A0A087YFA6_POEFO Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A087YFA6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 501 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	43.8	Very low	226 Å²	226	127.5 Å²	127.5	100%	1.113	68%	0.682	S	S	*	*				0	105.8	0	-62.9	174.1	77.7	0	0	107.7
2	D	32.6	Very low	43.9	Very low	135 Å²	135	125.3 Å²	125.3	72%	0.722	67%	0.669	S	S	*	*			cis	-148.7	130.4	-6.8	-86.5	-37.2	0	0	0	108.8	G4	D2-G4 PolarHBondContact O-N 3.4Å
3	L	39.9	Very low	43.8	Very low	172 Å²	172	123.7 Å²	123.7	90%	0.901	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	9.8	173.6	-118.1	76.5	0	0	0	112.8
4	G	44.8	Very low	43.7	Very low	41 Å²	41	122.4 Å²	122.4	42%	0.423	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-21.8	-171.1	0	0	0	0	0	115.8	D2 V8	D2-G4 PolarHBondContact O-N 3.4Å; G4-V8 WeakPolarHBondContact O-CG2 3.44Å
5	S	46.8	Very low	43.4	Very low	99 Å²	99	123.8 Å²	123.8	69%	0.692	65%	0.653	S	S	*	*	H	α-helix	trans	-79.6	-20.4	-174.7	-74.9	0	0	0	0	114.4
6	F	42.1	Very low	43.1	Very low	186 Å²	186	121.1 Å²	121.1	82%	0.816	65%	0.654	S	S	*	*	H	α-helix	trans	-84.1	-26.1	179	-116.6	-92.2	0	0	0	113.2
7	H	44.9	Very low	42.7	Very low	134 Å²	134	122.4 Å²	122.4	62%	0.62	66%	0.66	S	S	*	*	H	α-helix	trans	-78.3	-30.6	175.3	-92.9	-17.1	0	0	0	113.4	L10 L11	H7-L10 PolarHBondContact O-N 3.31Å; H7-L11 WeakPolarHBondContact O-CB 3.09Å; H7-L11 PolarHBondContact O-N 2.7Å
8	V	52.1	Low	42.4	Very low	87 Å²	87	125.1 Å²	125.1	53%	0.527	67%	0.667	S	S	.	*	H	α-helix	trans	-68.4	-37.8	177.2	176.3	0	0	0	0	111.2	G4 L12	G4-V8 WeakPolarHBondContact O-CG2 3.44Å; V8-L12 HydrophobicContact CG1-CD1 3.94Å; V8-L12 WeakPolarHBondContact O-CB 3.42Å; V8-L12 WeakPolarHBondContact O-CD1 3.49Å; V8-L12 VanDerWaalsContact O-CG 3.25Å; V8-L12 WeakPolarHBondContact O-CG 3.36Å; V8-L12 PolarHBondContact O-N 2.86Å
9	L	46.6	Very low	41.9	Very low	116 Å²	116	123.7 Å²	123.7	61%	0.607	68%	0.676	S	S	*	*	H	α-helix	trans	-70.2	-34.6	178.3	-138.5	84.8	0	0	0	112.5	L13	L9-L13 WeakPolarHBondContact O-CB 3.45Å; L9-L13 WeakPolarHBondContact O-CD1 3.49Å; L9-L13 PolarHBondContact O-N 3.01Å; L9-L13 VanDerWaalsContact O-N 3.12Å
10	L	47.8	Very low	41.6	Very low	99 Å²	99	123.3 Å²	123.3	52%	0.518	68%	0.682	S	S	.	*	H	α-helix	trans	-75.6	-34.2	178.5	-162.9	70.3	0	0	0	112.3	H7 L13 L14	H7-L10 PolarHBondContact O-N 3.31Å; L10-L13 PolarHBondContact O-N 3.34Å; L10-L14 HydrophobicContact CG-CD1 4.33Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 PolarHBondContact O-N 2.9Å
11	L	48.8	Very low	41.3	Very low	107 Å²	107	121.9 Å²	121.9	56%	0.56	69%	0.686	S	S	*	*	H	α-helix	trans	-68.9	-36.7	172.2	-88.8	154	0	0	0	112.4	H7 L14 Q15	H7-L11 WeakPolarHBondContact O-CB 3.09Å; H7-L11 PolarHBondContact O-N 2.7Å; L11-L14 PolarHBondContact O-N 2.75Å; L11-Q15 WeakPolarHBondContact O-CB 3.34Å; L11-Q15 WeakPolarHBondContact O-CG 3.36Å; L11-Q15 PolarHBondContact O-N 2.82Å
12	L	45.8	Very low	41.1	Very low	101 Å²	101	120.2 Å²	120.2	53%	0.529	68%	0.676	S	S	.	*	H	α-helix	trans	-70.5	-31.5	175.2	-72.9	169.1	0	0	0	112.6	V8 A16	V8-L12 HydrophobicContact CG1-CD1 3.94Å; V8-L12 WeakPolarHBondContact O-CB 3.42Å; V8-L12 WeakPolarHBondContact O-CD1 3.49Å; V8-L12 VanDerWaalsContact O-CG 3.25Å; V8-L12 WeakPolarHBondContact O-CG 3.36Å; V8-L12 PolarHBondContact O-N 2.86Å; L12-A16 PolarHBondContact O-N 3.05Å
13	L	41.8	Very low	41.2	Very low	105 Å²	105	121.7 Å²	121.7	55%	0.55	68%	0.684	S	S	.	*	H	α-helix	trans	-77.1	-29.7	174.4	-82	159.8	0	0	0	113	L9 L10	L9-L13 WeakPolarHBondContact O-CB 3.45Å; L9-L13 WeakPolarHBondContact O-CD1 3.49Å; L9-L13 PolarHBondContact O-N 3.01Å; L9-L13 VanDerWaalsContact O-N 3.12Å; L10-L13 PolarHBondContact O-N 3.34Å
14	L	42.6	Very low	41.1	Very low	106 Å²	106	118 Å²	118	56%	0.555	67%	0.673	S	S	*	*	H	α-helix	trans	-78.7	-29.3	173.1	-87	153	0	0	0	113	L10 L11 A16 L17	L10-L14 HydrophobicContact CG-CD1 4.33Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 PolarHBondContact O-N 2.9Å; L11-L14 PolarHBondContact O-N 2.75Å; L14-A16 VanDerWaalsContact C-N 3.29Å; L14-L17 PolarHBondContact O-N 2.83Å
15	Q	39.2	Very low	41.5	Very low	143 Å²	143	124.3 Å²	124.3	67%	0.668	69%	0.691	S	S	*	*	H	α-helix	trans	-72.3	-21.4	170.5	-77.6	-177.2	-24.3	0	0	113.3	L11 L17	L11-Q15 WeakPolarHBondContact O-CB 3.34Å; L11-Q15 WeakPolarHBondContact O-CG 3.36Å; L11-Q15 PolarHBondContact O-N 2.82Å; Q15-L17 VanDerWaalsContact C-N 3.33Å
16	A	39.4	Very low	41.8	Very low	80 Å²	80	122 Å²	122	66%	0.661	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10	174.2	0	0	0	0	0	113.9	L12 L14	L12-A16 PolarHBondContact O-N 3.05Å; L14-A16 VanDerWaalsContact C-N 3.29Å
17	L	36	Very low	43.1	Very low	144 Å²	144	117.5 Å²	117.5	75%	0.754	66%	0.664	S	S	*	*	S	Bend	trans	-110.9	5.5	-178	-86.6	156.4	0	0	0	114.3	L14 Q15	L14-L17 PolarHBondContact O-N 2.83Å; Q15-L17 VanDerWaalsContact C-N 3.33Å
18	Q	36.5	Very low	44.8	Very low	170 Å²	170	112 Å²	112	79%	0.794	64%	0.64	S	S	*	*			trans	-126.1	72.7	169.6	-83.5	-179.5	-39.1	0	0	110.7
19	A	33.8	Very low	46.4	Very low	100 Å²	100	109.7 Å²	109.7	83%	0.826	62%	0.623	S	S	*	*			trans	-150.2	49.2	159.4	0	0	0	0	0	110.3
20	S	36.5	Very low	48.4	Very low	114 Å²	114	104.2 Å²	104.2	80%	0.797	59%	0.594	S	S	*	*			trans	-119.8	88.6	160.8	61.7	0	0	0	0	108
21	A	34	Very low	50.3	Low	94 Å²	94	101 Å²	101	78%	0.777	58%	0.578	S	S	*	*			trans	163.6	95.6	152.4	0	0	0	0	0	108.2
22	E	30.7	Very low	52.1	Low	191 Å²	191	96.8 Å²	96.8	89%	0.893	56%	0.557	S	S	*	*			trans	-166.1	102.6	130.6	-106.9	173.6	-170.9	0	0	108.1	S24	E22-S24 PolarHBondContact O-N 3Å
23	D	35.3	Very low	53.9	Low	166 Å²	166	97.1 Å²	97.1	89%	0.888	56%	0.556	S	S	*	*			trans	-68	114.9	166.6	-171.7	19.2	0	0	0	108.4
24	S	36.7	Very low	55.6	Low	96 Å²	96	94 Å²	94	67%	0.671	55%	0.548	S	S	*	.			trans	-157.9	129.3	153.9	52.5	0	0	0	0	107.9	E22 G26	E22-S24 PolarHBondContact O-N 3Å; S24-G26 PolarHBondContact O-N 3.26Å
25	E	53.8	Low	56.9	Low	172 Å²	172	93.7 Å²	93.7	80%	0.804	56%	0.556	S	S	*	*			trans	-61.7	74.8	171.2	-72.4	-174.5	135.6	0	0	110.9	H27	E25-H27 VanDerWaalsContact C-N 3.31Å; E25-H27 PolarHBondContact O-N 3.3Å
26	G	52.7	Low	58.2	Low	51 Å²	51	96 Å²	96	53%	0.526	56%	0.563	S	S	.	*			trans	-81.5	71.5	177	0	0	0	0	0	111.5	S24 L28	S24-G26 PolarHBondContact O-N 3.26Å; G26-L28 PolarHBondContact O-N 3.37Å
27	H	71.1	Confident	59.9	Low	92 Å²	92	94 Å²	94	43%	0.426	54%	0.544	S	S	.	.			trans	-70.5	111.7	169.3	-73	80.3	0	0	0	109.5	E25 H88	E25-H27 VanDerWaalsContact C-N 3.31Å; E25-H27 PolarHBondContact O-N 3.3Å; H27-H88 PolarHBondContact O-CE1 2.81Å
28	L	80.6	Confident	61.3	Low	19 Å²	19	91 Å²	91	10%	0.099	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	140.2	173.8	-62.5	173.2	0	0	0	109.8	G26 R44 G45 S86	G26-L28 PolarHBondContact O-N 3.37Å; L28-R44 WeakPolarHBondContact O-CA 3.32Å; L28-G45 WeakPolarHBondContact CB-O 3.43Å; L28-G45 PolarHBondContact N-O 3.03Å; L28-G45 PolarHBondContact O-N 2.83Å; L28-S86 VanDerWaalsContact CD1-C 3.48Å
29	M	84.5	Confident	62.8	Low	38 Å²	38	93 Å²	93	19%	0.187	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.3	167	-68.4	-62.9	-58.6	0	0	107.9	E42 R44 H88 M89	M29-E42 HydrophobicContact CE-CB 3.72Å; M29-E42 HydrophobicContact CE-CG 4.29Å; M29-E42 WeakPolarHBondContact CE-OE2 3.28Å; M29-R44 HydrophobicContact CE-CG 4.37Å; M29-R44 HydrophobicContact SD-CG 3.23Å; M29-R44 WeakPolarHBondContact SD-CG 3.48Å; M29-R44 PolarHBondContact SD-NE 3.48Å; M29-H88 PolarHBondContact N-ND1 3.2Å; M29-H88 VanDerWaalsContact N-ND1 3.15Å; M29-M89 PolarHBondContact O-N 2.83Å
