K420 PolarHBondContact NE-O 2.86Å; R353-N421 WeakPolarHBondContact CB-O 3.34Å; R353-N421 WeakPolarHBondContact CG-O 3.3Å; R353-N421 PolarHBondContact N-O 3.23Å; R353-L422 PolarHBondContact NE-O 3.28Å; R353-I423 HydrophobicContact CG-CD1 4Å; R353-I423 HydrophobicContact CG-CG1 3.74Å; R353-I423 VanDerWaalsContact CZ-CG1 3.43Å
354	G	93.4	Very high	93.6	Very high	6 Å²	6	27.6 Å²	27.6	6%	0.062	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	-4.1	178.2	0	0	0	0	0	114.7	E326 G379 E380	E326-G354 PolarHBondContact OE2-N 2.79Å; G354-G379 CarbonylContact O-C 3.53Å; G354-G379 WeakPolarHBondContact O-CA 3.49Å; G354-E380 PolarHBondContact O-N 3.42Å
355	T	95.6	Very high	93.5	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	10%	0.1	C	C	.	.			trans	-81	159.1	-176.8	59.1	0	0	0	0	113.1	S325 E326 K327 I352 R353 I381 A386	S325-T355 WeakPolarHBondContact CA-OG1 3.32Å; S325-T355 VanDerWaalsContact CB-OG1 3.22Å; S325-T355 WeakPolarHBondContact CB-OG1 3.38Å; E326-T355 PolarHBondContact N-OG1 3.02Å; K327-T355 WeakPolarHBondContact CB-O 3.48Å; K327-T355 WeakPolarHBondContact CG-O 3.05Å; K327-T355 PolarHBondContact N-O 3.08Å; I352-T355 HydrophobicContact CB-CG2 3.67Å; I352-T355 HydrophobicContact CG2-CG2 3.47Å; I352-T355 VanDerWaalsContact CG2-CG2 3.47Å; I352-T355 PolarHBondContact O-N 3.23Å; I352-T355 PolarHBondContact O-OG1 3.01Å; R353-T355 PolarHBondContact O-N 3.47Å; R353-T355 VanDerWaalsContact O-N 3.11Å; T355-I381 HydrophobicContact CG2-CG2 3.51Å; T355-A386 HydrophobicContact CG2-CB 3.76Å
356	V	92.5	Very high	93.1	Very high	15 Å²	15	20.5 Å²	20.5	9%	0.091	9%	0.094	C	C	.	.			trans	-119.7	168.7	171.1	-69.1	0	0	0	0	109.1	S325 K327 Q358 S359 K376	S325-V356 VanDerWaalsContact CB-C 3.5Å; S325-V356 WeakPolarHBondContact CB-O 3.31Å; K327-V356 HydrophobicContact CB-CG1 4.19Å; K327-V356 HydrophobicContact CD-CG1 3.71Å; K327-V356 HydrophobicContact CG-CG1 4.46Å; V356-Q358 HydrophobicContact CG2-CB 4.35Å; V356-Q358 PolarHBondContact O-N 2.93Å; V356-Q358 VanDerWaalsContact O-N 3.07Å; V356-S359 PolarHBondContact N-OG 3.26Å; V356-S359 VanDerWaalsContact N-OG 3.14Å; V356-S359 WeakPolarHBondContact O-CB 3.24Å; V356-S359 PolarHBondContact O-N 2.54Å; V356-S359 PolarHBondContact O-OG 2.78Å; V356-K376 WeakPolarHBondContact CG2-O 3.17Å
357	H	92.6	Very high	92.3	Very high	33 Å²	33	18.6 Å²	18.6	15%	0.153	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-52.8	-34.2	177.7	-163.8	50.6	0	0	0	113.7	H278 S279 D302 S325 F328 S359	H278-H357 AromaticContact CE1-CE1 3.64Å; H278-H357 AromaticContact CE1-NE2 3.67Å; H278-H357 AromaticContact NE2-CE1 3.32Å; H278-H357 PolarHBondContact NE2-CE1 2.9Å; H278-H357 VanDerWaalsContact NE2-CE1 3.32Å; H278-H357 AromaticContact NE2-ND1 3.55Å; H278-H357 AromaticContact NE2-NE2 3.83Å; H278-H357 PolarHBondContact NE2-O 3.21Å; S279-H357 WeakPolarHBondContact CB-CE1 3.39Å; S279-H357 VanDerWaalsContact CB-NE2 3.27Å; S279-H357 WeakPolarHBondContact CB-NE2 3.26Å; S279-H357 PolarHBondContact OG-CE1 3.32Å; S279-H357 VanDerWaalsContact OG-CE1 3.26Å; S279-H357 PolarHBondContact OG-NE2 3.37Å; D302-H357 WeakPolarHBondContact OD2-CA 3.49Å; D302-H357 IonicContact OD2-CE1 2.98Å; D302-H357 IonicContact OD2-CG 3.7Å; D302-H357 IonicContact OD2-ND1 3.49Å; D302-H357 PolarHBondContact OD2-ND1 3.45Å; S325-H357 PolarHBondContact OG-N 2.71Å; F328-H357 HydrophobicContact CB-CB 3.99Å; F328-H357 AromaticContact CD1-CE1 3.83Å; F328-H357 AromaticContact CD1-ND1 3.43Å; F328-H357 WeakPolarHBondContact CD1-ND1 3.41Å; F328-H357 HydrophobicContact CD2-CB 3.63Å; F328-H357 AromaticContact CD2-CG 3.45Å; F328-H357 VanDerWaalsContact CD2-CG 3.45Å; F328-H357 AromaticContact CD2-ND1 3.52Å; F328-H357 AromaticContact CE1-CE1 3.47Å; F328-H357 VanDerWaalsContact CE1-CE1 3.47Å; F328-H357 WeakPolarHBondContact CE1-CE1 3.42Å; F328-H357 AromaticContact CE1-ND1 3.59Å; F328-H357 HydrophobicContact CE2-CB 4.29Å; F328-H357 AromaticContact CE2-CD2 3.77Å; F328-H357 AromaticContact CE2-CE1 3.76Å; F328-H357 AromaticContact CE2-CG 3.67Å; F328-H357 AromaticContact CE2-ND1 3.67Å; F328-H357 AromaticContact CE2-NE2 3.82Å; F328-H357 HydrophobicContact CG-CB 3.9Å; F328-H357 AromaticContact CG-CG 3.75Å; F328-H357 AromaticContact CG-ND1 3.39Å; F328-H357 WeakPolarHBondContact CG-ND1 3.5Å; F328-H357 AromaticContact CZ-CE1 3.43Å; F328-H357 VanDerWaalsContact CZ-CE1 3.43Å; F328-H357 WeakPolarHBondContact CZ-CE1 3.43Å; F328-H357 AromaticContact CZ-ND1 3.69Å; F328-H357 AromaticContact CZ-NE2 3.73Å; H357-S359 PolarHBondContact O-N 2.95Å
358	Q	89.2	Confident	90.9	Very high	60 Å²	60	18.3 Å²	18.3	28%	0.28	9%	0.092	S	C	.	.	G	3₁₀ helix	trans	-82.4	3.7	-179.1	-63.4	-65.6	-32.6	0	0	113.6	V356 F360 P361 T364 L377	V356-Q358 HydrophobicContact CG2-CB 4.35Å; V356-Q358 PolarHBondContact O-N 2.93Å; V356-Q358 VanDerWaalsContact O-N 3.07Å; Q358-F360 VanDerWaalsContact C-N 3.27Å; Q358-F360 PolarHBondContact O-N 3.43Å; Q358-P361 WeakPolarHBondContact O-CD 3.43Å; Q358-P361 VanDerWaalsContact OE1-CG 3.26Å; Q358-T364 WeakPolarHBondContact O-CB 3.08Å; Q358-L377 HydrophobicContact CB-CD2 4.19Å; Q358-L377 HydrophobicContact CG-CD2 3.97Å
359	S	91.9	Very high	89.2	Confident	4 Å²	4	19.1 Å²	19.1	3%	0.028	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-73.2	-15.1	175.8	-67.9	0	0	0	0	114	V356 H357	V356-S359 PolarHBondContact N-OG 3.26Å; V356-S359 VanDerWaalsContact N-OG 3.14Å; V356-S359 WeakPolarHBondContact O-CB 3.24Å; V356-S359 PolarHBondContact O-N 2.54Å; V356-S359 PolarHBondContact O-OG 2.78Å; H357-S359 PolarHBondContact O-N 2.95Å
360	F	93.7	Very high	86.9	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.018	12%	0.122	C	C	.	.	S	Bend	trans	-89.7	-44.6	176.9	-59.4	-81.4	0	0	0	114.6	H278 L301 D302 I323 I352 Q358	H278-F360 AromaticContact CD2-CD2 3.7Å; H278-F360 AromaticContact CD2-CG 3.82Å; H278-F360 AromaticContact NE2-CD2 3.65Å; L301-F360 HydrophobicContact CB-CD1 4.02Å; L301-F360 HydrophobicContact CB-CE1 4.19Å; L301-F360 HydrophobicContact CB-CG 4.36Å; L301-F360 HydrophobicContact CD1-CD1 4.24Å; L301-F360 HydrophobicContact CD2-CD1 4.45Å; L301-F360 HydrophobicContact CD2-CE1 4.31Å; L301-F360 HydrophobicContact CG-CD1 4.47Å; D302-F360 HydrophobicContact CB-CD2 4Å; D302-F360 HydrophobicContact CB-CE2 3.55Å; D302-F360 HydrophobicContact CB-CZ 4.29Å; I323-F360 HydrophobicContact CG2-CE1 4.01Å; I323-F360 HydrophobicContact CG2-CZ 4.25Å; I323-F360 WeakPolarHBondContact O-CZ 3.5Å; I352-F360 HydrophobicContact CD1-CE1 4.41Å; Q358-F360 VanDerWaalsContact C-N 3.27Å; Q358-F360 PolarHBondContact O-N 3.43Å
361	P	94.1	Very high	85	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.019	13%	0.131	C	C	.	.	S	Bend	trans	-74	159.8	175.3	28.6	-36.1	0	0	0	112.8	L148 Y149 Q358 F363 T364	L148-P361 WeakPolarHBondContact O-CA 3.43Å; Y149-P361 HydrophobicContact CD1-CB 4.28Å; Y149-P361 HydrophobicContact CE1-CB 3.81Å; Q358-P361 WeakPolarHBondContact O-CD 3.43Å; Q358-P361 VanDerWaalsContact OE1-CG 3.26Å; P361-F363 PolarHBondContact O-N 2.67Å; P361-F363 VanDerWaalsContact O-N 3.07Å; P361-T364 PolarHBondContact O-N 3.07Å
362	D	94.4	Very high	83.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.2	-173	-65.2	-21.9	0	0	0	114.3	I43 W85 L148 Y149 S150 A151 T364 F365	I43-D362 HydrophobicContact CD1-CB 3.88Å; I43-D362 HydrophobicContact CG1-CB 4.28Å; W85-D362 HydrophobicContact CZ2-CB 3.91Å; W85-D362 VanDerWaalsContact NE1-CB 3.34Å; W85-D362 PolarHBondContact NE1-OD2 2.89Å; L148-D362 PolarHBondContact O-N 3.29Å; Y149-D362 PolarHBondContact N-OD2 2.81Å; S150-D362 WeakPolarHBondContact CB-OD2 3.39Å; S150-D362 VanDerWaalsContact N-CG 3.35Å; S150-D362 PolarHBondContact N-OD1 2.88Å; S150-D362 VanDerWaalsContact N-OD1 3.14Å; S150-D362 PolarHBondContact N-OD2 3.32Å; S150-D362 PolarHBondContact OG-OD2 2.89Å; A151-D362 WeakPolarHBondContact CB-OD1 3.47Å; A151-D362 PolarHBondContact N-OD1 3.39Å; D362-T364 PolarHBondContact O-N 3.09Å; D362-F365 WeakPolarHBondContact O-CD2 3.31Å; D362-F365 PolarHBondContact O-N 2.8Å
363	F	87.3	Confident	81.4	Confident	25 Å²	25	33.2 Å²	33.2	11%	0.11	16%	0.155	C	C	.	.	H	α-helix	trans	-51.8	-28.5	178.5	-81.3	-76.3	0	0	0	113.5	W85 L95 L148 P361 F365 L366 L377	W85-F363 AromaticContact CH2-CD1 3.62Å; W85-F363 HydrophobicContact CH2-CD1 3.62Å; W85-F363 HydrophobicContact CH2-CD2 4.25Å; W85-F363 AromaticContact CH2-CE1 3.48Å; W85-F363 HydrophobicContact CH2-CE1 3.48Å; W85-F363 VanDerWaalsContact CH2-CE1 3.48Å; W85-F363 HydrophobicContact CH2-CE2 4.12Å; W85-F363 HydrophobicContact CH2-CG 4.01Å; W85-F363 AromaticContact CH2-CZ 3.72Å; W85-F363 HydrophobicContact CH2-CZ 3.72Å; W85-F363 HydrophobicContact CZ2-CD1 4.36Å; W85-F363 HydrophobicContact CZ2-CD2 4.29Å; W85-F363 HydrophobicContact CZ2-CE1 4.41Å; W85-F363 HydrophobicContact CZ2-CE2 4.33Å; W85-F363 HydrophobicContact CZ2-CG 4.3Å; W85-F363 HydrophobicContact CZ2-CZ 4.37Å; W85-F363 HydrophobicContact CZ3-CE1 4.26Å; L95-F363 HydrophobicContact CD1-CZ 3.86Å; L95-F363 HydrophobicContact CD2-CE2 4.37Å; L95-F363 HydrophobicContact CD2-CZ 4.05Å; L148-F363 HydrophobicContact CD1-CE2 3.9Å; L148-F363 HydrophobicContact CD2-CE2 4.06Å; L148-F363 HydrophobicContact CD2-CZ 4.42Å; P361-F363 PolarHBondContact O-N 2.67Å; P361-F363 VanDerWaalsContact O-N 3.07Å; F363-F365 PolarHBondContact O-N 2.9Å; F363-L366 PolarHBondContact O-N 3.38Å; F363-L377 HydrophobicContact CB-CD2 4.34Å
364	T	87.2	Confident	79.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-24.4	-180	-155	0	0	0	0	113.5	Q358 P361 D362 L377 K378 P383	Q358-T364 WeakPolarHBondContact O-CB 3.08Å; P361-T364 PolarHBondContact O-N 3.07Å; D362-T364 PolarHBondContact O-N 3.09Å; T364-L377 WeakPolarHBondContact CB-O 3.14Å; T364-L377 PolarHBondContact OG1-O 2.81Å; T364-K378 WeakPolarHBondContact O-CE 3.29Å; T364-K378 PolarHBondContact O-NZ 3.18Å; T364-K378 VanDerWaalsContact O-NZ 3.13Å; T364-P383 HydrophobicContact CG2-CB 3.85Å
365	F	87.9	Confident	77.6	Confident	8 Å²	8	36 Å²	36	4%	0.035	18%	0.175	C	C	.	.	H	α-helix	trans	-92	-20.1	-179.7	-52.5	-68.3	0	0	0	113.5	G42 P44 A151 D362 F363 P383 E384 I387	G42-F365 PolarHBondContact N-O 3.45Å; G42-F365 WeakPolarHBondContact O-CB 3.4Å; P44-F365 HydrophobicContact CG-CD1 4.22Å; P44-F365 HydrophobicContact CG-CE1 3.9Å; P44-F365 HydrophobicContact CG-CE2 4.39Å; P44-F365 HydrophobicContact CG-CZ 4.02Å; A151-F365 HydrophobicContact CB-CD2 4.36Å; A151-F365 HydrophobicContact CB-CE2 3.6Å; A151-F365 HydrophobicContact CB-CZ 4.23Å; D362-F365 WeakPolarHBondContact O-CD2 3.31Å; D362-F365 PolarHBondContact O-N 2.8Å; F363-F365 PolarHBondContact O-N 2.9Å; F365-P383 HydrophobicContact CD1-CB 3.89Å; F365-P383 HydrophobicContact CE1-CB 3.68Å; F365-E384 HydrophobicContact CE1-CG 4.31Å; F365-I387 HydrophobicContact CE1-CG2 4.16Å; F365-I387 HydrophobicContact CZ-CB 3.88Å; F365-I387 HydrophobicContact CZ-CG1 4.19Å; F365-I387 HydrophobicContact CZ-CG2 3.71Å
366	L	82.5	Confident	76.3	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-98.7	-1.7	-166.4	-57.4	-176.9	0	0	0	114	I43 W85 F114 Y117 F363	I43-L366 HydrophobicContact CG1-CD2 3.89Å; I43-L366 HydrophobicContact CG1-CG 4.43Å; W85-L366 HydrophobicContact CD2-CD1 3.41Å; W85-L366 VanDerWaalsContact CD2-CD1 3.41Å; W85-L366 HydrophobicContact CE3-CD1 3.27Å; W85-L366 HydrophobicContact CG-CD1 4.23Å; W85-L366 HydrophobicContact CH2-CD1 3.45Å; W85-L366 VanDerWaalsContact CH2-CD1 3.45Å; W85-L366 HydrophobicContact CZ2-CD1 3.56Å; W85-L366 HydrophobicContact CZ3-CD1 3.32Å; F114-L366 HydrophobicContact CD1-CB 3.83Å; F114-L366 HydrophobicContact CD1-CD1 4.33Å; F114-L366 HydrophobicContact CE1-CB 3.81Å; Y117-L366 HydrophobicContact CD1-CD2 3.67Å; Y117-L366 HydrophobicContact CD2-CB 4.09Å; Y117-L366 HydrophobicContact CD2-CD1 4.02Å; Y117-L366 HydrophobicContact CD2-CD2 3.69Å; Y117-L366 HydrophobicContact CD2-CG 4.14Å; Y117-L366 HydrophobicContact CE1-CD2 3.93Å; Y117-L366 HydrophobicContact CE2-CB 3.87Å; Y117-L366 HydrophobicContact CE2-CD2 3.94Å; Y117-L366 HydrophobicContact CE2-CG 4.36Å; Y117-L366 HydrophobicContact CG-CD1 4.36Å; Y117-L366 HydrophobicContact CG-CD2 3.57Å; Y117-L366 HydrophobicContact CG-CG 4.45Å; Y117-L366 PolarHBondContact OH-O 3.45Å; F363-L366 PolarHBondContact O-N 3.38Å
367	T	70.8	Confident	75.1	Confident	8 Å²	8	43.9 Å²	43.9	5%	0.049	21%	0.209	C	C	.	.	S	Bend	trans	-116.1	139.8	177.4	55.4	0	0	0	0	111.2	L41 F114 G372 L377 K378	L41-T367 VanDerWaalsContact CD2-C 3.42Å; L41-T367 WeakPolarHBondContact CD2-O 3.16Å; F114-T367 HydrophobicContact CE1-CG2 3.75Å; F114-T367 HydrophobicContact CZ-CG2 3.73Å; T367-G372 WeakPolarHBondContact OG1-CA 3.48Å; T367-L377 HydrophobicContact CG2-CD1 3.72Å; T367-K378 WeakPolarHBondContact O-CE 3.32Å; T367-K378 PolarHBondContact O-NZ 3.29Å; T367-K378 VanDerWaalsContact O-NZ 3.12Å
368	G	66.4	Low	74.3	Confident	28 Å²	28	43.3 Å²	43.3	29%	0.289	21%	0.206	S	C	.	.			trans	-58.2	148.9	173	0	0	0	0	0	111.5	W370 I371 G372	G368-W370 PolarHBondContact O-N 3.36Å; G368-I371 PolarHBondContact O-N 3.33Å; G368-I371 VanDerWaalsContact O-N 3.13Å; G368-G372 PolarHBondContact O-N 3.22Å
369	N	61.9	Low	73.8	Confident	63 Å²	63	40.6 Å²	40.6	34%	0.337	20%	0.195	S	C	.	.	H	α-helix	trans	-54	-34.9	-171.3	-77.6	-17.2	0	0	0	114.6	K373 K378	N369-K373 WeakPolarHBondContact O-CB 3.4Å; N369-K373 WeakPolarHBondContact O-CG 3.33Å; N369-K373 PolarHBondContact O-N 3.38Å; N369-K373 VanDerWaalsContact O-N 3.08Å; N369-K378 WeakPolarHBondContact OD1-CD 3.34Å; N369-K378 WeakPolarHBondContact OD1-CE 3.13Å; N369-K378 PolarHBondContact OD1-NZ 2.87Å
370	W	48.7	Very low	73.6	Confident	168 Å²	168	47.1 Å²	47.1	64%	0.636	23%	0.225	S	C	*	.	H	α-helix	trans	-71.6	-48.9	178.4	-174.7	74.6	0	0	0	112.7	G368 K373 L374	G368-W370 PolarHBondContact O-N 3.36Å; W370-K373 PolarHBondContact O-N 3.28Å; W370-L374 HydrophobicContact CH2-CD2 4.45Å; W370-L374 WeakPolarHBondContact O-CB 3.22Å; W370-L374 PolarHBondContact O-N 3.18Å
371	I	60.1	Low	73.5	Confident	39 Å²	39	47.9 Å²	47.9	20%	0.2	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-42.1	177.4	-61.8	174.7	0	0	0	110.1	G368 K373 L374 M375	G368-I371 PolarHBondContact O-N 3.33Å; G368-I371 VanDerWaalsContact O-N 3.13Å; I371-K373 PolarHBondContact O-N 3.35Å; I371-L374 PolarHBondContact O-N 3.17Å; I371-M375 HydrophobicContact CG2-CG 4.17Å; I371-M375 WeakPolarHBondContact O-CB 3.28Å; I371-M375 WeakPolarHBondContact O-CG 3.42Å; I371-M375 PolarHBondContact O-N 2.75Å
372	G	60.1	Low	73.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-43.5	178.6	0	0	0	0	0	112.6	T367 G368 K376 L377 K378	T367-G372 WeakPolarHBondContact OG1-CA 3.48Å; G368-G372 PolarHBondContact O-N 3.22Å; G372-K376 CarbonylContact O-C 3.56Å; G372-K376 PolarHBondContact O-N 3.15Å; G372-K376 VanDerWaalsContact O-N 3.15Å; G372-L377 WeakPolarHBondContact O-CA 3.48Å; G372-L377 PolarHBondContact O-N 2.89Å; G372-K378 PolarHBondContact O-N 2.71Å