30	C	87.8	Confident	64.5	Low	0 Å²	0	92 Å²	92	0%	0	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.4	-179.1	-51.9	0	0	0	0	110.3	E42 C43 C48 C65	C30-E42 WeakPolarHBondContact O-CA 3.43Å; C30-C43 PolarHBondContact N-O 2.84Å; C30-C43 PolarHBondContact O-N 3.19Å; C30-C48 HydrophobicContact CB-CB 3.66Å; C30-C48 WeakPolarHBondContact CB-SG 3.28Å; C30-C48 WeakPolarHBondContact SG-CA 3.39Å; C30-C48 WeakPolarHBondContact SG-CB 3.27Å; C30-C48 CovalentContact SG-SG 2.02Å; C30-C48 PolarHBondContact SG-SG 3.13Å; C30-C65 HydrophobicContact CB-CB 3.85Å; C30-C65 VanDerWaalsContact SG-CB 3.57Å
31	L	87.9	Confident	66.6	Low	33 Å²	33	90.8 Å²	90.8	17%	0.173	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	132.8	169.3	-176.2	70.8	0	0	0	109.1	H63 G64 M89 N91	L31-H63 HydrophobicContact CD2-CB 4.42Å; L31-H63 HydrophobicContact CG-CB 4.43Å; L31-H63 CarbonylContact O-C 3.41Å; L31-H63 WeakPolarHBondContact O-CB 3.39Å; L31-G64 WeakPolarHBondContact O-CA 3.05Å; L31-G64 PolarHBondContact O-N 3.41Å; L31-M89 HydrophobicContact CB-CE 4.32Å; L31-N91 PolarHBondContact N-OD1 2.89Å; L31-N91 PolarHBondContact O-ND2 2.96Å
32	C	86.3	Confident	69.1	Low	17 Å²	17	90.8 Å²	90.8	12%	0.115	50%	0.5	C	S	.	.			trans	-118	112.2	175.7	-154.8	0	0	0	0	109.8	C37 P41 C43 H63	C32-C37 WeakPolarHBondContact CA-SG 3.24Å; C32-C37 HydrophobicContact CB-CB 3.86Å; C32-C37 WeakPolarHBondContact CB-SG 3.49Å; C32-C37 WeakPolarHBondContact SG-CB 3.48Å; C32-C37 CovalentContact SG-SG 2.04Å; C32-C37 PolarHBondContact SG-SG 3.31Å; C32-P41 PolarHBondContact N-O 3.01Å; C32-C43 HydrophobicContact CB-CB 3.96Å; C32-H63 WeakPolarHBondContact CA-O 3.25Å
33	E	84.1	Confident	71.8	Confident	109 Å²	109	82.7 Å²	82.7	51%	0.509	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-140.6	118.2	179.9	-167.9	-179.7	-164.9	0	0	108.8	C37 E62 H63	E33-C37 PolarHBondContact N-SG 2.74Å; E33-E62 CarbonylContact O-C 3.59Å; E33-E62 WeakPolarHBondContact O-CA 3.48Å; E33-H63 HydrophobicContact CB-CB 4.17Å; E33-H63 PolarHBondContact N-O 2.8Å; E33-H63 PolarHBondContact O-N 2.94Å; E33-H63 IonicContact OE2-CE1 3.31Å; E33-H63 IonicContact OE2-ND1 3.25Å; E33-H63 PolarHBondContact OE2-ND1 3.09Å
34	G	78.4	Confident	74.1	Confident	38 Å²	38	82.7 Å²	82.7	39%	0.392	45%	0.451	S	S	.	.	S	Bend	trans	146.1	-178.3	-178.4	0	0	0	0	0	113.8	K36 C37	G34-K36 PolarHBondContact O-N 3.09Å; G34-K36 VanDerWaalsContact O-N 3.14Å; G34-C37 PolarHBondContact O-N 2.9Å
35	S	68.7	Low	76.4	Confident	101 Å²	101	78.1 Å²	78.1	71%	0.706	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.2	-171.5	59	0	0	0	0	114.8	E62	S35-E62 PolarHBondContact N-OE1 2.6Å; S35-E62 PolarHBondContact OG-OE1 2.79Å
36	K	67.3	Low	77.8	Confident	192 Å²	192	72.3 Å²	72.3	84%	0.835	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	6.2	-174.9	-63.8	-175.3	-179.6	178.2	0	114.1	G34	G34-K36 PolarHBondContact O-N 3.09Å; G34-K36 VanDerWaalsContact O-N 3.14Å
37	C	75.5	Confident	79.4	Confident	36 Å²	36	71.2 Å²	71.2	24%	0.243	38%	0.377	C	S	.	.			trans	-86	138.2	179.6	-68.2	0	0	0	0	111.6	C32 E33 G34	C32-C37 WeakPolarHBondContact CA-SG 3.24Å; C32-C37 HydrophobicContact CB-CB 3.86Å; C32-C37 WeakPolarHBondContact CB-SG 3.49Å; C32-C37 WeakPolarHBondContact SG-CB 3.48Å; C32-C37 CovalentContact SG-SG 2.04Å; C32-C37 PolarHBondContact SG-SG 3.31Å; E33-C37 PolarHBondContact N-SG 2.74Å; G34-C37 PolarHBondContact O-N 2.9Å
38	P	66.2	Low	80.2	Confident	83 Å²	83	66.9 Å²	66.9	54%	0.539	36%	0.357	S	S	.	.			trans	-63.5	169.5	168.9	25.3	-29.3	0	0	0	110.7	T40	P38-T40 PolarHBondContact O-N 2.73Å
39	Q	66	Low	80.7	Confident	211 Å²	211	67.5 Å²	67.5	99%	0.986	36%	0.359	S	S	*	.	S	Bend	trans	-60	2.7	-178.3	-68.1	-178.7	-2.1	0	0	115.2
40	T	70.1	Confident	80.9	Confident	80 Å²	80	65.7 Å²	65.7	49%	0.491	35%	0.35	S	S	.	.	S	Bend	trans	-103.8	135.8	176.4	52.8	0	0	0	0	110.1	P38 E42	P38-T40 PolarHBondContact O-N 2.73Å; T40-E42 PolarHBondContact O-N 2.93Å
41	P	81.3	Confident	80.9	Confident	88 Å²	88	66.2 Å²	66.2	57%	0.571	35%	0.353	S	S	*	.	S	Bend	trans	-71.4	5.2	-175.5	29.7	-35.2	0	0	0	114.5	C32	C32-P41 PolarHBondContact N-O 3.01Å
42	E	86.9	Confident	80.8	Confident	94 Å²	94	64.6 Å²	64.6	44%	0.439	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.8	-170.7	-65.6	175.4	-174.5	0	0	111	M29 C30 T40	M29-E42 HydrophobicContact CE-CB 3.72Å; M29-E42 HydrophobicContact CE-CG 4.29Å; M29-E42 WeakPolarHBondContact CE-OE2 3.28Å; C30-E42 WeakPolarHBondContact O-CA 3.43Å; T40-E42 PolarHBondContact O-N 2.93Å
43	C	86.1	Confident	80.8	Confident	20 Å²	20	69.2 Å²	69.2	14%	0.135	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	155.5	173.2	79.3	0	0	0	0	112.2	C30 C32 C65	C30-C43 PolarHBondContact N-O 2.84Å; C30-C43 PolarHBondContact O-N 3.19Å; C32-C43 HydrophobicContact CB-CB 3.96Å; C43-C65 HydrophobicContact CB-CB 4.44Å; C43-C65 WeakPolarHBondContact CB-SG 3.48Å; C43-C65 WeakPolarHBondContact SG-CB 3.37Å; C43-C65 PolarHBondContact SG-N 3.05Å; C43-C65 CovalentContact SG-SG 2.04Å; C43-C65 PolarHBondContact SG-SG 3.23Å
44	R	84.9	Confident	80.7	Confident	166 Å²	166	65.7 Å²	65.7	63%	0.626	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	128	179.6	-78.2	-175.6	-179.1	-142	-3.4	111.9	L28 M29 C65	L28-R44 WeakPolarHBondContact O-CA 3.32Å; M29-R44 HydrophobicContact CE-CG 4.37Å; M29-R44 HydrophobicContact SD-CG 3.23Å; M29-R44 WeakPolarHBondContact SD-CG 3.48Å; M29-R44 PolarHBondContact SD-NE 3.48Å; R44-C65 VanDerWaalsContact C-SG 3.55Å; R44-C65 PolarHBondContact N-SG 3.48Å
45	G	83.7	Confident	80.5	Confident	1 Å²	1	68 Å²	68	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	179.3	176.8	0	0	0	0	0	113.2	L28 Q47 F66	L28-G45 WeakPolarHBondContact CB-O 3.43Å; L28-G45 PolarHBondContact N-O 3.03Å; L28-G45 PolarHBondContact O-N 2.83Å; G45-Q47 VanDerWaalsContact C-N 3.3Å; G45-F66 CarbonylContact C-O 3.58Å; G45-F66 VanDerWaalsContact CA-O 3.28Å; G45-F66 WeakPolarHBondContact CA-O 3.46Å
46	T	83.7	Confident	80.1	Confident	49 Å²	49	67.6 Å²	67.6	30%	0.301	37%	0.371	S	S	.	.	S	Bend	trans	-80.1	-13.7	177.1	55.3	0	0	0	0	112.8	F66 K67	T46-F66 PolarHBondContact N-O 3.36Å; T46-F66 PolarHBondContact OG1-O 2.98Å; T46-K67 PolarHBondContact OG1-O 2.85Å
47	Q	86.4	Confident	80	Confident	29 Å²	29	61.8 Å²	61.8	14%	0.136	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	144.2	-178.6	-160.2	164.4	29.7	0	0	110.9	G45 C65 F66 C72 C84 C85 S86	G45-Q47 VanDerWaalsContact C-N 3.3Å; Q47-C65 CarbonylContact O-C 3.59Å; Q47-C65 VanDerWaalsContact O-CA 3.26Å; Q47-C65 WeakPolarHBondContact O-CA 3.49Å; Q47-F66 PolarHBondContact N-O 3.1Å; Q47-F66 PolarHBondContact O-N 2.95Å; Q47-C72 PolarHBondContact OE1-SG 3.06Å; Q47-C84 HydrophobicContact CG-CB 4.32Å; Q47-C85 VanDerWaalsContact CG-O 3.31Å; Q47-C85 WeakPolarHBondContact CG-O 3.44Å; Q47-S86 PolarHBondContact NE2-OG 2.64Å
48	C	88.4	Confident	79.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	151.3	173.6	-50.6	0	0	0	0	110.7	C30 G64 C84 C85 N91	C30-C48 HydrophobicContact CB-CB 3.66Å; C30-C48 WeakPolarHBondContact CB-SG 3.28Å; C30-C48 WeakPolarHBondContact SG-CA 3.39Å; C30-C48 WeakPolarHBondContact SG-CB 3.27Å; C30-C48 CovalentContact SG-SG 2.02Å; C30-C48 PolarHBondContact SG-SG 3.13Å; C48-G64 CarbonylContact C-O 3.57Å; C48-G64 WeakPolarHBondContact CA-O 3.44Å; C48-C84 WeakPolarHBondContact O-CA 3.23Å; C48-C85 PolarHBondContact N-O 3.42Å; C48-C85 PolarHBondContact O-N 3.26Å; C48-N91 HydrophobicContact CB-CB 4.09Å