373	K	60.7	Low	73.3	Confident	118 Å²	118	52 Å²	52	51%	0.513	25%	0.251	S	S	.	.	H	α-helix	trans	-69.7	-41.1	174.9	-74.5	-178.6	178.7	-176.2	0	112.4	N369 W370 I371 M375 K376 K378 G379	N369-K373 WeakPolarHBondContact O-CB 3.4Å; N369-K373 WeakPolarHBondContact O-CG 3.33Å; N369-K373 PolarHBondContact O-N 3.38Å; N369-K373 VanDerWaalsContact O-N 3.08Å; W370-K373 PolarHBondContact O-N 3.28Å; I371-K373 PolarHBondContact O-N 3.35Å; K373-M375 VanDerWaalsContact C-N 3.31Å; K373-M375 PolarHBondContact O-N 2.88Å; K373-K376 PolarHBondContact O-N 3.42Å; K373-K378 HydrophobicContact CG-CB 4.26Å; K373-G379 VanDerWaalsContact CE-O 3.31Å; K373-G379 WeakPolarHBondContact CE-O 3.5Å
374	L	50.2	Low	73.7	Confident	94 Å²	94	54 Å²	54	49%	0.492	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-40	177.8	-178.4	63.9	0	0	0	112.1	W370 I371 K376	W370-L374 HydrophobicContact CH2-CD2 4.45Å; W370-L374 WeakPolarHBondContact O-CB 3.22Å; W370-L374 PolarHBondContact O-N 3.18Å; I371-L374 PolarHBondContact O-N 3.17Å; L374-K376 VanDerWaalsContact C-N 3.31Å
375	M	61.6	Low	74.1	Confident	79 Å²	79	57.3 Å²	57.3	39%	0.389	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	5.8	179.6	-62.3	-63	-72.1	0	0	113.2	M99 I371 K373 L377	M99-M375 HydrophobicContact CE-CE 4.27Å; I371-M375 HydrophobicContact CG2-CG 4.17Å; I371-M375 WeakPolarHBondContact O-CB 3.28Å; I371-M375 WeakPolarHBondContact O-CG 3.42Å; I371-M375 PolarHBondContact O-N 2.75Å; K373-M375 VanDerWaalsContact C-N 3.31Å; K373-M375 PolarHBondContact O-N 2.88Å; M375-L377 HydrophobicContact CB-CD1 3.96Å; M375-L377 HydrophobicContact CB-CG 3.87Å; M375-L377 PolarHBondContact O-N 3.11Å
376	K	69.5	Low	74.5	Confident	154 Å²	154	57 Å²	57	67%	0.67	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	27.5	-174.9	-56.2	-176.8	178.1	-176.5	0	114.3	V356 G372 K373 L374	V356-K376 WeakPolarHBondContact CG2-O 3.17Å; G372-K376 CarbonylContact O-C 3.56Å; G372-K376 PolarHBondContact O-N 3.15Å; G372-K376 VanDerWaalsContact O-N 3.15Å; K373-K376 PolarHBondContact O-N 3.42Å; L374-K376 VanDerWaalsContact C-N 3.31Å
377	L	67.2	Low	75.2	Confident	29 Å²	29	56.9 Å²	56.9	15%	0.152	28%	0.276	C	S	.	.	S	Bend	trans	-83.7	-18.3	172	-58.1	175.3	0	0	0	112.2	Q358 F363 T364 T367 G372 M375	Q358-L377 HydrophobicContact CB-CD2 4.19Å; Q358-L377 HydrophobicContact CG-CD2 3.97Å; F363-L377 HydrophobicContact CB-CD2 4.34Å; T364-L377 WeakPolarHBondContact CB-O 3.14Å; T364-L377 PolarHBondContact OG1-O 2.81Å; T367-L377 HydrophobicContact CG2-CD1 3.72Å; G372-L377 WeakPolarHBondContact O-CA 3.48Å; G372-L377 PolarHBondContact O-N 2.89Å; M375-L377 HydrophobicContact CB-CD1 3.96Å; M375-L377 HydrophobicContact CB-CG 3.87Å; M375-L377 PolarHBondContact O-N 3.11Å
378	K	75.9	Confident	76.5	Confident	20 Å²	20	57.7 Å²	57.7	9%	0.087	28%	0.28	C	S	.	.	S	Bend	trans	-124.3	143.3	173.9	-63.5	-163.9	-166.7	-138.5	0	112	T364 T367 N369 G372 K373 P383	T364-K378 WeakPolarHBondContact O-CE 3.29Å; T364-K378 PolarHBondContact O-NZ 3.18Å; T364-K378 VanDerWaalsContact O-NZ 3.13Å; T367-K378 WeakPolarHBondContact O-CE 3.32Å; T367-K378 PolarHBondContact O-NZ 3.29Å; T367-K378 VanDerWaalsContact O-NZ 3.12Å; N369-K378 WeakPolarHBondContact OD1-CD 3.34Å; N369-K378 WeakPolarHBondContact OD1-CE 3.13Å; N369-K378 PolarHBondContact OD1-NZ 2.87Å; G372-K378 PolarHBondContact O-N 2.71Å; K373-K378 HydrophobicContact CG-CB 4.26Å; K378-P383 HydrophobicContact CD-CG 3.9Å; K378-P383 HydrophobicContact CG-CG 4.27Å
379	G	78.7	Confident	78.1	Confident	4 Å²	4	56.8 Å²	56.8	4%	0.041	27%	0.269	C	S	.	.			trans	-81.4	-164.4	170.2	0	0	0	0	0	112.9	G354 K373	G354-G379 CarbonylContact O-C 3.53Å; G354-G379 WeakPolarHBondContact O-CA 3.49Å; K373-G379 VanDerWaalsContact CE-O 3.31Å; K373-G379 WeakPolarHBondContact CE-O 3.5Å
380	E	87.5	Confident	79.8	Confident	140 Å²	140	53.8 Å²	53.8	65%	0.654	25%	0.253	S	S	*	.	S	Bend	trans	-81.2	-33.3	169.1	-73.1	167	-147.7	0	0	112	K327 G354	K327-E380 IonicContact NZ-OE1 2.69Å; K327-E380 PolarHBondContact NZ-OE1 3Å; G354-E380 PolarHBondContact O-N 3.42Å
381	I	91.3	Very high	82.2	Confident	20 Å²	20	46.1 Å²	46.1	10%	0.103	23%	0.225	C	C	.	.	S	Bend	trans	-72.3	151.9	175	-167.1	169.5	0	0	0	111	I352 T355 L385 A386 L389 N421	I352-I381 HydrophobicContact CG2-CD1 4.21Å; T355-I381 HydrophobicContact CG2-CG2 3.51Å; I381-L385 HydrophobicContact CD1-CD2 4.01Å; I381-L385 HydrophobicContact CD1-CG 4.1Å; I381-L385 HydrophobicContact CG1-CB 4.47Å; I381-L385 HydrophobicContact CG1-CD2 4.02Å; I381-L385 HydrophobicContact CG1-CG 4.34Å; I381-A386 HydrophobicContact CD1-CB 4.42Å; I381-A386 HydrophobicContact CG2-CB 3.86Å; I381-L389 HydrophobicContact CD1-CD1 4.32Å; I381-N421 HydrophobicContact CD1-CB 4.04Å
382	D	91.9	Very high	84	Confident	81 Å²	81	47.1 Å²	47.1	43%	0.433	23%	0.228	S	C	.	.			trans	-60	130.8	169.7	177.4	-98	0	0	0	111	E384 L385 A386	D382-E384 PolarHBondContact O-N 2.88Å; D382-E384 WeakPolarHBondContact OD1-CA 3.34Å; D382-E384 WeakPolarHBondContact OD1-CB 3.17Å; D382-E384 PolarHBondContact OD1-N 2.88Å; D382-L385 HydrophobicContact CB-CB 4.04Å; D382-L385 PolarHBondContact O-N 3.48Å; D382-L385 PolarHBondContact OD1-N 2.85Å; D382-A386 PolarHBondContact O-N 3.24Å
383	P	92.4	Very high	85.9	Confident	10 Å²	10	47.1 Å²	47.1	7%	0.065	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-36.7	-178.6	-25.5	34.9	0	0	0	114.7	T364 F365 K378 A386 I387	T364-P383 HydrophobicContact CG2-CB 3.85Å; F365-P383 HydrophobicContact CD1-CB 3.89Å; F365-P383 HydrophobicContact CE1-CB 3.68Å; K378-P383 HydrophobicContact CD-CG 3.9Å; K378-P383 HydrophobicContact CG-CG 4.27Å; P383-A386 PolarHBondContact O-N 2.78Å; P383-I387 PolarHBondContact O-N 3.25Å
384	E	94.6	Very high	87.7	Confident	67 Å²	67	41.6 Å²	41.6	31%	0.313	20%	0.204	S	C	.	.	H	α-helix	trans	-69.4	-40.3	178.4	-66.5	-174.4	-151.3	0	0	110.9	P44 F365 D382 I387 D388	P44-E384 HydrophobicContact CB-CG 4.19Å; P44-E384 HydrophobicContact CG-CG 4.49Å; F365-E384 HydrophobicContact CE1-CG 4.31Å; D382-E384 PolarHBondContact O-N 2.88Å; D382-E384 WeakPolarHBondContact OD1-CA 3.34Å; D382-E384 WeakPolarHBondContact OD1-CB 3.17Å; D382-E384 PolarHBondContact OD1-N 2.88Å; E384-I387 WeakPolarHBondContact O-CG2 3.43Å; E384-D388 VanDerWaalsContact O-CB 3.27Å; E384-D388 WeakPolarHBondContact O-CB 3.47Å; E384-D388 PolarHBondContact O-N 3.22Å
385	L	96.2	Very high	90	Very high	68 Å²	68	37.1 Å²	37.1	36%	0.356	18%	0.18	S	C	.	.	H	α-helix	trans	-62.5	-42.3	173.1	179	59.9	0	0	0	112	I381 D382 D388 L389	I381-L385 HydrophobicContact CD1-CD2 4.01Å; I381-L385 HydrophobicContact CD1-CG 4.1Å; I381-L385 HydrophobicContact CG1-CB 4.47Å; I381-L385 HydrophobicContact CG1-CD2 4.02Å; I381-L385 HydrophobicContact CG1-CG 4.34Å; D382-L385 HydrophobicContact CB-CB 4.04Å; D382-L385 PolarHBondContact O-N 3.48Å; D382-L385 PolarHBondContact OD1-N 2.85Å; L385-D388 PolarHBondContact O-N 2.99Å; L385-L389 HydrophobicContact CD1-CD1 4.33Å; L385-L389 HydrophobicContact CD1-CG 4.39Å; L385-L389 HydrophobicContact CG-CD1 4.27Å; L385-L389 WeakPolarHBondContact O-CG 3.34Å; L385-L389 PolarHBondContact O-N 3.03Å
386	A	97	Very high	91.8	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-47.2	179.6	0	0	0	0	0	112	T355 I381 D382 P383 D388 L389 S390	T355-A386 HydrophobicContact CG2-CB 3.76Å; I381-A386 HydrophobicContact CD1-CB 4.42Å; I381-A386 HydrophobicContact CG2-CB 3.86Å; D382-A386 PolarHBondContact O-N 3.24Å; P383-A386 PolarHBondContact O-N 2.78Å; A386-D388 VanDerWaalsContact C-N 3.32Å; A386-D388 PolarHBondContact O-N 3.11Å; A386-L389 PolarHBondContact O-N 3.13Å; A386-S390 PolarHBondContact O-N 3.09Å; A386-S390 VanDerWaalsContact O-N 3.14Å
387	I	97.3	Very high	93.2	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-68.7	-34	179.3	-155.5	63.6	0	0	0	111.5	P44 A151 I152 F365 P383 E384 S390 N391	P44-I387 HydrophobicContact CG-CG2 4.45Å; A151-I387 HydrophobicContact CB-CG1 4.34Å; I152-I387 HydrophobicContact CD1-CD1 4.06Å; I152-I387 HydrophobicContact CG1-CD1 3.69Å; I152-I387 HydrophobicContact CG1-CG1 4.34Å; F365-I387 HydrophobicContact CE1-CG2 4.16Å; F365-I387 HydrophobicContact CZ-CB 3.88Å; F365-I387 HydrophobicContact CZ-CG1 4.19Å; F365-I387 HydrophobicContact CZ-CG2 3.71Å; P383-I387 PolarHBondContact O-N 3.25Å; E384-I387 WeakPolarHBondContact O-CG2 3.43Å; I387-S390 PolarHBondContact O-N 2.8Å; I387-N391 VanDerWaalsContact O-CB 3.3Å; I387-N391 WeakPolarHBondContact O-CB 3.42Å; I387-N391 PolarHBondContact O-N 3.22Å
388	D	98.1	Very high	94.7	Very high	25 Å²	25	24.7 Å²	24.7	13%	0.134	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-46.8	173.6	-96.1	20.9	0	0	0	112.7	K47 E384 L385 A386 S390 N391 K392	K47-D388 IonicContact NZ-OD1 2.69Å; K47-D388 PolarHBondContact NZ-OD1 3.33Å; K47-D388 IonicContact NZ-OD2 3.71Å; K47-D388 PolarHBondContact NZ-OD2 3.17Å; E384-D388 VanDerWaalsContact O-CB 3.27Å; E384-D388 WeakPolarHBondContact O-CB 3.47Å; E384-D388 PolarHBondContact O-N 3.22Å; L385-D388 PolarHBondContact O-N 2.99Å; A386-D388 VanDerWaalsContact C-N 3.32Å; A386-D388 PolarHBondContact O-N 3.11Å; D388-S390 VanDerWaalsContact C-N 3.32Å; D388-N391 PolarHBondContact O-N 2.98Å; D388-K392 VanDerWaalsContact O-CB 3.26Å; D388-K392 WeakPolarHBondContact O-CB 3.21Å; D388-K392 VanDerWaalsContact O-CG 3.23Å; D388-K392 WeakPolarHBondContact O-CG 3.35Å; D388-K392 PolarHBondContact O-N 3.27Å; D388-K392 IonicContact OD2-NZ 3.44Å; D388-K392 PolarHBondContact OD2-NZ 3.36Å
389	L	98.6	Very high	95.8	Very high	9 Å²	9	24.7 Å²	24.7	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-44.7	177.7	-73.1	166.5	0	0	0	110.5	I352 I381 L385 A386 A393 L414 D419 N421 L422	I352-L389 HydrophobicContact CG2-CD1 4.13Å; I381-L389 HydrophobicContact CD1-CD1 4.32Å; L385-L389 HydrophobicContact CD1-CD1 4.33Å; L385-L389 HydrophobicContact CD1-CG 4.39Å; L385-L389 HydrophobicContact CG-CD1 4.27Å; L385-L389 WeakPolarHBondContact O-CG 3.34Å; L385-L389 PolarHBondContact O-N 3.03Å; A386-L389 PolarHBondContact O-N 3.13Å; L389-A393 VanDerWaalsContact O-CB 3.23Å; L389-A393 WeakPolarHBondContact O-CB 3.07Å; L389-A393 PolarHBondContact O-N 3Å; L389-L414 HydrophobicContact CD2-CD1 4.4Å; L389-L414 HydrophobicContact CD2-CD2 4.22Å; L389-D419 HydrophobicContact CD2-CB 4.37Å; L389-N421 HydrophobicContact CD1-CB 3.66Å; L389-L422 HydrophobicContact CB-CD2 4.45Å; L389-L422 HydrophobicContact CD1-CD2 4.42Å; L389-L422 HydrophobicContact CD2-CD1 4.45Å; L389-L422 HydrophobicContact CD2-CG 4.49Å
390	S	98.7	Very high	96.7	Very high	1 Å²	1	28 Å²	28	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-48.8	176.5	-174.7	0	0	0	0	112	A386 I387 D388 T394	A386-S390 PolarHBondContact O-N 3.09Å; A386-S390 VanDerWaalsContact O-N 3.14Å; I387-S390 PolarHBondContact O-N 2.8Å; D388-S390 VanDerWaalsContact C-N 3.32Å; S390-T394 VanDerWaalsContact O-CB 3.27Å; S390-T394 WeakPolarHBondContact O-CB 3.46Å; S390-T394 PolarHBondContact O-N 3.34Å; S390-T394 PolarHBondContact O-OG1 3.09Å
391	N	98.8	Very high	97.2	Very high	6 Å²	6	22.9 Å²	22.9	3%	0.032	11%	0.11	C	C	.	.	H	α-helix	trans	-67.6	-45.2	-177	-72.2	-9.8	0	0	0	111.7	E155 I387 D388 T394 L395	E155-N391 WeakPolarHBondContact CB-ND2 3.32Å; E155-N391 HydrophobicContact CG-CB 3.89Å; E155-N391 WeakPolarHBondContact CG-ND2 3.37Å; I387-N391 VanDerWaalsContact O-CB 3.3Å; I387-N391 WeakPolarHBondContact O-CB 3.42Å; I387-N391 PolarHBondContact O-N 3.22Å; D388-N391 PolarHBondContact O-N 2.98Å; N391-T394 WeakPolarHBondContact O-CB 3.42Å; N391-T394 PolarHBondContact O-N 3.04Å; N391-L395 WeakPolarHBondContact O-CB 3.46Å; N391-L395 VanDerWaalsContact O-CG 3.29Å; N391-L395 WeakPolarHBondContact O-CG 3.25Å; N391-L395 PolarHBondContact O-N 2.96Å
392	K	98.8	Very high	97.5	Very high	61 Å²	61	22.2 Å²	22.2	27%	0.265	11%	0.107	S	C	.	.	H	α-helix	trans	-63.7	-44	178.1	-72.7	170.7	177.9	159	0	112.1	D388 T394 L395 A396 W411 L414	D388-K392 VanDerWaalsContact O-CB 3.26Å; D388-K392 WeakPolarHBondContact O-CB 3.21Å; D388-K392 VanDerWaalsContact O-CG 3.23Å; D388-K392 WeakPolarHBondContact O-CG 3.35Å; D388-K392 PolarHBondContact O-N 3.27Å; D388-K392 IonicContact OD2-NZ 3.44Å; D388-K392 PolarHBondContact OD2-NZ 3.36Å; K392-T394 VanDerWaalsContact C-N 3.32Å; K392-T394 PolarHBondContact O-N 3.23Å; K392-L395 PolarHBondContact O-N 3.15Å; K392-A396 PolarHBondContact O-N 3.35Å; K392-W411 HydrophobicContact CB-CB 4.14Å; K392-W411 HydrophobicContact CB-CD2 3.69Å; K392-W411 HydrophobicContact CB-CE3 3.96Å; K392-W411 HydrophobicContact CB-CG 3.76Å; K392-W411 HydrophobicContact CD-CD2 4.29Å; K392-W411 HydrophobicContact CD-CG 4.4Å; K392-W411 HydrophobicContact CD-CZ2 4.42Å; K392-W411 HydrophobicContact CG-CD2 3.72Å; K392-W411 HydrophobicContact CG-CE3 4.06Å; K392-W411 HydrophobicContact CG-CG 4.13Å; K392-W411 HydrophobicContact CG-CH2 4.35Å; K392-W411 HydrophobicContact CG-CZ2 4.05Å; K392-W411 HydrophobicContact CG-CZ3 4.36Å; K392-L414 HydrophobicContact CB-CD1 3.59Å
393	A	98.8	Very high	97.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.1	-39.2	175.6	0	0	0	0	0	111.4	F321 I323 I350 L389 F397 L414	F321-A393 HydrophobicContact CE1-CB 3.77Å; F321-A393 HydrophobicContact CZ-CB 4.1Å; I323-A393 HydrophobicContact CD1-CB 4.37Å; I350-A393 HydrophobicContact CD1-CB 3.98Å; L389-A393 VanDerWaalsContact O-CB 3.23Å; L389-A393 WeakPolarHBondContact O-CB 3.07Å; L389-A393 PolarHBondContact O-N 3Å; A393-F397 WeakPolarHBondContact O-CB 3.16Å; A393-F397 PolarHBondContact O-N 2.92Å; A393-L414 HydrophobicContact CB-CB 3.86Å
394	T	98.9	Very high	98	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-50	173.6	-64.4	0	0	0	0	111.3	L156 I276 V299 I323 S390 N391 K392 A396 F397 L398	L156-T394 HydrophobicContact CD2-CG2 4.28Å; I276-T394 HydrophobicContact CD1-CG2 3.72Å; V299-T394 HydrophobicContact CG2-CG2 4.22Å; I323-T394 WeakPolarHBondContact CD1-OG1 3.34Å; S390-T394 VanDerWaalsContact O-CB 3.27Å; S390-T394 WeakPolarHBondContact O-CB 3.46Å; S390-T394 PolarHBondContact O-N 3.34Å; S390-T394 PolarHBondContact O-OG1 3.09Å; N391-T394 WeakPolarHBondContact O-CB 3.42Å; N391-T394 PolarHBondContact O-N 3.04Å; K392-T394 VanDerWaalsContact C-N 3.32Å; K392-T394 PolarHBondContact O-N 3.23Å; T394-A396 PolarHBondContact O-N 3.19Å; T394-F397 PolarHBondContact O-N 3.4Å; T394-F397 VanDerWaalsContact O-N 3.17Å; T394-L398 HydrophobicContact CG2-CD1 3.9Å; T394-L398 HydrophobicContact CG2-CG 4.22Å; T394-L398 WeakPolarHBondContact O-CB 3.49Å; T394-L398 VanDerWaalsContact O-CG 3.28Å; T394-L398 WeakPolarHBondContact O-CG 3.29Å; T394-L398 PolarHBondContact O-N 3.35Å