49	F	89.7	Confident	80.5	Confident	33 Å²	33	65.3 Å²	65.3	15%	0.145	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	157.3	174.2	77.5	-93.7	0	0	0	113	H63 G64 F66 V82 H83 N91	F49-H63 WeakPolarHBondContact O-CA 3.34Å; F49-G64 WeakPolarHBondContact CD1-O 3.48Å; F49-G64 VanDerWaalsContact CE1-CA 3.47Å; F49-G64 PolarHBondContact N-O 3Å; F49-G64 PolarHBondContact O-N 3.15Å; F49-F66 HydrophobicContact CB-CD2 4.18Å; F49-F66 HydrophobicContact CB-CE2 3.64Å; F49-F66 HydrophobicContact CB-CZ 4.36Å; F49-F66 HydrophobicContact CD1-CD1 4.25Å; F49-F66 AromaticContact CD1-CD2 3.74Å; F49-F66 HydrophobicContact CD1-CD2 3.74Å; F49-F66 AromaticContact CD1-CE1 3.98Å; F49-F66 HydrophobicContact CD1-CE1 3.98Å; F49-F66 AromaticContact CD1-CE2 3.43Å; F49-F66 HydrophobicContact CD1-CE2 3.43Å; F49-F66 VanDerWaalsContact CD1-CE2 3.43Å; F49-F66 HydrophobicContact CD1-CG 4.15Å; F49-F66 AromaticContact CD1-CZ 3.56Å; F49-F66 HydrophobicContact CD1-CZ 3.56Å; F49-F66 HydrophobicContact CD2-CZ 4.48Å; F49-F66 HydrophobicContact CE1-CD1 4.32Å; F49-F66 AromaticContact CE1-CE1 3.96Å; F49-F66 HydrophobicContact CE1-CE1 3.96Å; F49-F66 HydrophobicContact CE1-CE2 4.23Å; F49-F66 AromaticContact CE1-CZ 3.91Å; F49-F66 HydrophobicContact CE1-CZ 3.91Å; F49-F66 HydrophobicContact CG-CD2 4.28Å; F49-F66 AromaticContact CG-CE2 3.63Å; F49-F66 HydrophobicContact CG-CE2 3.63Å; F49-F66 AromaticContact CG-CZ 3.89Å; F49-F66 HydrophobicContact CG-CZ 3.89Å; F49-V82 HydrophobicContact CB-CG1 4.24Å; F49-V82 HydrophobicContact CD2-CG1 4.49Å; F49-H83 CarbonylContact C-O 3.55Å; F49-H83 VanDerWaalsContact CA-O 3.25Å; F49-H83 WeakPolarHBondContact CA-O 3.46Å; F49-N91 PolarHBondContact O-ND2 2.64Å; F49-N91 VanDerWaalsContact O-ND2 3.08Å
50	S	89.4	Confident	81.4	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.2	169.2	-42.2	0	0	0	0	107.8	E62 H63 H83 N91 T94	S50-E62 CarbonylContact C-O 3.57Å; S50-E62 WeakPolarHBondContact CA-O 3.34Å; S50-H63 PolarHBondContact OG-CD2 2.83Å; S50-H83 PolarHBondContact N-O 3.07Å; S50-H83 PolarHBondContact O-N 2.84Å; S50-N91 VanDerWaalsContact OG-CB 3.32Å; S50-N91 WeakPolarHBondContact OG-CB 3.43Å; S50-T94 WeakPolarHBondContact OG-CB 3.4Å; S50-T94 PolarHBondContact OG-OG1 2.83Å
51	S	87.9	Confident	82.1	Confident	10 Å²	10	58.6 Å²	58.6	7%	0.07	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.3	-177.8	71.6	0	0	0	0	112	L61 E62 A81	S51-L61 WeakPolarHBondContact O-CA 3.25Å; S51-E62 PolarHBondContact N-O 3.22Å; S51-E62 PolarHBondContact O-N 3.25Å; S51-A81 VanDerWaalsContact CA-O 3.27Å; S51-A81 WeakPolarHBondContact CA-O 3.35Å
52	I	86.8	Confident	82.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.5	175.6	-163.6	168.7	0	0	0	108.6	V59 L60 L61 Q80 A81 R96 L99 M100 L103	I52-V59 HydrophobicContact CD1-CG1 3.53Å; I52-V59 HydrophobicContact CG1-CG1 3.49Å; I52-V59 VanDerWaalsContact CG1-CG1 3.49Å; I52-L60 WeakPolarHBondContact CA-O 3.33Å; I52-L61 HydrophobicContact CB-CD1 4.42Å; I52-L61 HydrophobicContact CG1-CD1 4.48Å; I52-Q80 VanDerWaalsContact O-CA 3.26Å; I52-Q80 WeakPolarHBondContact O-CA 3.37Å; I52-A81 HydrophobicContact CG2-CB 4.04Å; I52-A81 PolarHBondContact N-O 3.29Å; I52-A81 PolarHBondContact O-N 2.91Å; I52-A81 VanDerWaalsContact O-N 3.12Å; I52-R96 HydrophobicContact CD1-CG 4.26Å; I52-L99 HydrophobicContact CB-CB 3.98Å; I52-L99 HydrophobicContact CD1-CB 4.17Å; I52-L99 HydrophobicContact CG2-CB 3.91Å; I52-M100 HydrophobicContact CD1-CE 3.81Å; I52-M100 HydrophobicContact CD1-CG 3.68Å; I52-M100 HydrophobicContact CD1-SD 3.9Å; I52-L103 HydrophobicContact CG2-CD1 4.36Å; I52-L103 HydrophobicContact CG2-CD2 4.25Å; I52-L103 HydrophobicContact CG2-CG 4.28Å
53	K	84.7	Confident	82.4	Confident	114 Å²	114	52.5 Å²	52.5	50%	0.496	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.6	174.4	-165.1	177.2	-177.5	-179.6	0	109.9	V59 L60 H79	K53-V59 WeakPolarHBondContact O-CA 3.38Å; K53-L60 PolarHBondContact N-O 2.89Å; K53-L60 PolarHBondContact O-N 3.41Å; K53-H79 CarbonylContact C-O 3.58Å; K53-H79 VanDerWaalsContact CA-O 3.32Å; K53-H79 WeakPolarHBondContact CA-O 3.44Å
54	V	82.4	Confident	82.5	Confident	34 Å²	34	51.7 Å²	51.7	21%	0.206	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.6	-179.4	-174.1	0	0	0	0	108.6	E58 V59 H79 M100 L103	V54-E58 WeakPolarHBondContact CA-O 3.46Å; V54-V59 HydrophobicContact CG2-CG2 4.3Å; V54-H79 PolarHBondContact N-O 3.29Å; V54-M100 HydrophobicContact CG2-CE 3.85Å; V54-M100 HydrophobicContact CG2-SD 4.46Å; V54-L103 HydrophobicContact CG2-CD1 3.83Å
55	S	74.6	Confident	82.5	Confident	88 Å²	88	45.1 Å²	45.1	62%	0.615	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	116.2	179.8	-173.4	0	0	0	0	109.7	G57 E58	S55-G57 VanDerWaalsContact C-N 3.26Å; S55-G57 PolarHBondContact O-N 3.03Å; S55-E58 PolarHBondContact N-O 3.28Å; S55-E58 PolarHBondContact O-N 3.2Å
56	G	60.9	Low	82.6	Confident	91 Å²	91	46.9 Å²	46.9	94%	0.938	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	21.9	174	0	0	0	0	0	116
57	G	65.1	Low	82.3	Confident	71 Å²	71	53 Å²	53	73%	0.732	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-13.1	-177.7	0	0	0	0	0	114.4	S55	S55-G57 VanDerWaalsContact C-N 3.26Å; S55-G57 PolarHBondContact O-N 3.03Å
58	E	72.9	Confident	81.2	Confident	161 Å²	161	57.2 Å²	57.2	75%	0.752	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.4	170.5	-66.5	-168.4	161.2	0	0	110.9	V54 S55	V54-E58 WeakPolarHBondContact CA-O 3.46Å; S55-E58 PolarHBondContact N-O 3.28Å; S55-E58 PolarHBondContact O-N 3.2Å
59	V	79.7	Confident	79.8	Confident	31 Å²	31	66.6 Å²	66.6	19%	0.188	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	111.4	-178.4	179.3	0	0	0	0	107.6	I52 K53 V54 R96 M100	I52-V59 HydrophobicContact CD1-CG1 3.53Å; I52-V59 HydrophobicContact CG1-CG1 3.49Å; I52-V59 VanDerWaalsContact CG1-CG1 3.49Å; K53-V59 WeakPolarHBondContact O-CA 3.38Å; V54-V59 HydrophobicContact CG2-CG2 4.3Å; V59-R96 VanDerWaalsContact CG2-NH2 3.32Å; V59-M100 HydrophobicContact CB-CE 4.23Å; V59-M100 HydrophobicContact CG1-CE 3.67Å; V59-M100 HydrophobicContact CG2-CE 3.45Å; V59-M100 VanDerWaalsContact CG2-CE 3.45Å
60	L	84	Confident	78.2	Confident	99 Å²	99	71.7 Å²	71.7	52%	0.518	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128.1	176.2	-167.9	74.1	0	0	0	109.1	I52 K53 E62	I52-L60 WeakPolarHBondContact CA-O 3.33Å; K53-L60 PolarHBondContact N-O 2.89Å; K53-L60 PolarHBondContact O-N 3.41Å; L60-E62 HydrophobicContact CD2-CG 4.16Å; L60-E62 HydrophobicContact CG-CG 4.26Å
61	L	83.8	Confident	77	Confident	51 Å²	51	76.1 Å²	76.1	27%	0.267	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.3	174.3	-165.2	77.8	0	0	0	108.2	S51 I52 H63 L99	S51-L61 WeakPolarHBondContact O-CA 3.25Å; I52-L61 HydrophobicContact CB-CD1 4.42Å; I52-L61 HydrophobicContact CG1-CD1 4.48Å; L61-H63 VanDerWaalsContact CD2-CE1 3.43Å; L61-H63 WeakPolarHBondContact CD2-CE1 3.5Å; L61-L99 HydrophobicContact CD1-CD1 3.44Å; L61-L99 VanDerWaalsContact CD1-CD1 3.44Å
62	E	86.8	Confident	76.1	Confident	45 Å²	45	77.1 Å²	77.1	21%	0.21	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	137	176.7	-64.6	-168.4	140.4	0	0	111.3	E33 S35 S50 S51 L60	E33-E62 CarbonylContact O-C 3.59Å; E33-E62 WeakPolarHBondContact O-CA 3.48Å; S35-E62 PolarHBondContact N-OE1 2.6Å; S35-E62 PolarHBondContact OG-OE1 2.79Å; S50-E62 CarbonylContact C-O 3.57Å; S50-E62 WeakPolarHBondContact CA-O 3.34Å; S51-E62 PolarHBondContact N-O 3.22Å; S51-E62 PolarHBondContact O-N 3.25Å; L60-E62 HydrophobicContact CD2-CG 4.16Å; L60-E62 HydrophobicContact CG-CG 4.26Å
63	H	88.8	Confident	75	Confident	9 Å²	9	85.5 Å²	85.5	4%	0.042	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140.6	176.3	-61	107.7	0	0	0	110	L31 C32 E33 F49 S50 L61	L31-H63 HydrophobicContact CD2-CB 4.42Å; L31-H63 HydrophobicContact CG-CB 4.43Å; L31-H63 CarbonylContact O-C 3.41Å; L31-H63 WeakPolarHBondContact O-CB 3.39Å; C32-H63 WeakPolarHBondContact CA-O 3.25Å; E33-H63 HydrophobicContact CB-CB 4.17Å; E33-H63 PolarHBondContact N-O 2.8Å; E33-H63 PolarHBondContact O-N 2.94Å; E33-H63 IonicContact OE2-CE1 3.31Å; E33-H63 IonicContact OE2-ND1 3.25Å; E33-H63 PolarHBondContact OE2-ND1 3.09Å; F49-H63 WeakPolarHBondContact O-CA 3.34Å; S50-H63 PolarHBondContact OG-CD2 2.83Å; L61-H63 VanDerWaalsContact CD2-CE1 3.43Å; L61-H63 WeakPolarHBondContact CD2-CE1 3.5Å