395	L	98.9	Very high	98	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-43.7	-179.8	-73.8	164.4	0	0	0	112.2	L156 Q159 F161 N391 K392 F397 L398 Q399 F408 W411	L156-L395 HydrophobicContact CD2-CD2 3.77Å; L156-L395 HydrophobicContact CD2-CG 4.28Å; Q159-L395 HydrophobicContact CB-CD2 3.88Å; Q159-L395 HydrophobicContact CG-CD1 3.82Å; Q159-L395 HydrophobicContact CG-CD2 3.91Å; F161-L395 HydrophobicContact CD2-CD2 4.44Å; F161-L395 HydrophobicContact CE2-CD2 3.67Å; F161-L395 HydrophobicContact CZ-CD2 4.32Å; N391-L395 WeakPolarHBondContact O-CB 3.46Å; N391-L395 VanDerWaalsContact O-CG 3.29Å; N391-L395 WeakPolarHBondContact O-CG 3.25Å; N391-L395 PolarHBondContact O-N 2.96Å; K392-L395 PolarHBondContact O-N 3.15Å; L395-F397 VanDerWaalsContact C-N 3.34Å; L395-F397 PolarHBondContact O-N 3.4Å; L395-L398 PolarHBondContact O-N 2.99Å; L395-Q399 WeakPolarHBondContact O-CB 3.41Å; L395-Q399 PolarHBondContact O-N 2.93Å; L395-F408 HydrophobicContact CB-CB 4.07Å; L395-F408 HydrophobicContact CB-CD1 4.33Å; L395-F408 HydrophobicContact CB-CD2 4.02Å; L395-F408 HydrophobicContact CB-CG 3.9Å; L395-F408 HydrophobicContact CD2-CD2 4.14Å; L395-F408 HydrophobicContact CD2-CE2 3.9Å; L395-F408 HydrophobicContact CD2-CZ 4.13Å; L395-W411 HydrophobicContact CB-CE3 4.09Å; L395-W411 HydrophobicContact CB-CZ3 3.89Å; L395-W411 HydrophobicContact CD1-CE3 4.45Å; L395-W411 HydrophobicContact CD1-CH2 4.28Å; L395-W411 HydrophobicContact CD1-CZ3 3.64Å; L395-W411 HydrophobicContact CG-CZ3 4.42Å
396	A	98.8	Very high	98	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-43.6	175	0	0	0	0	0	111.6	K392 T394 Q399 R400 F408 W411 I415	K392-A396 PolarHBondContact O-N 3.35Å; T394-A396 PolarHBondContact O-N 3.19Å; A396-Q399 PolarHBondContact O-N 3.3Å; A396-R400 PolarHBondContact O-N 2.95Å; A396-F408 WeakPolarHBondContact CB-O 3.13Å; A396-W411 HydrophobicContact CB-CB 4.07Å; A396-I415 HydrophobicContact CB-CD1 3.6Å; A396-I415 HydrophobicContact CB-CG1 4.01Å
397	F	98.8	Very high	98	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.8	-43.9	179.1	-176.9	-96.6	0	0	0	111.9	C297 G298 V299 P319 F321 K348 A393 T394 L395 Q399 R400 H401 I415	C297-F397 HydrophobicContact CB-CE1 3.96Å; G298-F397 WeakPolarHBondContact O-CE1 3.39Å; V299-F397 HydrophobicContact CG2-CD1 3.68Å; V299-F397 HydrophobicContact CG2-CE1 4.12Å; P319-F397 HydrophobicContact CB-CE2 4.46Å; P319-F397 HydrophobicContact CB-CZ 3.78Å; F321-F397 HydrophobicContact CB-CD1 3.76Å; F321-F397 HydrophobicContact CB-CD2 3.71Å; F321-F397 HydrophobicContact CB-CE1 3.72Å; F321-F397 HydrophobicContact CB-CE2 3.68Å; F321-F397 HydrophobicContact CB-CG 3.75Å; F321-F397 HydrophobicContact CB-CZ 3.69Å; F321-F397 HydrophobicContact CD1-CB 3.73Å; F321-F397 HydrophobicContact CD1-CD1 4.36Å; F321-F397 HydrophobicContact CD1-CD2 4.07Å; F321-F397 AromaticContact CD1-CG 3.79Å; F321-F397 HydrophobicContact CD1-CG 3.79Å; F321-F397 HydrophobicContact CE1-CB 4.29Å; F321-F397 HydrophobicContact CG-CB 4.49Å; F321-F397 HydrophobicContact CG-CD2 4.01Å; F321-F397 HydrophobicContact CG-CE2 4.37Å; F321-F397 HydrophobicContact CG-CG 4.08Å; K348-F397 HydrophobicContact CG-CE2 4.45Å; A393-F397 WeakPolarHBondContact O-CB 3.16Å; A393-F397 PolarHBondContact O-N 2.92Å; T394-F397 PolarHBondContact O-N 3.4Å; T394-F397 VanDerWaalsContact O-N 3.17Å; L395-F397 VanDerWaalsContact C-N 3.34Å; L395-F397 PolarHBondContact O-N 3.4Å; F397-Q399 VanDerWaalsContact C-N 3.34Å; F397-Q399 PolarHBondContact O-N 2.83Å; F397-R400 PolarHBondContact O-N 3.2Å; F397-H401 AromaticContact CD2-CD2 3.5Å; F397-H401 AromaticContact CD2-NE2 3.62Å; F397-H401 AromaticContact CE1-CD2 3.76Å; F397-H401 AromaticContact CE2-CD2 3.19Å; F397-H401 WeakPolarHBondContact CE2-CD2 3.33Å; F397-H401 AromaticContact CE2-NE2 3.15Å; F397-H401 WeakPolarHBondContact CE2-NE2 3.43Å; F397-H401 AromaticContact CG-CD2 3.91Å; F397-H401 AromaticContact CZ-CD2 3.33Å; F397-H401 WeakPolarHBondContact CZ-CD2 3.21Å; F397-H401 AromaticContact CZ-NE2 3.67Å; F397-H401 PolarHBondContact O-CD2 2.93Å; F397-H401 VanDerWaalsContact O-CD2 3.26Å; F397-H401 PolarHBondContact O-N 2.61Å; F397-H401 VanDerWaalsContact O-N 3.15Å; F397-I415 HydrophobicContact CB-CD1 4.16Å; F397-I415 HydrophobicContact CB-CG1 4.37Å; F397-I415 HydrophobicContact CD2-CG2 4.4Å
398	L	98.9	Very high	98.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-44.2	174.6	-68.7	176.2	0	0	0	110.8	V136 L156 F161 A274 I276 T394 L395 R400 H401 L402 L404	V136-L398 HydrophobicContact CG2-CD1 4.44Å; L156-L398 HydrophobicContact CD2-CD1 3.95Å; F161-L398 HydrophobicContact CE1-CB 4.39Å; F161-L398 HydrophobicContact CE1-CD1 3.8Å; F161-L398 HydrophobicContact CZ-CB 4.17Å; F161-L398 HydrophobicContact CZ-CD1 3.82Å; A274-L398 HydrophobicContact CB-CD2 3.52Å; I276-L398 HydrophobicContact CD1-CD1 4.22Å; T394-L398 HydrophobicContact CG2-CD1 3.9Å; T394-L398 HydrophobicContact CG2-CG 4.22Å; T394-L398 WeakPolarHBondContact O-CB 3.49Å; T394-L398 VanDerWaalsContact O-CG 3.28Å; T394-L398 WeakPolarHBondContact O-CG 3.29Å; T394-L398 PolarHBondContact O-N 3.35Å; L395-L398 PolarHBondContact O-N 2.99Å; L398-R400 PolarHBondContact O-N 2.91Å; L398-H401 PolarHBondContact O-N 3.15Å; L398-L402 HydrophobicContact CB-CD1 4.31Å; L398-L402 HydrophobicContact CD2-CD1 4.15Å; L398-L402 WeakPolarHBondContact O-CA 3.49Å; L398-L402 WeakPolarHBondContact O-CB 3.35Å; L398-L402 VanDerWaalsContact O-CG 3.29Å; L398-L402 WeakPolarHBondContact O-CG 3.26Å; L398-L402 PolarHBondContact O-N 3.13Å; L398-L404 HydrophobicContact CB-CD1 4.47Å
399	Q	98.6	Very high	98.1	Very high	21 Å²	21	39.2 Å²	39.2	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-58	-48.8	176.1	171	159.7	-38.7	0	0	112.3	L395 A396 F397 H401 H403 L404 K406 F408 N409	L395-Q399 WeakPolarHBondContact O-CB 3.41Å; L395-Q399 PolarHBondContact O-N 2.93Å; A396-Q399 PolarHBondContact O-N 3.3Å; F397-Q399 VanDerWaalsContact C-N 3.34Å; F397-Q399 PolarHBondContact O-N 2.83Å; Q399-H401 VanDerWaalsContact C-N 3.29Å; Q399-H401 PolarHBondContact O-N 3.17Å; Q399-H403 WeakPolarHBondContact O-CA 3.37Å; Q399-H403 PolarHBondContact O-N 3.35Å; Q399-L404 HydrophobicContact CB-CB 4.1Å; Q399-L404 HydrophobicContact CB-CD1 4.43Å; Q399-L404 HydrophobicContact CB-CG 4.48Å; Q399-L404 HydrophobicContact CG-CB 4.08Å; Q399-L404 WeakPolarHBondContact CG-O 3.49Å; Q399-L404 PolarHBondContact O-N 2.98Å; Q399-L404 VanDerWaalsContact O-N 3.14Å; Q399-K406 PolarHBondContact NE2-O 3.46Å; Q399-K406 VanDerWaalsContact OE1-CB 3.3Å; Q399-K406 PolarHBondContact OE1-O 3.39Å; Q399-F408 HydrophobicContact CB-CB 4.03Å; Q399-F408 HydrophobicContact CB-CD2 4.14Å; Q399-N409 PolarHBondContact NE2-OD1 2.84Å
400	R	97.6	Very high	98.1	Very high	74 Å²	74	44.7 Å²	44.7	28%	0.279	21%	0.21	S	C	.	.	H	α-helix	trans	-57.4	-41.2	-179.2	-175.4	-177	-63.9	-176	-1.6	112.6	D346 A396 F397 L398 D412	D346-R400 IonicContact OD2-NH1 3.61Å; D346-R400 PolarHBondContact OD2-NH1 3.13Å; A396-R400 PolarHBondContact O-N 2.95Å; F397-R400 PolarHBondContact O-N 3.2Å; L398-R400 PolarHBondContact O-N 2.91Å; R400-D412 IonicContact CZ-OD1 3.71Å; R400-D412 IonicContact NE-OD1 2.91Å; R400-D412 IonicContact NH2-OD1 3.63Å; R400-D412 PolarHBondContact NH2-OD1 2.97Å
401	H	98.3	Very high	98.1	Very high	32 Å²	32	46.8 Å²	46.8	15%	0.148	22%	0.218	C	C	.	.	H	α-helix	trans	-104.8	-12	-170.5	-62.3	-59.5	0	0	0	115.2	C297 P319 D346 F397 L398 Q399	C297-H401 HydrophobicContact CB-CB 3.79Å; P319-H401 HydrophobicContact CB-CB 4.42Å; P319-H401 HydrophobicContact CG-CB 4.32Å; P319-H401 WeakPolarHBondContact CG-ND1 3.37Å; D346-H401 IonicContact OD2-CE1 2.86Å; D346-H401 IonicContact OD2-NE2 3.47Å; F397-H401 AromaticContact CD2-CD2 3.5Å; F397-H401 AromaticContact CD2-NE2 3.62Å; F397-H401 AromaticContact CE1-CD2 3.76Å; F397-H401 AromaticContact CE2-CD2 3.19Å; F397-H401 WeakPolarHBondContact CE2-CD2 3.33Å; F397-H401 AromaticContact CE2-NE2 3.15Å; F397-H401 WeakPolarHBondContact CE2-NE2 3.43Å; F397-H401 AromaticContact CG-CD2 3.91Å; F397-H401 AromaticContact CZ-CD2 3.33Å; F397-H401 WeakPolarHBondContact CZ-CD2 3.21Å; F397-H401 AromaticContact CZ-NE2 3.67Å; F397-H401 PolarHBondContact O-CD2 2.93Å; F397-H401 VanDerWaalsContact O-CD2 3.26Å; F397-H401 PolarHBondContact O-N 2.61Å; F397-H401 VanDerWaalsContact O-N 3.15Å; L398-H401 PolarHBondContact O-N 3.15Å; Q399-H401 VanDerWaalsContact C-N 3.29Å; Q399-H401 PolarHBondContact O-N 3.17Å
402	L	98.4	Very high	98	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-103.5	1.1	169.2	-54.3	-177.7	0	0	0	112.4	P134 F161 R272 A274 K296 L398 L404	P134-L402 HydrophobicContact CB-CD1 4.48Å; F161-L402 HydrophobicContact CE1-CD1 4.35Å; R272-L402 HydrophobicContact CB-CB 4.19Å; R272-L402 HydrophobicContact CG-CB 4.5Å; A274-L402 HydrophobicContact CB-CD1 4.18Å; K296-L402 HydrophobicContact CB-CD2 3.62Å; K296-L402 HydrophobicContact CG-CD2 4.27Å; L398-L402 HydrophobicContact CB-CD1 4.31Å; L398-L402 HydrophobicContact CD2-CD1 4.15Å; L398-L402 WeakPolarHBondContact O-CA 3.49Å; L398-L402 WeakPolarHBondContact O-CB 3.35Å; L398-L402 VanDerWaalsContact O-CG 3.29Å; L398-L402 WeakPolarHBondContact O-CG 3.26Å; L398-L402 PolarHBondContact O-N 3.13Å; L402-L404 VanDerWaalsContact C-N 3.34Å; L402-L404 HydrophobicContact CB-CD2 3.78Å; L402-L404 HydrophobicContact CB-CG 3.97Å; L402-L404 PolarHBondContact O-N 3.05Å
403	H	97.2	Very high	98	Very high	143 Å²	143	48.7 Å²	48.7	66%	0.662	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	45.5	-178.8	-54.7	-68.6	0	0	0	112.9	R272 Q399	R272-H403 PolarHBondContact NH1-O 3.41Å; R272-H403 PolarHBondContact NH2-O 3.4Å; Q399-H403 WeakPolarHBondContact O-CA 3.37Å; Q399-H403 PolarHBondContact O-N 3.35Å
404	L	97.4	Very high	98	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	24%	0.239	C	C	.	.			trans	-71.3	139.3	-179.5	-51.8	-178.6	0	0	0	111.7	P134 F161 L398 Q399 L402 K406 F408	P134-L404 HydrophobicContact CB-CD2 4.11Å; P134-L404 HydrophobicContact CG-CD2 4.07Å; F161-L404 HydrophobicContact CE1-CD1 3.85Å; F161-L404 HydrophobicContact CE2-CD1 4.25Å; F161-L404 HydrophobicContact CZ-CD1 3.33Å; L398-L404 HydrophobicContact CB-CD1 4.47Å; Q399-L404 HydrophobicContact CB-CB 4.1Å; Q399-L404 HydrophobicContact CB-CD1 4.43Å; Q399-L404 HydrophobicContact CB-CG 4.48Å; Q399-L404 HydrophobicContact CG-CB 4.08Å; Q399-L404 WeakPolarHBondContact CG-O 3.49Å; Q399-L404 PolarHBondContact O-N 2.98Å; Q399-L404 VanDerWaalsContact O-N 3.14Å; L402-L404 VanDerWaalsContact C-N 3.34Å; L402-L404 HydrophobicContact CB-CD2 3.78Å; L402-L404 HydrophobicContact CB-CG 3.97Å; L402-L404 PolarHBondContact O-N 3.05Å; L404-K406 VanDerWaalsContact C-N 3.31Å; L404-K406 HydrophobicContact CB-CG 4.4Å; L404-K406 PolarHBondContact O-N 2.92Å; L404-F408 HydrophobicContact CD1-CD2 4.49Å; L404-F408 HydrophobicContact CD1-CE2 4.38Å
405	E	95.1	Very high	98	Very high	173 Å²	173	49.5 Å²	49.5	81%	0.808	24%	0.239	S	C	*	.			trans	-94	66.4	174.4	-64.9	-178.6	-168.9	0	0	109.2
406	K	95.8	Very high	97.9	Very high	71 Å²	71	52.2 Å²	52.2	31%	0.309	25%	0.253	S	S	.	.	S	Bend	trans	-131	174.5	177.9	-61.4	-66.3	-177.2	-168.2	0	109.4	E131 Q399 L404 F408	E131-K406 WeakPolarHBondContact OE1-CE 3.42Å; E131-K406 IonicContact OE1-NZ 2.61Å; E131-K406 PolarHBondContact OE1-NZ 2.93Å; E131-K406 IonicContact OE2-NZ 3.67Å; Q399-K406 PolarHBondContact NE2-O 3.46Å; Q399-K406 VanDerWaalsContact OE1-CB 3.3Å; Q399-K406 PolarHBondContact OE1-O 3.39Å; L404-K406 VanDerWaalsContact C-N 3.31Å; L404-K406 HydrophobicContact CB-CG 4.4Å; L404-K406 PolarHBondContact O-N 2.92Å; K406-F408 VanDerWaalsContact C-N 3.31Å; K406-F408 HydrophobicContact CB-CD1 4.19Å; K406-F408 HydrophobicContact CB-CD2 3.77Å; K406-F408 HydrophobicContact CB-CE1 4.07Å; K406-F408 HydrophobicContact CB-CE2 3.63Å; K406-F408 HydrophobicContact CB-CG 4.03Å; K406-F408 HydrophobicContact CB-CZ 3.77Å; K406-F408 HydrophobicContact CD-CZ 4.34Å; K406-F408 HydrophobicContact CG-CD2 4.28Å; K406-F408 HydrophobicContact CG-CE2 3.66Å; K406-F408 HydrophobicContact CG-CZ 3.79Å; K406-F408 PolarHBondContact O-N 3.27Å
407	D	97.4	Very high	97.8	Very high	120 Å²	120	52.4 Å²	52.4	64%	0.642	26%	0.255	S	S	*	.	S	Bend	trans	-93.2	22.1	177.7	-62.4	-41.3	0	0	0	112.7	N409 Q410	D407-N409 VanDerWaalsContact C-OD1 3.27Å; D407-N409 WeakPolarHBondContact CA-OD1 3.34Å; D407-N409 PolarHBondContact O-N 2.98Å; D407-N409 PolarHBondContact O-OD1 3.23Å; D407-Q410 WeakPolarHBondContact O-CB 3.37Å; D407-Q410 WeakPolarHBondContact O-CG 3.22Å; D407-Q410 PolarHBondContact O-N 3.41Å; D407-Q410 PolarHBondContact O-NE2 3.44Å
408	F	98.5	Very high	97.8	Very high	10 Å²	10	58.4 Å²	58.4	4%	0.044	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-71.2	-18.3	-177.3	-50.1	-34.5	0	0	0	112.9	Q159 F161 L395 A396 Q399 L404 K406 Q410 W411	Q159-F408 HydrophobicContact CB-CE1 4.34Å; Q159-F408 HydrophobicContact CB-CZ 3.77Å; Q159-F408 HydrophobicContact CG-CE1 4.42Å; Q159-F408 HydrophobicContact CG-CZ 4.33Å; F161-F408 AromaticContact CE2-CE2 3.94Å; F161-F408 HydrophobicContact CE2-CE2 3.94Å; F161-F408 HydrophobicContact CZ-CE2 4.39Å; L395-F408 HydrophobicContact CB-CB 4.07Å; L395-F408 HydrophobicContact CB-CD1 4.33Å; L395-F408 HydrophobicContact CB-CD2 4.02Å; L395-F408 HydrophobicContact CB-CG 3.9Å; L395-F408 HydrophobicContact CD2-CD2 4.14Å; L395-F408 HydrophobicContact CD2-CE2 3.9Å; L395-F408 HydrophobicContact CD2-CZ 4.13Å; A396-F408 WeakPolarHBondContact CB-O 3.13Å; Q399-F408 HydrophobicContact CB-CB 4.03Å; Q399-F408 HydrophobicContact CB-CD2 4.14Å; L404-F408 HydrophobicContact CD1-CD2 4.49Å; L404-F408 HydrophobicContact CD1-CE2 4.38Å; K406-F408 VanDerWaalsContact C-N 3.31Å; K406-F408 HydrophobicContact CB-CD1 4.19Å; K406-F408 HydrophobicContact CB-CD2 3.77Å; K406-F408 HydrophobicContact CB-CE1 4.07Å; K406-F408 HydrophobicContact CB-CE2 3.63Å; K406-F408 HydrophobicContact CB-CG 4.03Å; K406-F408 HydrophobicContact CB-CZ 3.77Å; K406-F408 HydrophobicContact CD-CZ 4.34Å; K406-F408 HydrophobicContact CG-CD2 4.28Å; K406-F408 HydrophobicContact CG-CE2 3.66Å; K406-F408 HydrophobicContact CG-CZ 3.79Å; K406-F408 PolarHBondContact O-N 3.27Å; F408-Q410 PolarHBondContact O-N 2.97Å; F408-Q410 VanDerWaalsContact O-N 3.13Å; F408-W411 HydrophobicContact CB-CE3 4.02Å; F408-W411 HydrophobicContact CB-CZ3 4.03Å; F408-W411 HydrophobicContact CD1-CE3 4.28Å; F408-W411 HydrophobicContact CD1-CH2 4.04Å; F408-W411 AromaticContact CD1-CZ3 3.44Å; F408-W411 HydrophobicContact CD1-CZ3 3.44Å; F408-W411 VanDerWaalsContact CD1-CZ3 3.44Å; F408-W411 HydrophobicContact CE1-CZ3 4.26Å; F408-W411 HydrophobicContact CG-CZ3 4.03Å; F408-W411 PolarHBondContact O-N 3.43Å