64	G	87.3	Confident	74.2	Confident	3 Å²	3	84 Å²	84	3%	0.031	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	-162.3	175.7	0	0	0	0	0	114.4	L31 C48 F49 N91	L31-G64 WeakPolarHBondContact O-CA 3.05Å; L31-G64 PolarHBondContact O-N 3.41Å; C48-G64 CarbonylContact C-O 3.57Å; C48-G64 WeakPolarHBondContact CA-O 3.44Å; F49-G64 WeakPolarHBondContact CD1-O 3.48Å; F49-G64 VanDerWaalsContact CE1-CA 3.47Å; F49-G64 PolarHBondContact N-O 3Å; F49-G64 PolarHBondContact O-N 3.15Å; G64-N91 PolarHBondContact O-ND2 2.94Å
65	C	86.6	Confident	73.7	Confident	28 Å²	28	86.1 Å²	86.1	19%	0.189	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.6	-178.1	54.8	0	0	0	0	111.9	C30 C43 R44 Q47	C30-C65 HydrophobicContact CB-CB 3.85Å; C30-C65 VanDerWaalsContact SG-CB 3.57Å; C43-C65 HydrophobicContact CB-CB 4.44Å; C43-C65 WeakPolarHBondContact CB-SG 3.48Å; C43-C65 WeakPolarHBondContact SG-CB 3.37Å; C43-C65 PolarHBondContact SG-N 3.05Å; C43-C65 CovalentContact SG-SG 2.04Å; C43-C65 PolarHBondContact SG-SG 3.23Å; R44-C65 VanDerWaalsContact C-SG 3.55Å; R44-C65 PolarHBondContact N-SG 3.48Å; Q47-C65 CarbonylContact O-C 3.59Å; Q47-C65 VanDerWaalsContact O-CA 3.26Å; Q47-C65 WeakPolarHBondContact O-CA 3.49Å
66	F	85.7	Confident	73.8	Confident	38 Å²	38	84.7 Å²	84.7	17%	0.167	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	142.1	173.5	-65.9	-58.4	0	0	0	110.8	G45 T46 Q47 F49 Q71	G45-F66 CarbonylContact C-O 3.58Å; G45-F66 VanDerWaalsContact CA-O 3.28Å; G45-F66 WeakPolarHBondContact CA-O 3.46Å; T46-F66 PolarHBondContact N-O 3.36Å; T46-F66 PolarHBondContact OG1-O 2.98Å; Q47-F66 PolarHBondContact N-O 3.1Å; Q47-F66 PolarHBondContact O-N 2.95Å; F49-F66 HydrophobicContact CB-CD2 4.18Å; F49-F66 HydrophobicContact CB-CE2 3.64Å; F49-F66 HydrophobicContact CB-CZ 4.36Å; F49-F66 HydrophobicContact CD1-CD1 4.25Å; F49-F66 AromaticContact CD1-CD2 3.74Å; F49-F66 HydrophobicContact CD1-CD2 3.74Å; F49-F66 AromaticContact CD1-CE1 3.98Å; F49-F66 HydrophobicContact CD1-CE1 3.98Å; F49-F66 AromaticContact CD1-CE2 3.43Å; F49-F66 HydrophobicContact CD1-CE2 3.43Å; F49-F66 VanDerWaalsContact CD1-CE2 3.43Å; F49-F66 HydrophobicContact CD1-CG 4.15Å; F49-F66 AromaticContact CD1-CZ 3.56Å; F49-F66 HydrophobicContact CD1-CZ 3.56Å; F49-F66 HydrophobicContact CD2-CZ 4.48Å; F49-F66 HydrophobicContact CE1-CD1 4.32Å; F49-F66 AromaticContact CE1-CE1 3.96Å; F49-F66 HydrophobicContact CE1-CE1 3.96Å; F49-F66 HydrophobicContact CE1-CE2 4.23Å; F49-F66 AromaticContact CE1-CZ 3.91Å; F49-F66 HydrophobicContact CE1-CZ 3.91Å; F49-F66 HydrophobicContact CG-CD2 4.28Å; F49-F66 AromaticContact CG-CE2 3.63Å; F49-F66 HydrophobicContact CG-CE2 3.63Å; F49-F66 AromaticContact CG-CZ 3.89Å; F49-F66 HydrophobicContact CG-CZ 3.89Å; F66-Q71 HydrophobicContact CD1-CB 3.93Å; F66-Q71 HydrophobicContact CD2-CB 4.23Å; F66-Q71 HydrophobicContact CE1-CB 3.99Å; F66-Q71 HydrophobicContact CE2-CB 4.29Å; F66-Q71 HydrophobicContact CG-CB 4.04Å; F66-Q71 HydrophobicContact CZ-CB 4.17Å
67	K	75.5	Confident	74.6	Confident	177 Å²	177	82.7 Å²	82.7	77%	0.77	44%	0.438	S	S	*	.	S	Bend	trans	-86.1	-16	175.1	-66.1	-174	178.5	-177.1	0	113.1	T46	T46-K67 PolarHBondContact OG1-O 2.85Å
68	E	64.8	Low	75.1	Confident	119 Å²	119	85.2 Å²	85.2	56%	0.556	43%	0.428	S	S	*	.	S	Bend	trans	-129.2	143.7	178.7	-66.4	-179.1	178	0	0	110.6	L70	E68-L70 VanDerWaalsContact C-N 3.29Å; E68-L70 PolarHBondContact O-N 2.87Å
69	R	59.3	Low	75.3	Confident	196 Å²	196	83.4 Å²	83.4	74%	0.74	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-70.2	-15.9	-176.3	-77.8	-175.5	176.3	-178.4	1.2	115	Q71	R69-Q71 VanDerWaalsContact C-N 3.29Å; R69-Q71 PolarHBondContact O-N 2.91Å
70	L	56	Low	75.5	Confident	140 Å²	140	85.6 Å²	85.6	73%	0.733	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-77.1	-6.9	-170.8	-76.7	123.7	0	0	0	114.8	E68	E68-L70 VanDerWaalsContact C-N 3.29Å; E68-L70 PolarHBondContact O-N 2.87Å
71	Q	62.7	Low	75.4	Confident	93 Å²	93	81 Å²	81	44%	0.435	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-92.9	-6.5	-171	-69.2	175.3	-5.5	0	0	114.8	F66 R69 F73	F66-Q71 HydrophobicContact CD1-CB 3.93Å; F66-Q71 HydrophobicContact CD2-CB 4.23Å; F66-Q71 HydrophobicContact CE1-CB 3.99Å; F66-Q71 HydrophobicContact CE2-CB 4.29Å; F66-Q71 HydrophobicContact CG-CB 4.04Å; F66-Q71 HydrophobicContact CZ-CB 4.17Å; R69-Q71 VanDerWaalsContact C-N 3.29Å; R69-Q71 PolarHBondContact O-N 2.91Å; Q71-F73 PolarHBondContact O-N 3.44Å
72	C	69.2	Low	75.5	Confident	31 Å²	31	80.1 Å²	80.1	21%	0.209	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-89.4	9.2	-179.7	-79.5	0	0	0	0	115.7	Q47 C84	Q47-C72 PolarHBondContact OE1-SG 3.06Å; C72-C84 HydrophobicContact CB-CB 3.54Å; C72-C84 WeakPolarHBondContact CB-SG 3.18Å; C72-C84 WeakPolarHBondContact SG-CB 3.46Å; C72-C84 CovalentContact SG-SG 2.01Å; C72-C84 PolarHBondContact SG-SG 3.39Å
73	F	65	Low	75.5	Confident	177 Å²	177	81 Å²	81	78%	0.776	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-94.3	15.6	179.4	-66	-79.9	0	0	0	113.9	Q71 A75	Q71-F73 PolarHBondContact O-N 3.44Å; F73-A75 PolarHBondContact O-N 2.68Å
74	T	67.9	Low	75.4	Confident	82 Å²	82	81.9 Å²	81.9	50%	0.503	41%	0.412	S	S	.	.			trans	-71.9	113.7	-179.7	-50.8	0	0	0	0	109.7
75	A	70.9	Confident	75.3	Confident	78 Å²	78	82.8 Å²	82.8	65%	0.645	42%	0.418	S	S	*	.			trans	-63.7	141.2	176.1	0	0	0	0	0	110.8	F73	F73-A75 PolarHBondContact O-N 2.68Å
76	P	77.6	Confident	75.2	Confident	59 Å²	59	85.3 Å²	85.3	38%	0.383	44%	0.435	S	S	.	.			trans	-63.5	143.9	176.9	24.5	-31.2	0	0	0	111.2	A81 L102 I104	P76-A81 HydrophobicContact CB-CB 4.19Å; P76-L102 WeakPolarHBondContact CB-O 3.46Å; P76-I104 WeakPolarHBondContact O-CD1 3.32Å
77	S	77.1	Confident	75.1	Confident	49 Å²	49	91.1 Å²	91.1	34%	0.343	46%	0.461	S	S	.	.			trans	-122.8	174.7	176.9	68.6	0	0	0	0	110.2	H79 Q80 L103	S77-H79 PolarHBondContact O-N 3.09Å; S77-Q80 PolarHBondContact N-O 3.1Å; S77-Q80 PolarHBondContact OG-N 2.96Å; S77-Q80 PolarHBondContact OG-O 2.89Å; S77-L103 WeakPolarHBondContact O-CD2 3.46Å
78	F	75.1	Confident	75.5	Confident	123 Å²	123	88.3 Å²	88.3	54%	0.539	45%	0.45	S	S	.	.	S	Bend	trans	-61.5	-24.5	176.7	-66.4	-74.7	0	0	0	114	I104	F78-I104 HydrophobicContact CD1-CB 4.16Å; F78-I104 HydrophobicContact CD1-CG2 4.32Å; F78-I104 WeakPolarHBondContact CD1-O 3.26Å; F78-I104 HydrophobicContact CE1-CB 3.99Å; F78-I104 HydrophobicContact CE1-CG2 3.65Å; F78-I104 WeakPolarHBondContact CE1-O 3.19Å; F78-I104 HydrophobicContact CZ-CB 4.46Å; F78-I104 HydrophobicContact CZ-CG2 3.96Å
79	H	78.3	Confident	76.4	Confident	124 Å²	124	85.1 Å²	85.1	57%	0.574	44%	0.435	S	S	*	.	S	Bend	trans	-118.2	-7.3	-173.2	-62.1	-64.9	0	0	0	113.7	K53 V54 S77	K53-H79 CarbonylContact C-O 3.58Å; K53-H79 VanDerWaalsContact CA-O 3.32Å; K53-H79 WeakPolarHBondContact CA-O 3.44Å; V54-H79 PolarHBondContact N-O 3.29Å; S77-H79 PolarHBondContact O-N 3.09Å
80	Q	82.9	Confident	77.6	Confident	77 Å²	77	77.6 Å²	77.6	36%	0.36	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	133.8	-177	-173.8	177	-1.1	0	0	111.7	I52 S77 L103	I52-Q80 VanDerWaalsContact O-CA 3.26Å; I52-Q80 WeakPolarHBondContact O-CA 3.37Å; S77-Q80 PolarHBondContact N-O 3.1Å; S77-Q80 PolarHBondContact OG-N 2.96Å; S77-Q80 PolarHBondContact OG-O 2.89Å; Q80-L103 VanDerWaalsContact C-CD2 3.45Å
81	A	82.5	Confident	79.1	Confident	2 Å²	2	70.9 Å²	70.9	2%	0.017	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.9	169.6	0	0	0	0	0	110.2	S51 I52 P76 L102 L103	S51-A81 VanDerWaalsContact CA-O 3.27Å; S51-A81 WeakPolarHBondContact CA-O 3.35Å; I52-A81 HydrophobicContact CG2-CB 4.04Å; I52-A81 PolarHBondContact N-O 3.29Å; I52-A81 PolarHBondContact O-N 2.91Å; I52-A81 VanDerWaalsContact O-N 3.12Å; P76-A81 HydrophobicContact CB-CB 4.19Å; A81-L102 HydrophobicContact CB-CB 3.82Å; A81-L103 HydrophobicContact CB-CD2 3.78Å; A81-L103 HydrophobicContact CB-CG 4.31Å
82	V	85.8	Confident	80.1	Confident	33 Å²	33	71.7 Å²	71.7	20%	0.2	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.4	178.6	-174.8	0	0	0	0	108.3	F49	F49-V82 HydrophobicContact CB-CG1 4.24Å; F49-V82 HydrophobicContact CD2-CG1 4.49Å