409	N	97.6	Very high	97.7	Very high	79 Å²	79	61.1 Å²	61.1	42%	0.422	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-57.6	-19.3	169.5	63.1	-39.2	0	0	0	113.3	Q399 D407 W411 D412	Q399-N409 PolarHBondContact NE2-OD1 2.84Å; D407-N409 VanDerWaalsContact C-OD1 3.27Å; D407-N409 WeakPolarHBondContact CA-OD1 3.34Å; D407-N409 PolarHBondContact O-N 2.98Å; D407-N409 PolarHBondContact O-OD1 3.23Å; N409-W411 PolarHBondContact O-N 2.89Å; N409-D412 WeakPolarHBondContact CB-OD2 3.27Å; N409-D412 VanDerWaalsContact O-CB 3.27Å; N409-D412 WeakPolarHBondContact O-CB 3.36Å; N409-D412 PolarHBondContact O-N 2.98Å
410	Q	98.1	Very high	97.7	Very high	124 Å²	124	68.5 Å²	68.5	58%	0.579	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-57.2	-21.8	170.2	78.8	-174.2	-92.9	0	0	112.7	D407 F408	D407-Q410 WeakPolarHBondContact O-CB 3.37Å; D407-Q410 WeakPolarHBondContact O-CG 3.22Å; D407-Q410 PolarHBondContact O-N 3.41Å; D407-Q410 PolarHBondContact O-NE2 3.44Å; F408-Q410 PolarHBondContact O-N 2.97Å; F408-Q410 VanDerWaalsContact O-N 3.13Å
411	W	98.6	Very high	97.7	Very high	46 Å²	46	66.5 Å²	66.5	17%	0.174	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-103.8	11.5	176.7	-50.8	-49.4	0	0	0	113.6	K392 L395 A396 F408 N409 P413 L414	K392-W411 HydrophobicContact CB-CB 4.14Å; K392-W411 HydrophobicContact CB-CD2 3.69Å; K392-W411 HydrophobicContact CB-CE3 3.96Å; K392-W411 HydrophobicContact CB-CG 3.76Å; K392-W411 HydrophobicContact CD-CD2 4.29Å; K392-W411 HydrophobicContact CD-CG 4.4Å; K392-W411 HydrophobicContact CD-CZ2 4.42Å; K392-W411 HydrophobicContact CG-CD2 3.72Å; K392-W411 HydrophobicContact CG-CE3 4.06Å; K392-W411 HydrophobicContact CG-CG 4.13Å; K392-W411 HydrophobicContact CG-CH2 4.35Å; K392-W411 HydrophobicContact CG-CZ2 4.05Å; K392-W411 HydrophobicContact CG-CZ3 4.36Å; L395-W411 HydrophobicContact CB-CE3 4.09Å; L395-W411 HydrophobicContact CB-CZ3 3.89Å; L395-W411 HydrophobicContact CD1-CE3 4.45Å; L395-W411 HydrophobicContact CD1-CH2 4.28Å; L395-W411 HydrophobicContact CD1-CZ3 3.64Å; L395-W411 HydrophobicContact CG-CZ3 4.42Å; A396-W411 HydrophobicContact CB-CB 4.07Å; F408-W411 HydrophobicContact CB-CE3 4.02Å; F408-W411 HydrophobicContact CB-CZ3 4.03Å; F408-W411 HydrophobicContact CD1-CE3 4.28Å; F408-W411 HydrophobicContact CD1-CH2 4.04Å; F408-W411 AromaticContact CD1-CZ3 3.44Å; F408-W411 HydrophobicContact CD1-CZ3 3.44Å; F408-W411 VanDerWaalsContact CD1-CZ3 3.44Å; F408-W411 HydrophobicContact CE1-CZ3 4.26Å; F408-W411 HydrophobicContact CG-CZ3 4.03Å; F408-W411 PolarHBondContact O-N 3.43Å; N409-W411 PolarHBondContact O-N 2.89Å; W411-P413 VanDerWaalsContact C-N 3.26Å; W411-L414 HydrophobicContact CB-CD1 3.98Å; W411-L414 HydrophobicContact CB-CG 4.25Å; W411-L414 HydrophobicContact CG-CD1 4.42Å; W411-L414 VanDerWaalsContact O-CB 3.31Å; W411-L414 WeakPolarHBondContact O-CB 3.44Å; W411-L414 PolarHBondContact O-N 3.21Å
412	D	98.2	Very high	97.7	Very high	47 Å²	47	65.1 Å²	65.1	25%	0.251	32%	0.318	S	S	.	.	H	α-helix	trans	-49	-39.7	173.7	-88.8	-33.7	0	0	0	113.9	R400 N409 L414 I415	R400-D412 IonicContact CZ-OD1 3.71Å; R400-D412 IonicContact NE-OD1 2.91Å; R400-D412 IonicContact NH2-OD1 3.63Å; R400-D412 PolarHBondContact NH2-OD1 2.97Å; N409-D412 WeakPolarHBondContact CB-OD2 3.27Å; N409-D412 VanDerWaalsContact O-CB 3.27Å; N409-D412 WeakPolarHBondContact O-CB 3.36Å; N409-D412 PolarHBondContact O-N 2.98Å; D412-L414 PolarHBondContact O-N 2.87Å; D412-L414 VanDerWaalsContact O-N 3.13Å; D412-I415 WeakPolarHBondContact O-CB 3.48Å; D412-I415 PolarHBondContact O-N 3.3Å
413	P	98.6	Very high	97.7	Very high	60 Å²	60	65.8 Å²	65.8	39%	0.39	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-28.4	176.5	-26.5	35.7	0	0	0	113.8	W411 I415 D416 G417 H418	W411-P413 VanDerWaalsContact C-N 3.26Å; P413-I415 VanDerWaalsContact C-N 3.29Å; P413-I415 PolarHBondContact O-N 2.81Å; P413-D416 PolarHBondContact O-N 2.69Å; P413-G417 PolarHBondContact O-N 3.35Å; P413-H418 HydrophobicContact CB-CB 3.86Å; P413-H418 VanDerWaalsContact O-CB 3.28Å; P413-H418 WeakPolarHBondContact O-CB 3.24Å; P413-H418 PolarHBondContact O-N 3.45Å
414	L	98.6	Very high	97.8	Very high	18 Å²	18	62.8 Å²	62.8	9%	0.094	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-29.6	178.9	-56.5	-173.9	0	0	0	112.3	L389 K392 A393 W411 D412 D416 G417 D419 L422	L389-L414 HydrophobicContact CD2-CD1 4.4Å; L389-L414 HydrophobicContact CD2-CD2 4.22Å; K392-L414 HydrophobicContact CB-CD1 3.59Å; A393-L414 HydrophobicContact CB-CB 3.86Å; W411-L414 HydrophobicContact CB-CD1 3.98Å; W411-L414 HydrophobicContact CB-CG 4.25Å; W411-L414 HydrophobicContact CG-CD1 4.42Å; W411-L414 VanDerWaalsContact O-CB 3.31Å; W411-L414 WeakPolarHBondContact O-CB 3.44Å; W411-L414 PolarHBondContact O-N 3.21Å; D412-L414 PolarHBondContact O-N 2.87Å; D412-L414 VanDerWaalsContact O-N 3.13Å; L414-D416 PolarHBondContact O-N 2.86Å; L414-G417 PolarHBondContact O-N 2.89Å; L414-D419 HydrophobicContact CD2-CB 3.8Å; L414-L422 HydrophobicContact CB-CD1 4.11Å; L414-L422 HydrophobicContact CD2-CD1 3.94Å
415	I	98.2	Very high	97.7	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-32.2	177.8	-61	167.9	0	0	0	110.9	F321 K348 I350 A396 F397 D412 P413 G417	F321-I415 HydrophobicContact CE1-CG1 4.43Å; F321-I415 HydrophobicContact CE2-CG2 4.43Å; F321-I415 HydrophobicContact CZ-CB 4.46Å; F321-I415 HydrophobicContact CZ-CG2 4.31Å; K348-I415 HydrophobicContact CB-CG2 3.87Å; K348-I415 HydrophobicContact CD-CG2 3.89Å; K348-I415 HydrophobicContact CG-CG2 3.5Å; I350-I415 WeakPolarHBondContact CG2-O 3.14Å; A396-I415 HydrophobicContact CB-CD1 3.6Å; A396-I415 HydrophobicContact CB-CG1 4.01Å; F397-I415 HydrophobicContact CB-CD1 4.16Å; F397-I415 HydrophobicContact CB-CG1 4.37Å; F397-I415 HydrophobicContact CD2-CG2 4.4Å; D412-I415 WeakPolarHBondContact O-CB 3.48Å; D412-I415 PolarHBondContact O-N 3.3Å; P413-I415 VanDerWaalsContact C-N 3.29Å; P413-I415 PolarHBondContact O-N 2.81Å; I415-G417 VanDerWaalsContact C-N 3.33Å
416	D	96.8	Very high	97.9	Very high	56 Å²	56	56.2 Å²	56.2	30%	0.299	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	4.7	177.3	-64.1	-47.8	0	0	0	112.7	K348 P413 L414 P424	K348-D416 WeakPolarHBondContact CE-OD1 3.49Å; K348-D416 IonicContact NZ-OD1 3.61Å; K348-D416 PolarHBondContact NZ-OD1 3.37Å; P413-D416 PolarHBondContact O-N 2.69Å; L414-D416 PolarHBondContact O-N 2.86Å; D416-P424 WeakPolarHBondContact O-CB 3.41Å; D416-P424 WeakPolarHBondContact O-CG 3.39Å
417	G	97.3	Very high	97.9	Very high	4 Å²	4	55.8 Å²	55.8	4%	0.041	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	21.8	179.4	0	0	0	0	0	114	P413 L414 I415 D419	P413-G417 PolarHBondContact O-N 3.35Å; L414-G417 PolarHBondContact O-N 2.89Å; I415-G417 VanDerWaalsContact C-N 3.33Å; G417-D419 VanDerWaalsContact C-N 3.29Å; G417-D419 PolarHBondContact O-N 3Å
418	H	98.1	Very high	97.7	Very high	126 Å²	126	51.4 Å²	51.4	58%	0.583	27%	0.27	S	S	*	.			trans	-81.6	71.6	176.7	-58.5	165	0	0	0	111.6	P413	P413-H418 HydrophobicContact CB-CB 3.86Å; P413-H418 VanDerWaalsContact O-CB 3.28Å; P413-H418 WeakPolarHBondContact O-CB 3.24Å; P413-H418 PolarHBondContact O-N 3.45Å
419	D	98.3	Very high	97.4	Very high	58 Å²	58	58 Å²	58	31%	0.31	30%	0.304	S	S	.	.	S	Bend	trans	-151.7	151.7	166.5	-178.7	-89.2	0	0	0	108.5	L389 L414 G417 N421 L422	L389-D419 HydrophobicContact CD2-CB 4.37Å; L414-D419 HydrophobicContact CD2-CB 3.8Å; G417-D419 VanDerWaalsContact C-N 3.29Å; G417-D419 PolarHBondContact O-N 3Å; D419-N421 PolarHBondContact O-N 3.34Å; D419-N421 VanDerWaalsContact O-N 3.12Å; D419-N421 VanDerWaalsContact OD1-CB 3.31Å; D419-N421 WeakPolarHBondContact OD1-CB 3.47Å; D419-N421 PolarHBondContact OD1-N 3.25Å; D419-N421 PolarHBondContact OD1-ND2 3.07Å; D419-L422 HydrophobicContact CB-CB 4.19Å; D419-L422 HydrophobicContact CB-CD1 3.86Å; D419-L422 HydrophobicContact CB-CG 3.87Å; D419-L422 PolarHBondContact O-N 3.12Å