83	H	85.8	Confident	80.6	Confident	62 Å²	62	77.2 Å²	77.2	29%	0.287	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.5	172.2	-176.9	68.1	0	0	0	109.5	F49 S50 F98 L99 L102	F49-H83 CarbonylContact C-O 3.55Å; F49-H83 VanDerWaalsContact CA-O 3.25Å; F49-H83 WeakPolarHBondContact CA-O 3.46Å; S50-H83 PolarHBondContact N-O 3.07Å; S50-H83 PolarHBondContact O-N 2.84Å; H83-F98 HydrophobicContact CB-CE1 4.3Å; H83-F98 AromaticContact CD2-CE1 3.84Å; H83-F98 AromaticContact CG-CE1 3.75Å; H83-F98 AromaticContact ND1-CE1 3.91Å; H83-L99 HydrophobicContact CB-CD2 3.8Å; H83-L102 HydrophobicContact CB-CD1 4.08Å
84	C	87.7	Confident	81.3	Confident	29 Å²	29	69.7 Å²	69.7	20%	0.196	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.2	-178.9	-66.4	0	0	0	0	112.2	Q47 C48 C72	Q47-C84 HydrophobicContact CG-CB 4.32Å; C48-C84 WeakPolarHBondContact O-CA 3.23Å; C72-C84 HydrophobicContact CB-CB 3.54Å; C72-C84 WeakPolarHBondContact CB-SG 3.18Å; C72-C84 WeakPolarHBondContact SG-CB 3.46Å; C72-C84 CovalentContact SG-SG 2.01Å; C72-C84 PolarHBondContact SG-SG 3.39Å
85	C	85.1	Confident	81.8	Confident	22 Å²	22	69.3 Å²	69.3	15%	0.149	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	155.7	-179.1	59.1	0	0	0	0	111.2	Q47 C48 C90	Q47-C85 VanDerWaalsContact CG-O 3.31Å; Q47-C85 WeakPolarHBondContact CG-O 3.44Å; C48-C85 PolarHBondContact N-O 3.42Å; C48-C85 PolarHBondContact O-N 3.26Å; C85-C90 HydrophobicContact CB-CB 3.8Å; C85-C90 WeakPolarHBondContact CB-SG 3.49Å; C85-C90 PolarHBondContact O-SG 3.09Å; C85-C90 WeakPolarHBondContact SG-CB 3.43Å; C85-C90 CovalentContact SG-SG 2.01Å; C85-C90 PolarHBondContact SG-SG 2.85Å
86	S	84.3	Confident	82.1	Confident	80 Å²	80	72.2 Å²	72.2	56%	0.559	37%	0.369	S	S	*	.			trans	-120.7	35	-167.7	-50.4	0	0	0	0	113.2	L28 Q47	L28-S86 VanDerWaalsContact CD1-C 3.48Å; Q47-S86 PolarHBondContact NE2-OG 2.64Å
87	K	83.3	Confident	82.1	Confident	161 Å²	161	73.6 Å²	73.6	70%	0.7	38%	0.381	S	S	*	.	S	Bend	trans	-125.1	154.6	174.3	-66.2	-178.3	179.8	-178.9	0	110.2	M89 C90	K87-M89 PolarHBondContact O-N 3.14Å; K87-C90 HydrophobicContact CB-CB 3.96Å; K87-C90 VanDerWaalsContact O-CB 3.28Å; K87-C90 WeakPolarHBondContact O-CB 3.4Å; K87-C90 PolarHBondContact O-N 2.78Å; K87-C90 PolarHBondContact O-SG 3.07Å
88	H	84.9	Confident	82.2	Confident	117 Å²	117	75.5 Å²	75.5	54%	0.542	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	131.9	176.5	-71.9	-89.4	0	0	0	110.5	H27 M29 C90	H27-H88 PolarHBondContact O-CE1 2.81Å; M29-H88 PolarHBondContact N-ND1 3.2Å; M29-H88 VanDerWaalsContact N-ND1 3.15Å; H88-C90 PolarHBondContact O-N 2.97Å; H88-C90 VanDerWaalsContact O-N 3.1Å
89	M	82.8	Confident	82.4	Confident	52 Å²	52	69.6 Å²	69.6	26%	0.256	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	23.2	-180	-59.1	-63.2	-74.7	0	0	114.5	M29 L31 K87 N91 E92	M29-M89 PolarHBondContact O-N 2.83Å; L31-M89 HydrophobicContact CB-CE 4.32Å; K87-M89 PolarHBondContact O-N 3.14Å; M89-N91 PolarHBondContact O-N 3.36Å; M89-N91 VanDerWaalsContact O-N 3.14Å; M89-E92 WeakPolarHBondContact O-CB 3.39Å; M89-E92 PolarHBondContact O-N 3.35Å
90	C	84.4	Confident	82.2	Confident	38 Å²	38	67 Å²	67	26%	0.257	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.3	-175.4	63.4	0	0	0	0	114.1	C85 K87 H88	C85-C90 HydrophobicContact CB-CB 3.8Å; C85-C90 WeakPolarHBondContact CB-SG 3.49Å; C85-C90 PolarHBondContact O-SG 3.09Å; C85-C90 WeakPolarHBondContact SG-CB 3.43Å; C85-C90 CovalentContact SG-SG 2.01Å; C85-C90 PolarHBondContact SG-SG 2.85Å; K87-C90 HydrophobicContact CB-CB 3.96Å; K87-C90 VanDerWaalsContact O-CB 3.28Å; K87-C90 WeakPolarHBondContact O-CB 3.4Å; K87-C90 PolarHBondContact O-N 2.78Å; K87-C90 PolarHBondContact O-SG 3.07Å; H88-C90 PolarHBondContact O-N 2.97Å; H88-C90 VanDerWaalsContact O-N 3.1Å
91	N	87.6	Confident	81.9	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-9.6	178.5	62.5	-24.7	0	0	0	113.8	L31 C48 F49 S50 G64 M89 N93 T94	L31-N91 PolarHBondContact N-OD1 2.89Å; L31-N91 PolarHBondContact O-ND2 2.96Å; C48-N91 HydrophobicContact CB-CB 4.09Å; F49-N91 PolarHBondContact O-ND2 2.64Å; F49-N91 VanDerWaalsContact O-ND2 3.08Å; S50-N91 VanDerWaalsContact OG-CB 3.32Å; S50-N91 WeakPolarHBondContact OG-CB 3.43Å; G64-N91 PolarHBondContact O-ND2 2.94Å; M89-N91 PolarHBondContact O-N 3.36Å; M89-N91 VanDerWaalsContact O-N 3.14Å; N91-N93 PolarHBondContact O-N 3.18Å; N91-T94 PolarHBondContact O-N 3.36Å; N91-T94 PolarHBondContact O-OG1 3.13Å
92	E	85.1	Confident	81.5	Confident	109 Å²	109	70 Å²	70	51%	0.509	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-38.2	-176.3	-174.2	177.1	-161.9	0	0	113.7	M89 T94	M89-E92 WeakPolarHBondContact O-CB 3.39Å; M89-E92 PolarHBondContact O-N 3.35Å; E92-T94 VanDerWaalsContact C-N 3.33Å; E92-T94 PolarHBondContact O-N 3.38Å
93	N	78.7	Confident	81	Confident	148 Å²	148	69.4 Å²	69.4	79%	0.791	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	16.1	-178.3	-78.9	-23.6	0	0	0	113.6	N91 T95	N91-N93 PolarHBondContact O-N 3.18Å; N93-T95 PolarHBondContact O-N 3.36Å
94	T	79.6	Confident	80.2	Confident	19 Å²	19	70.5 Å²	70.5	12%	0.117	37%	0.373	C	S	.	.			trans	-76.9	112.7	-179	-42.7	0	0	0	0	110.3	S50 N91 E92 F98 L99	S50-T94 WeakPolarHBondContact OG-CB 3.4Å; S50-T94 PolarHBondContact OG-OG1 2.83Å; N91-T94 PolarHBondContact O-N 3.36Å; N91-T94 PolarHBondContact O-OG1 3.13Å; E92-T94 VanDerWaalsContact C-N 3.33Å; E92-T94 PolarHBondContact O-N 3.38Å; T94-F98 HydrophobicContact CG2-CD1 3.85Å; T94-F98 HydrophobicContact CG2-CE1 4.44Å; T94-L99 HydrophobicContact CG2-CD1 3.62Å; T94-L99 HydrophobicContact CG2-CD2 4.24Å; T94-L99 HydrophobicContact CG2-CG 3.73Å
95	T	78.6	Confident	78.7	Confident	74 Å²	74	74.1 Å²	74.1	45%	0.454	40%	0.399	S	S	.	.			trans	-85.9	149.9	-179.2	57.2	0	0	0	0	112.1	N93 S97 F98 L99	N93-T95 PolarHBondContact O-N 3.36Å; T95-S97 PolarHBondContact O-N 3.19Å; T95-S97 PolarHBondContact OG1-OG 3.45Å; T95-F98 WeakPolarHBondContact O-CB 3.45Å; T95-F98 PolarHBondContact O-N 3.42Å; T95-F98 VanDerWaalsContact O-N 3.13Å; T95-L99 PolarHBondContact O-N 3.43Å; T95-L99 VanDerWaalsContact O-N 3.16Å
96	R	78.1	Confident	76.7	Confident	138 Å²	138	76.3 Å²	76.3	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-55.7	-35.3	173.9	-176.9	178.1	179.4	144.4	-13.3	112.8	I52 V59 L99 M100	I52-R96 HydrophobicContact CD1-CG 4.26Å; V59-R96 VanDerWaalsContact CG2-NH2 3.32Å; R96-L99 PolarHBondContact O-N 3.47Å; R96-M100 WeakPolarHBondContact O-CB 3.43Å; R96-M100 WeakPolarHBondContact O-CG 3.47Å; R96-M100 PolarHBondContact O-N 3.28Å
97	S	76.7	Confident	74.7	Confident	89 Å²	89	78.4 Å²	78.4	62%	0.622	43%	0.431	S	S	*	.	H	α-helix	trans	-66.2	-40.5	177.6	51.8	0	0	0	0	112.2	T95 M100 S101	T95-S97 PolarHBondContact O-N 3.19Å; T95-S97 PolarHBondContact OG1-OG 3.45Å; S97-M100 PolarHBondContact O-N 3.17Å; S97-S101 PolarHBondContact O-N 2.83Å
98	F	80.1	Confident	72.7	Confident	88 Å²	88	79.9 Å²	79.9	39%	0.386	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-46.6	175.2	176.4	-102.8	0	0	0	111.5	H83 T94 T95 M100 S101 L102	H83-F98 HydrophobicContact CB-CE1 4.3Å; H83-F98 AromaticContact CD2-CE1 3.84Å; H83-F98 AromaticContact CG-CE1 3.75Å; H83-F98 AromaticContact ND1-CE1 3.91Å; T94-F98 HydrophobicContact CG2-CD1 3.85Å; T94-F98 HydrophobicContact CG2-CE1 4.44Å; T95-F98 WeakPolarHBondContact O-CB 3.45Å; T95-F98 PolarHBondContact O-N 3.42Å; T95-F98 VanDerWaalsContact O-N 3.13Å; F98-M100 PolarHBondContact O-N 3.18Å; F98-S101 WeakPolarHBondContact O-CB 3.48Å; F98-S101 PolarHBondContact O-N 2.97Å; F98-S101 VanDerWaalsContact O-N 3.16Å; F98-S101 PolarHBondContact O-OG 3.23Å; F98-L102 HydrophobicContact CD1-CD1 4.08Å; F98-L102 HydrophobicContact CE1-CD1 3.69Å; F98-L102 HydrophobicContact CZ-CD1 4.08Å; F98-L102 PolarHBondContact O-N 3.1Å
99	L	77.5	Confident	71	Confident	0 Å²	0	78 Å²	78	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-68.8	-32	177.9	-73.2	163.8	0	0	0	113.7	I52 L61 H83 T94 T95 R96 S101 L102	I52-L99 HydrophobicContact CB-CB 3.98Å; I52-L99 HydrophobicContact CD1-CB 4.17Å; I52-L99 HydrophobicContact CG2-CB 3.91Å; L61-L99 HydrophobicContact CD1-CD1 3.44Å; L61-L99 VanDerWaalsContact CD1-CD1 3.44Å; H83-L99 HydrophobicContact CB-CD2 3.8Å; T94-L99 HydrophobicContact CG2-CD1 3.62Å; T94-L99 HydrophobicContact CG2-CD2 4.24Å; T94-L99 HydrophobicContact CG2-CG 3.73Å; T95-L99 PolarHBondContact O-N 3.43Å; T95-L99 VanDerWaalsContact O-N 3.16Å; R96-L99 PolarHBondContact O-N 3.47Å; L99-S101 VanDerWaalsContact C-N 3.31Å; L99-L102 HydrophobicContact CD2-CD1 3.99Å; L99-L102 WeakPolarHBondContact O-CB 3.29Å; L99-L102 PolarHBondContact O-N 3.08Å
100	M	75.2	Confident	68.7	Low	68 Å²	68	83.3 Å²	83.3	34%	0.335	48%	0.476	S	S	.	.	H	α-helix	trans	-65.3	-34.7	170.7	-82.7	-68.4	-173.1	0	0	112.3	I52 V54 V59 R96 S97 F98 L102 L103	I52-M100 HydrophobicContact CD1-CE 3.81Å; I52-M100 HydrophobicContact CD1-CG 3.68Å; I52-M100 HydrophobicContact CD1-SD 3.9Å; V54-M100 HydrophobicContact CG2-CE 3.85Å; V54-M100 HydrophobicContact CG2-SD 4.46Å; V59-M100 HydrophobicContact CB-CE 4.23Å; V59-M100 HydrophobicContact CG1-CE 3.67Å; V59-M100 HydrophobicContact CG2-CE 3.45Å; V59-M100 VanDerWaalsContact CG2-CE 3.45Å; R96-M100 WeakPolarHBondContact O-CB 3.43Å; R96-M100 WeakPolarHBondContact O-CG 3.47Å; R96-M100 PolarHBondContact O-N 3.28Å; S97-M100 PolarHBondContact O-N 3.17Å; F98-M100 PolarHBondContact O-N 3.18Å; M100-L102 PolarHBondContact O-N 3.36Å; M100-L103 WeakPolarHBondContact O-CB 3.39Å; M100-L103 PolarHBondContact O-N 2.66Å; M100-L103 VanDerWaalsContact O-N 3.16Å; M100-L103 HydrophobicContact SD-CD1 3.53Å; M100-L103 VanDerWaalsContact SD-CD1 3.53Å
101	S	76.4	Confident	66.5	Low	89 Å²	89	87.2 Å²	87.2	62%	0.622	50%	0.501	S	S	*	.	H	α-helix	trans	-68.8	-19	176.8	77.7	0	0	0	0	113.6	S97 F98 L99	S97-S101 PolarHBondContact O-N 2.83Å; F98-S101 WeakPolarHBondContact O-CB 3.48Å; F98-S101 PolarHBondContact O-N 2.97Å; F98-S101 VanDerWaalsContact O-N 3.16Å; F98-S101 PolarHBondContact O-OG 3.23Å; L99-S101 VanDerWaalsContact C-N 3.31Å
102	L	74.1	Confident	64.4	Low	53 Å²	53	91.6 Å²	91.6	28%	0.277	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-15.1	174.6	-77	151.9	0	0	0	112.8	P76 A81 H83 F98 L99 M100	P76-L102 WeakPolarHBondContact CB-O 3.46Å; A81-L102 HydrophobicContact CB-CB 3.82Å; H83-L102 HydrophobicContact CB-CD1 4.08Å; F98-L102 HydrophobicContact CD1-CD1 4.08Å; F98-L102 HydrophobicContact CE1-CD1 3.69Å; F98-L102 HydrophobicContact CZ-CD1 4.08Å; F98-L102 PolarHBondContact O-N 3.1Å; L99-L102 HydrophobicContact CD2-CD1 3.99Å; L99-L102 WeakPolarHBondContact O-CB 3.29Å; L99-L102 PolarHBondContact O-N 3.08Å; M100-L102 PolarHBondContact O-N 3.36Å
103	L	74.4	Confident	62.5	Low	21 Å²	21	98.2 Å²	98.2	11%	0.11	55%	0.548	C	S	.	.	S	Bend	trans	-73.4	140.5	172.6	-64.1	172.6	0	0	0	109.4	I52 V54 S77 Q80 A81 M100 S105	I52-L103 HydrophobicContact CG2-CD1 4.36Å; I52-L103 HydrophobicContact CG2-CD2 4.25Å; I52-L103 HydrophobicContact CG2-CG 4.28Å; V54-L103 HydrophobicContact CG2-CD1 3.83Å; S77-L103 WeakPolarHBondContact O-CD2 3.46Å; Q80-L103 VanDerWaalsContact C-CD2 3.45Å; A81-L103 HydrophobicContact CB-CD2 3.78Å; A81-L103 HydrophobicContact CB-CG 4.31Å; M100-L103 WeakPolarHBondContact O-CB 3.39Å; M100-L103 PolarHBondContact O-N 2.66Å; M100-L103 VanDerWaalsContact O-N 3.16Å; M100-L103 HydrophobicContact SD-CD1 3.53Å; M100-L103 VanDerWaalsContact SD-CD1 3.53Å; L103-S105 PolarHBondContact O-N 2.8Å; L103-S105 VanDerWaalsContact O-N 3.09Å
104	I	69.9	Low	61.2	Low	85 Å²	85	98.8 Å²	98.8	44%	0.436	54%	0.54	S	S	.	.			trans	-67	112.3	175.5	-58.2	174.2	0	0	0	107.3	P76 F78	P76-I104 WeakPolarHBondContact O-CD1 3.32Å; F78-I104 HydrophobicContact CD1-CB 4.16Å; F78-I104 HydrophobicContact CD1-CG2 4.32Å; F78-I104 WeakPolarHBondContact CD1-O 3.26Å; F78-I104 HydrophobicContact CE1-CB 3.99Å; F78-I104 HydrophobicContact CE1-CG2 3.65Å; F78-I104 WeakPolarHBondContact CE1-O 3.19Å; F78-I104 HydrophobicContact CZ-CB 4.46Å; F78-I104 HydrophobicContact CZ-CG2 3.96Å
105	S	55.2	Low	60.4	Low	105 Å²	105	106.6 Å²	106.6	73%	0.734	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-72.2	131.4	172.2	48.4	0	0	0	0	109.7	L103	L103-S105 PolarHBondContact O-N 2.8Å; L103-S105 VanDerWaalsContact O-N 3.09Å
106	A	44.8	Very low	59.6	Low	69 Å²	69	109.1 Å²	109.1	57%	0.57	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-65.8	135	165.1	0	0	0	0	0	108.2	E108	A106-E108 PolarHBondContact O-N 2.79Å; A106-E108 VanDerWaalsContact O-N 3.16Å
107	P	41.7	Very low	58.7	Low	124 Å²	124	108.7 Å²	108.7	81%	0.805	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-64.2	119.6	168.3	23.2	-24.8	0	0	0	107.9
108	E	40.7	Very low	58	Low	191 Å²	191	107.5 Å²	107.5	89%	0.893	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-58.1	138.5	171.5	-74.4	-172.6	158.1	0	0	109.6	A106 E110	A106-E108 PolarHBondContact O-N 2.79Å; A106-E108 VanDerWaalsContact O-N 3.16Å; E108-E110 PolarHBondContact O-N 2.81Å
109	G	49.4	Very low	57.2	Low	77 Å²	77	108.2 Å²	108.2	79%	0.794	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-59.5	125.2	-162.4	0	0	0	0	0	114.8
110	E	33.8	Very low	56.7	Low	164 Å²	164	110.1 Å²	110.1	77%	0.766	60%	0.598	S	S	*	*			trans	-141.1	130.7	147.8	-91.5	-81.8	154.5	0	0	105.2	E108 V112	E108-E110 PolarHBondContact O-N 2.81Å; E110-V112 PolarHBondContact O-N 3.18Å
111	P	38.5	Very low	56.4	Low	120 Å²	120	112.5 Å²	112.5	78%	0.779	61%	0.612	S	S	*	*			trans	-70.2	99	-178	28.4	-31.7	0	0	0	109.2	R113	P111-R113 PolarHBondContact O-N 3.39Å
112	V	44.4	Very low	56.2	Low	93 Å²	93	115.9 Å²	115.9	56%	0.564	62%	0.616	S	S	*	*			trans	-64.8	103.5	169.4	-175.7	0	0	0	0	107.7	E110 Y114	E110-V112 PolarHBondContact O-N 3.18Å; V112-Y114 HydrophobicContact CB-CD2 4.04Å; V112-Y114 HydrophobicContact CB-CE2 3.56Å; V112-Y114 HydrophobicContact CG1-CD1 4.11Å; V112-Y114 HydrophobicContact CG1-CD2 3.78Å; V112-Y114 HydrophobicContact CG1-CE1 3.76Å; V112-Y114 HydrophobicContact CG1-CE2 3.42Å; V112-Y114 VanDerWaalsContact CG1-CE2 3.42Å; V112-Y114 HydrophobicContact CG1-CG 4.12Å; V112-Y114 VanDerWaalsContact CG1-CZ 3.4Å; V112-Y114 HydrophobicContact CG2-CE2 4.49Å; V112-Y114 WeakPolarHBondContact O-CD2 3.04Å; V112-Y114 PolarHBondContact O-N 3.42Å
113	R	45.6	Very low	56.3	Low	248 Å²	248	117.7 Å²	117.7	94%	0.936	63%	0.629	S	S	*	*			trans	-65	85.9	166.7	-105.6	179	177.4	175.9	0.5	108.3	P111 R115	P111-R113 PolarHBondContact O-N 3.39Å; R113-R115 PolarHBondContact O-N 2.67Å
114	Y	51.5	Low	56.5	Low	159 Å²	159	121.8 Å²	121.8	62%	0.624	65%	0.65	S	S	*	*			trans	-69	118.7	163.1	-66.4	-78.3	0	0	0	107.7	V112 V116	V112-Y114 HydrophobicContact CB-CD2 4.04Å; V112-Y114 HydrophobicContact CB-CE2 3.56Å; V112-Y114 HydrophobicContact CG1-CD1 4.11Å; V112-Y114 HydrophobicContact CG1-CD2 3.78Å; V112-Y114 HydrophobicContact CG1-CE1 3.76Å; V112-Y114 HydrophobicContact CG1-CE2 3.42Å; V112-Y114 VanDerWaalsContact CG1-CE2 3.42Å; V112-Y114 HydrophobicContact CG1-CG 4.12Å; V112-Y114 VanDerWaalsContact CG1-CZ 3.4Å; V112-Y114 HydrophobicContact CG2-CE2 4.49Å; V112-Y114 WeakPolarHBondContact O-CD2 3.04Å; V112-Y114 PolarHBondContact O-N 3.42Å; Y114-V116 PolarHBondContact O-N 2.88Å
115	R	61.3	Low	56.9	Low	184 Å²	184	120.1 Å²	120.1	69%	0.694	65%	0.649	S	S	*	*			trans	-59.1	131.6	167	-83	-173.6	173.3	-164.4	1.2	107.3	R113 E117 T118	R113-R115 PolarHBondContact O-N 2.67Å; R115-E117 HydrophobicContact CB-CB 4.49Å; R115-E117 IonicContact NH1-OE2 3.2Å; R115-E117 PolarHBondContact O-N 2.89Å; R115-T118 PolarHBondContact O-N 3.06Å; R115-T118 PolarHBondContact O-OG1 3.26Å