420	K	97.6	Very high	96.9	Very high	176 Å²	176	56.4 Å²	56.4	77%	0.765	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-26.6	-180	68.4	-177	-179.3	-178.9	0	113.4	R353	R353-K420 WeakPolarHBondContact CD-O 3.29Å; R353-K420 PolarHBondContact NE-O 2.86Å
421	N	98.1	Very high	95.8	Very high	31 Å²	31	58.3 Å²	58.3	17%	0.166	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	5.1	179.3	-52	-71.3	0	0	0	112.6	R353 I381 L389 D419	R353-N421 WeakPolarHBondContact CB-O 3.34Å; R353-N421 WeakPolarHBondContact CG-O 3.3Å; R353-N421 PolarHBondContact N-O 3.23Å; I381-N421 HydrophobicContact CD1-CB 4.04Å; L389-N421 HydrophobicContact CD1-CB 3.66Å; D419-N421 PolarHBondContact O-N 3.34Å; D419-N421 VanDerWaalsContact O-N 3.12Å; D419-N421 VanDerWaalsContact OD1-CB 3.31Å; D419-N421 WeakPolarHBondContact OD1-CB 3.47Å; D419-N421 PolarHBondContact OD1-N 3.25Å; D419-N421 PolarHBondContact OD1-ND2 3.07Å
422	L	98.4	Very high	93.9	Very high	3 Å²	3	65.2 Å²	65.2	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	156	177.7	-64	-179.2	0	0	0	111.2	I350 T351 I352 R353 L389 L414 D419	I350-L422 HydrophobicContact CD1-CD1 4.18Å; I350-L422 HydrophobicContact CD1-CD2 4.11Å; T351-L422 CarbonylContact O-C 3.58Å; T351-L422 WeakPolarHBondContact O-CA 3.34Å; I352-L422 HydrophobicContact CB-CD2 4.18Å; I352-L422 HydrophobicContact CG1-CD2 3.76Å; I352-L422 HydrophobicContact CG2-CD2 4.24Å; R353-L422 PolarHBondContact NE-O 3.28Å; L389-L422 HydrophobicContact CB-CD2 4.45Å; L389-L422 HydrophobicContact CD1-CD2 4.42Å; L389-L422 HydrophobicContact CD2-CD1 4.45Å; L389-L422 HydrophobicContact CD2-CG 4.49Å; L414-L422 HydrophobicContact CB-CD1 4.11Å; L414-L422 HydrophobicContact CD2-CD1 3.94Å; D419-L422 HydrophobicContact CB-CB 4.19Å; D419-L422 HydrophobicContact CB-CD1 3.86Å; D419-L422 HydrophobicContact CB-CG 3.87Å; D419-L422 PolarHBondContact O-N 3.12Å
423	I	98.4	Very high	91.7	Very high	19 Å²	19	68.2 Å²	68.2	10%	0.097	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.8	170	-54.9	176.6	0	0	0	106	I350 T351 R353 G425 N427	I350-I423 WeakPolarHBondContact CA-O 3.43Å; T351-I423 HydrophobicContact CG2-CD1 4.47Å; T351-I423 PolarHBondContact N-O 2.95Å; T351-I423 PolarHBondContact O-N 3.48Å; R353-I423 HydrophobicContact CG-CD1 4Å; R353-I423 HydrophobicContact CG-CG1 3.74Å; R353-I423 VanDerWaalsContact CZ-CG1 3.43Å; I423-G425 PolarHBondContact O-N 3.05Å; I423-N427 HydrophobicContact CD1-CB 3.82Å
424	P	98.1	Very high	88.6	Confident	80 Å²	80	71.1 Å²	71.1	52%	0.519	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	124.3	167.8	-22.4	33	0	0	0	110	D416 T426	D416-P424 WeakPolarHBondContact O-CB 3.41Å; D416-P424 WeakPolarHBondContact O-CG 3.39Å; P424-T426 PolarHBondContact O-N 2.95Å
425	G	97.1	Very high	85.5	Confident	23 Å²	23	82.7 Å²	82.7	24%	0.237	45%	0.446	C	S	.	.	S	Bend	trans	70.3	-113.9	-172.8	0	0	0	0	0	112.3	M349 I350 T351 I423	M349-G425 WeakPolarHBondContact O-CA 3.24Å; M349-G425 PolarHBondContact O-N 2.99Å; I350-G425 CarbonylContact C-O 3.56Å; T351-G425 PolarHBondContact N-O 3.38Å; T351-G425 PolarHBondContact OG1-O 3.44Å; I423-G425 PolarHBondContact O-N 3.05Å
426	T	97.4	Very high	84.8	Confident	28 Å²	28	86.8 Å²	86.8	17%	0.172	47%	0.468	C	S	.	.			trans	-146.7	150.7	-171.8	-176.4	0	0	0	0	113.2	I334 M349 T351 P424 V428	I334-T426 HydrophobicContact CD1-CG2 4.31Å; I334-T426 HydrophobicContact CG1-CG2 4.33Å; I334-T426 HydrophobicContact CG2-CG2 3.83Å; M349-T426 HydrophobicContact SD-CG2 4.29Å; T351-T426 WeakPolarHBondContact OG1-CA 3.49Å; P424-T426 PolarHBondContact O-N 2.95Å; T426-V428 VanDerWaalsContact C-N 3.26Å; T426-V428 HydrophobicContact CG2-CB 4.27Å; T426-V428 PolarHBondContact OG1-N 2.9Å; T426-V428 VanDerWaalsContact OG1-N 3.16Å
427	N	96	Very high	84.2	Confident	62 Å²	62	88.4 Å²	88.4	33%	0.332	48%	0.477	S	S	.	.	S	Bend	trans	-76	-9.3	169.3	60.2	-42.6	0	0	0	113.5	E326 I423 I429	E326-N427 VanDerWaalsContact CG-ND2 3.27Å; E326-N427 WeakPolarHBondContact CG-ND2 3.39Å; E326-N427 PolarHBondContact O-ND2 3.49Å; E326-N427 VanDerWaalsContact O-ND2 3.08Å; I423-N427 HydrophobicContact CD1-CB 3.82Å; N427-I429 PolarHBondContact O-N 3.02Å
428	V	95	Very high	83.5	Confident	29 Å²	29	93.1 Å²	93.1	18%	0.176	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-78	119.6	-179.4	178.4	0	0	0	0	110.7	Q329 A331 I334 T426 L430	Q329-V428 HydrophobicContact CB-CG2 3.77Å; A331-V428 HydrophobicContact CB-CG1 4.12Å; I334-V428 HydrophobicContact CG1-CB 3.97Å; I334-V428 HydrophobicContact CG1-CG1 4.18Å; I334-V428 HydrophobicContact CG1-CG2 4.05Å; T426-V428 VanDerWaalsContact C-N 3.26Å; T426-V428 HydrophobicContact CG2-CB 4.27Å; T426-V428 PolarHBondContact OG1-N 2.9Å; T426-V428 VanDerWaalsContact OG1-N 3.16Å; V428-L430 HydrophobicContact CG1-CD2 4.39Å; V428-L430 PolarHBondContact O-N 3.43Å
429	I	90.8	Very high	82.6	Confident	147 Å²	147	91.2 Å²	91.2	75%	0.754	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-76.8	120	174.6	-57.7	174	0	0	0	108.9	N427	N427-I429 PolarHBondContact O-N 3.02Å
430	L	86.9	Confident	81.6	Confident	47 Å²	47	93.3 Å²	93.3	25%	0.246	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-90	124.3	169.4	-58.9	-178.1	0	0	0	108.5	A331 I334 K338 V428 Q432	A331-L430 HydrophobicContact CB-CD2 4.01Å; A331-L430 WeakPolarHBondContact O-CD2 3.32Å; I334-L430 HydrophobicContact CB-CD2 4.13Å; I334-L430 HydrophobicContact CG2-CD1 4Å; I334-L430 HydrophobicContact CG2-CD2 3.94Å; I334-L430 HydrophobicContact CG2-CG 4.21Å; K338-L430 HydrophobicContact CD-CD1 3.66Å; V428-L430 HydrophobicContact CG1-CD2 4.39Å; V428-L430 PolarHBondContact O-N 3.43Å; L430-Q432 PolarHBondContact O-N 3.05Å; L430-Q432 VanDerWaalsContact O-N 3.17Å
431	L	76.3	Confident	80.6	Confident	163 Å²	163	87.7 Å²	87.7	85%	0.853	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-65.5	116	165.7	-66.1	169.9	0	0	0	106.8	S433	L431-S433 PolarHBondContact O-N 3.41Å; L431-S433 VanDerWaalsContact O-N 3.09Å
432	Q	58.8	Low	79.3	Confident	192 Å²	192	91.8 Å²	91.8	90%	0.897	51%	0.514	S	S	*	.			trans	-59.9	116	168.2	-77.3	179.3	-21.3	0	0	106.8	L430 S434	L430-Q432 PolarHBondContact O-N 3.05Å; L430-Q432 VanDerWaalsContact O-N 3.17Å; Q432-S434 PolarHBondContact O-N 3.42Å; Q432-S434 VanDerWaalsContact O-N 3.13Å
433	S	51	Low	77.9	Confident	110 Å²	110	98.6 Å²	98.6	77%	0.769	55%	0.553	S	S	*	*			trans	-56.3	119.2	161.6	-1	0	0	0	0	105.8	L431 M435	L431-S433 PolarHBondContact O-N 3.41Å; L431-S433 VanDerWaalsContact O-N 3.09Å; S433-M435 PolarHBondContact O-N 3.27Å
434	S	33.8	Very low	76.1	Confident	120 Å²	120	105.3 Å²	105.3	84%	0.839	59%	0.59	S	S	*	*			trans	-47.2	116.2	168.3	35.4	0	0	0	0	108.1	Q432	Q432-S434 PolarHBondContact O-N 3.42Å; Q432-S434 VanDerWaalsContact O-N 3.13Å
435	M	32.8	Very low	74.2	Confident	262 Å²	262	107.5 Å²	107.5	100%	1.291	60%	0.597	S	S	*	*			trans	-55.8	0	176.4	-79.9	-167.2	-81.3	0	0	111.7	S433	S433-M435 PolarHBondContact O-N 3.27Å

Retrieved 435 of 435 residues in 3388.4 ms (Link to these results)

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