116	V	61.3	Low	58.2	Low	126 Å²	126	118.4 Å²	118.4	76%	0.764	64%	0.635	S	S	*	*	H	α-helix	trans	-49.7	-29.1	178.9	-177.7	0	0	0	0	111.9	Y114 T118 L119 A120	Y114-V116 PolarHBondContact O-N 2.88Å; V116-T118 PolarHBondContact O-N 3.45Å; V116-L119 PolarHBondContact O-N 3.47Å; V116-A120 WeakPolarHBondContact O-CB 3.41Å; V116-A120 PolarHBondContact O-N 2.76Å
117	E	60.3	Low	60.1	Low	130 Å²	130	118.7 Å²	118.7	61%	0.607	63%	0.63	S	S	*	*	H	α-helix	trans	-58.4	-41.2	174	-62.3	171	169.9	0	0	113.5	R115 L121	R115-E117 HydrophobicContact CB-CB 4.49Å; R115-E117 IonicContact NH1-OE2 3.2Å; R115-E117 PolarHBondContact O-N 2.89Å; E117-L121 PolarHBondContact O-N 3Å
118	T	60.9	Low	62.3	Low	63 Å²	63	116.7 Å²	116.7	39%	0.387	62%	0.615	S	S	.	*	H	α-helix	trans	-71.8	-37.9	-179.4	-34.8	0	0	0	0	111	R115 V116 L121 F122	R115-T118 PolarHBondContact O-N 3.06Å; R115-T118 PolarHBondContact O-OG1 3.26Å; V116-T118 PolarHBondContact O-N 3.45Å; T118-L121 PolarHBondContact O-N 3.05Å; T118-F122 HydrophobicContact CG2-CD2 4.36Å; T118-F122 HydrophobicContact CG2-CE2 4.17Å; T118-F122 VanDerWaalsContact O-CD2 3.31Å; T118-F122 WeakPolarHBondContact O-CD2 3.4Å; T118-F122 PolarHBondContact O-N 3.24Å
119	L	63.4	Low	64.7	Low	103 Å²	103	111.4 Å²	111.4	54%	0.539	60%	0.596	S	S	.	*	H	α-helix	trans	-71.5	-36.3	180	-133	134.5	0	0	0	111.5	V116 F122 V123	V116-L119 PolarHBondContact O-N 3.47Å; L119-F122 PolarHBondContact O-N 3.2Å; L119-V123 WeakPolarHBondContact O-CG2 3.35Å; L119-V123 PolarHBondContact O-N 3.19Å
120	A	67.3	Low	66.6	Low	40 Å²	40	113.2 Å²	113.2	33%	0.331	59%	0.587	S	S	.	*	H	α-helix	trans	-62.7	-40.3	172.8	0	0	0	0	0	112	V116 V123 L124	V116-A120 WeakPolarHBondContact O-CB 3.41Å; V116-A120 PolarHBondContact O-N 2.76Å; A120-V123 PolarHBondContact O-N 3.23Å; A120-L124 HydrophobicContact CB-CD1 4.25Å; A120-L124 WeakPolarHBondContact O-CB 3.47Å; A120-L124 WeakPolarHBondContact O-CD1 3.36Å; A120-L124 VanDerWaalsContact O-CG 3.32Å; A120-L124 WeakPolarHBondContact O-CG 3.39Å; A120-L124 PolarHBondContact O-N 3.24Å
121	L	69.9	Low	69.4	Low	119 Å²	119	109.2 Å²	109.2	62%	0.623	57%	0.573	S	S	*	*	H	α-helix	trans	-63.5	-42.8	177.3	-84.5	162.4	0	0	0	112.8	E117 T118 V123 A125	E117-L121 PolarHBondContact O-N 3Å; T118-L121 PolarHBondContact O-N 3.05Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.07Å; L121-A125 WeakPolarHBondContact O-CB 3.49Å; L121-A125 PolarHBondContact O-N 3.12Å
122	F	72.2	Confident	71.9	Confident	160 Å²	160	108.5 Å²	108.5	70%	0.702	56%	0.562	S	S	*	*	H	α-helix	trans	-70.6	-24.3	-179.8	-84.7	-75.9	0	0	0	114	T118 L119 P126	T118-F122 HydrophobicContact CG2-CD2 4.36Å; T118-F122 HydrophobicContact CG2-CE2 4.17Å; T118-F122 VanDerWaalsContact O-CD2 3.31Å; T118-F122 WeakPolarHBondContact O-CD2 3.4Å; T118-F122 PolarHBondContact O-N 3.24Å; L119-F122 PolarHBondContact O-N 3.2Å; F122-P126 WeakPolarHBondContact O-CD 3.26Å; F122-P126 WeakPolarHBondContact O-CG 3.2Å
123	V	76.5	Confident	74.2	Confident	90 Å²	90	108.9 Å²	108.9	55%	0.545	56%	0.561	S	S	.	*	H	α-helix	trans	-90.8	-40.2	176.8	178.6	0	0	0	0	111.6	L119 A120 L121 P126 V127	L119-V123 WeakPolarHBondContact O-CG2 3.35Å; L119-V123 PolarHBondContact O-N 3.19Å; A120-V123 PolarHBondContact O-N 3.23Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.07Å; V123-P126 WeakPolarHBondContact O-CD 3.35Å; V123-V127 VanDerWaalsContact O-CG2 3.28Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å
124	L	78.8	Confident	76.2	Confident	108 Å²	108	100 Å²	100	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-77.8	-34.9	-176.8	-70.6	164.8	0	0	0	112.5	A120 V127 V128	A120-L124 HydrophobicContact CB-CD1 4.25Å; A120-L124 WeakPolarHBondContact O-CB 3.47Å; A120-L124 WeakPolarHBondContact O-CD1 3.36Å; A120-L124 VanDerWaalsContact O-CG 3.32Å; A120-L124 WeakPolarHBondContact O-CG 3.39Å; A120-L124 PolarHBondContact O-N 3.24Å; L124-V127 PolarHBondContact O-N 2.96Å; L124-V128 WeakPolarHBondContact O-CG2 3.46Å; L124-V128 PolarHBondContact O-N 2.73Å
125	A	77.4	Confident	78.2	Confident	50 Å²	50	96 Å²	96	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-45.8	-178	0	0	0	0	0	113.5	L121 V127 V128 V129	L121-A125 WeakPolarHBondContact O-CB 3.49Å; L121-A125 PolarHBondContact O-N 3.12Å; A125-V127 VanDerWaalsContact C-N 3.32Å; A125-V127 PolarHBondContact O-N 3.09Å; A125-V128 PolarHBondContact O-N 2.86Å; A125-V129 WeakPolarHBondContact O-CG2 3.34Å; A125-V129 PolarHBondContact O-N 3.41Å
126	P	82.4	Confident	79.7	Confident	68 Å²	68	91.6 Å²	91.6	44%	0.442	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-37.5	175.5	-20.4	31.5	0	0	0	112.7	F122 V123 V129 L130	F122-P126 WeakPolarHBondContact O-CD 3.26Å; F122-P126 WeakPolarHBondContact O-CG 3.2Å; V123-P126 WeakPolarHBondContact O-CD 3.35Å; P126-V129 PolarHBondContact O-N 3.45Å; P126-L130 WeakPolarHBondContact O-CB 3.38Å; P126-L130 VanDerWaalsContact O-CG 3.3Å; P126-L130 WeakPolarHBondContact O-CG 3.43Å; P126-L130 PolarHBondContact O-N 2.88Å
127	V	84.6	Confident	80.9	Confident	76 Å²	76	89.2 Å²	89.2	46%	0.461	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-43.9	178.6	174.9	0	0	0	0	110.6	V123 L124 A125 V129 L130 V131	V123-V127 VanDerWaalsContact O-CG2 3.28Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å; L124-V127 PolarHBondContact O-N 2.96Å; A125-V127 VanDerWaalsContact C-N 3.32Å; A125-V127 PolarHBondContact O-N 3.09Å; V127-V129 PolarHBondContact O-N 3.49Å; V127-L130 PolarHBondContact O-N 3.44Å; V127-V131 VanDerWaalsContact O-CG2 3.29Å; V127-V131 WeakPolarHBondContact O-CG2 3.42Å; V127-V131 PolarHBondContact O-N 3.01Å
128	V	88.3	Confident	82.4	Confident	81 Å²	81	86.6 Å²	86.6	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-41.9	175.9	172.9	0	0	0	0	111	L124 A125 V131 L132	L124-V128 WeakPolarHBondContact O-CG2 3.46Å; L124-V128 PolarHBondContact O-N 2.73Å; A125-V128 PolarHBondContact O-N 2.86Å; V128-V131 PolarHBondContact O-N 2.82Å; V128-L132 HydrophobicContact CG1-CD1 4.07Å; V128-L132 HydrophobicContact CG1-CG 4.45Å; V128-L132 VanDerWaalsContact O-CG 3.29Å; V128-L132 WeakPolarHBondContact O-CG 3.46Å; V128-L132 PolarHBondContact O-N 3.26Å
129	V	90.9	Very high	83.8	Confident	81 Å²	81	88 Å²	88	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.4	171.8	0	0	0	0	111.4	A125 P126 V127 V131 L132 L133	A125-V129 WeakPolarHBondContact O-CG2 3.34Å; A125-V129 PolarHBondContact O-N 3.41Å; P126-V129 PolarHBondContact O-N 3.45Å; V127-V129 PolarHBondContact O-N 3.49Å; V129-V131 PolarHBondContact O-N 3.36Å; V129-L132 PolarHBondContact O-N 3.14Å; V129-L133 HydrophobicContact CG1-CD1 3.99Å; V129-L133 HydrophobicContact CG1-CG 4.37Å; V129-L133 WeakPolarHBondContact O-CB 3.4Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.19Å
130	L	90.2	Very high	85	Confident	115 Å²	115	85.3 Å²	85.3	60%	0.602	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-40.4	176.9	-73.9	170.9	0	0	0	112.1	P126 V127 L133 S134	P126-L130 WeakPolarHBondContact O-CB 3.38Å; P126-L130 VanDerWaalsContact O-CG 3.3Å; P126-L130 WeakPolarHBondContact O-CG 3.43Å; P126-L130 PolarHBondContact O-N 2.88Å; V127-L130 PolarHBondContact O-N 3.44Å; L130-L133 PolarHBondContact O-N 2.8Å; L130-S134 WeakPolarHBondContact O-CB 3.44Å; L130-S134 PolarHBondContact O-N 3.36Å
131	V	91.6	Very high	85.9	Confident	79 Å²	79	87.6 Å²	87.6	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-45.8	174.5	171.6	0	0	0	0	110.2	V127 V128 V129 L133 S134 V135	V127-V131 VanDerWaalsContact O-CG2 3.29Å; V127-V131 WeakPolarHBondContact O-CG2 3.42Å; V127-V131 PolarHBondContact O-N 3.01Å; V128-V131 PolarHBondContact O-N 2.82Å; V129-V131 PolarHBondContact O-N 3.36Å; V131-L133 PolarHBondContact O-N 2.8Å; V131-S134 PolarHBondContact O-N 3.08Å; V131-S134 PolarHBondContact O-OG 3.46Å; V131-V135 WeakPolarHBondContact O-CG2 3.23Å; V131-V135 PolarHBondContact O-N 2.87Å
132	L	92	Very high	86.6	Confident	105 Å²	105	89.9 Å²	89.9	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.6	-69.5	172.4	0	0	0	112.3	V128 V129 S134 V135 V136	V128-L132 HydrophobicContact CG1-CD1 4.07Å; V128-L132 HydrophobicContact CG1-CG 4.45Å; V128-L132 VanDerWaalsContact O-CG 3.29Å; V128-L132 WeakPolarHBondContact O-CG 3.46Å; V128-L132 PolarHBondContact O-N 3.26Å; V129-L132 PolarHBondContact O-N 3.14Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 3.38Å; L132-V135 PolarHBondContact O-N 2.84Å; L132-V136 VanDerWaalsContact O-CG2 3.32Å; L132-V136 WeakPolarHBondContact O-CG2 3.31Å; L132-V136 PolarHBondContact O-N 3.38Å
133	L	91.6	Very high	87.1	Confident	101 Å²	101	92.2 Å²	92.2	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-36.8	175.8	-71.2	173.9	0	0	0	112.3	V129 L130 V131 S137	V129-L133 HydrophobicContact CG1-CD1 3.99Å; V129-L133 HydrophobicContact CG1-CG 4.37Å; V129-L133 WeakPolarHBondContact O-CB 3.4Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.19Å; L130-L133 PolarHBondContact O-N 2.8Å; V131-L133 PolarHBondContact O-N 2.8Å; L133-S137 WeakPolarHBondContact O-CB 3.39Å; L133-S137 PolarHBondContact O-N 3.22Å; L133-S137 PolarHBondContact O-OG 3.05Å
134	S	87.3	Confident	87.2	Confident	62 Å²	62	93.9 Å²	93.9	43%	0.434	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-42.1	175.2	77.7	0	0	0	0	111.5	L130 V131 L132 S137 V138	L130-S134 WeakPolarHBondContact O-CB 3.44Å; L130-S134 PolarHBondContact O-N 3.36Å; V131-S134 PolarHBondContact O-N 3.08Å; V131-S134 PolarHBondContact O-OG 3.46Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 3.38Å; S134-S137 PolarHBondContact O-N 3.49Å; S134-V138 VanDerWaalsContact O-CG2 3.3Å; S134-V138 WeakPolarHBondContact O-CG2 3.2Å; S134-V138 PolarHBondContact O-N 2.88Å
135	V	93.3	Very high	87.1	Confident	74 Å²	74	94.5 Å²	94.5	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-45.2	176.8	172.6	0	0	0	0	110.6	V131 L132 S137 V138 L139	V131-V135 WeakPolarHBondContact O-CG2 3.23Å; V131-V135 PolarHBondContact O-N 2.87Å; L132-V135 PolarHBondContact O-N 2.84Å; V135-S137 VanDerWaalsContact C-N 3.32Å; V135-S137 PolarHBondContact O-N 3.22Å; V135-V138 PolarHBondContact O-N 3.09Å; V135-L139 HydrophobicContact CG1-CD1 3.98Å; V135-L139 HydrophobicContact CG1-CG 4.36Å; V135-L139 WeakPolarHBondContact O-CB 3.46Å; V135-L139 VanDerWaalsContact O-CG 3.28Å; V135-L139 WeakPolarHBondContact O-CG 3.18Å; V135-L139 PolarHBondContact O-N 2.98Å
136	V	92.8	Very high	86.9	Confident	92 Å²	92	101 Å²	101	56%	0.558	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-41.8	176	172.3	0	0	0	0	111	L132 L139 A140	L132-V136 VanDerWaalsContact O-CG2 3.32Å; L132-V136 WeakPolarHBondContact O-CG2 3.31Å; L132-V136 PolarHBondContact O-N 3.38Å; V136-L139 PolarHBondContact O-N 2.68Å; V136-A140 VanDerWaalsContact O-CB 3.29Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 2.93Å
137	S	87.9	Confident	86.4	Confident	76 Å²	76	99 Å²	99	53%	0.531	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-43.3	176.3	-64.8	0	0	0	0	111.9	L133 S134 V135 A140 C141	L133-S137 WeakPolarHBondContact O-CB 3.39Å; L133-S137 PolarHBondContact O-N 3.22Å; L133-S137 PolarHBondContact O-OG 3.05Å; S134-S137 PolarHBondContact O-N 3.49Å; V135-S137 VanDerWaalsContact C-N 3.32Å; V135-S137 PolarHBondContact O-N 3.22Å; S137-A140 PolarHBondContact O-N 3.34Å; S137-C141 WeakPolarHBondContact O-CB 3.45Å; S137-C141 PolarHBondContact O-N 2.84Å
138	V	90.8	Very high	85.7	Confident	76 Å²	76	104.1 Å²	104.1	46%	0.461	54%	0.54	S	S	.	.	H	α-helix	trans	-64.3	-41.9	175.6	170	0	0	0	0	111.1	S134 V135 C141 R142	S134-V138 VanDerWaalsContact O-CG2 3.3Å; S134-V138 WeakPolarHBondContact O-CG2 3.2Å; S134-V138 PolarHBondContact O-N 2.88Å; V135-V138 PolarHBondContact O-N 3.09Å; V138-C141 PolarHBondContact O-N 3.41Å; V138-R142 HydrophobicContact CG1-CG 4.47Å; V138-R142 VanDerWaalsContact O-CB 3.28Å; V138-R142 WeakPolarHBondContact O-CB 3.37Å; V138-R142 VanDerWaalsContact O-CG 3.28Å; V138-R142 WeakPolarHBondContact O-CG 3.3Å; V138-R142 PolarHBondContact O-N 2.83Å
139	L	91.1	Very high	84.5	Confident	93 Å²	93	104.5 Å²	104.5	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-66.9	-41.3	177.1	-70.3	175.3	0	0	0	111.9	V135 V136 R142 R143	V135-L139 HydrophobicContact CG1-CD1 3.98Å; V135-L139 HydrophobicContact CG1-CG 4.36Å; V135-L139 WeakPolarHBondContact O-CB 3.46Å; V135-L139 VanDerWaalsContact O-CG 3.28Å; V135-L139 WeakPolarHBondContact O-CG 3.18Å; V135-L139 PolarHBondContact O-N 2.98Å; V136-L139 PolarHBondContact O-N 2.68Å; L139-R142 PolarHBondContact O-N 2.94Å; L139-R143 WeakPolarHBondContact O-CB 3.14Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.25Å
140	A	88.7	Confident	83.4	Confident	46 Å²	46	107 Å²	107	38%	0.38	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-44.9	174.8	0	0	0	0	0	111.1	V136 S137 R142 R143 L144	V136-A140 VanDerWaalsContact O-CB 3.29Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 2.93Å; S137-A140 PolarHBondContact O-N 3.34Å; A140-R142 PolarHBondContact O-N 3.48Å; A140-R143 PolarHBondContact O-N 3.17Å; A140-L144 WeakPolarHBondContact O-CB 3.5Å; A140-L144 WeakPolarHBondContact O-CG 3.28Å; A140-L144 PolarHBondContact O-N 2.99Å
141	C	84.8	Confident	81.9	Confident	87 Å²	87	110 Å²	110	59%	0.588	55%	0.549	S	S	*	.	H	α-helix	trans	-62.4	-42.7	176.1	-152.4	0	0	0	0	111	S137 V138 R143 L144 H145	S137-C141 WeakPolarHBondContact O-CB 3.45Å; S137-C141 PolarHBondContact O-N 2.84Å; V138-C141 PolarHBondContact O-N 3.41Å; C141-R143 PolarHBondContact O-N 2.98Å; C141-L144 PolarHBondContact O-N 2.88Å; C141-H145 WeakPolarHBondContact O-CB 3.48Å; C141-H145 PolarHBondContact O-N 3.47Å
142	R	84.8	Confident	80.2	Confident	168 Å²	168	111.5 Å²	111.5	63%	0.634	55%	0.553	S	S	*	*	H	α-helix	trans	-63.1	-38.8	173.6	-79.5	179.4	164.7	-179.9	-4.2	112.8	V138 L139 A140 R146	V138-R142 HydrophobicContact CG1-CG 4.47Å; V138-R142 VanDerWaalsContact O-CB 3.28Å; V138-R142 WeakPolarHBondContact O-CB 3.37Å; V138-R142 VanDerWaalsContact O-CG 3.28Å; V138-R142 WeakPolarHBondContact O-CG 3.3Å; V138-R142 PolarHBondContact O-N 2.83Å; L139-R142 PolarHBondContact O-N 2.94Å; A140-R142 PolarHBondContact O-N 3.48Å; R142-R146 WeakPolarHBondContact O-CB 3.31Å; R142-R146 WeakPolarHBondContact O-CG 3.27Å; R142-R146 PolarHBondContact O-N 3.1Å
143	R	83.8	Confident	78.4	Confident	208 Å²	208	112.3 Å²	112.3	79%	0.785	55%	0.554	S	S	*	*	H	α-helix	trans	-69.4	-42.4	175.9	-74.4	-148.8	-179	-165.7	1.7	112.2	L139 A140 C141 H145 R146 G147	L139-R143 WeakPolarHBondContact O-CB 3.14Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.25Å; A140-R143 PolarHBondContact O-N 3.17Å; C141-R143 PolarHBondContact O-N 2.98Å; R143-H145 VanDerWaalsContact C-N 3.35Å; R143-R146 PolarHBondContact O-N 3.29Å; R143-G147 PolarHBondContact O-N 3.08Å
144	L	78.3	Confident	76.6	Confident	126 Å²	126	114.9 Å²	114.9	66%	0.66	56%	0.564	S	S	*	*	H	α-helix	trans	-65.2	-39.8	174.8	-70.9	172	0	0	0	111.6	A140 C141 G147 R148	A140-L144 WeakPolarHBondContact O-CB 3.5Å; A140-L144 WeakPolarHBondContact O-CG 3.28Å; A140-L144 PolarHBondContact O-N 2.99Å; C141-L144 PolarHBondContact O-N 2.88Å; L144-G147 PolarHBondContact O-N 3.04Å; L144-R148 PolarHBondContact O-N 3.49Å
145	H	75.8	Confident	74.8	Confident	121 Å²	121	120.4 Å²	120.4	56%	0.56	58%	0.58	S	S	*	*	H	α-helix	trans	-65.4	-45.9	175	-168.9	-75	0	0	0	111.3	C141 R143 G147 R148 L149	C141-H145 WeakPolarHBondContact O-CB 3.48Å; C141-H145 PolarHBondContact O-N 3.47Å; R143-H145 VanDerWaalsContact C-N 3.35Å; H145-G147 VanDerWaalsContact C-N 3.33Å; H145-G147 PolarHBondContact O-N 3.44Å; H145-R148 PolarHBondContact O-N 2.96Å; H145-L149 WeakPolarHBondContact O-CB 3.41Å; H145-L149 PolarHBondContact O-N 2.68Å
146	R	75.2	Confident	72.6	Confident	185 Å²	185	122.5 Å²	122.5	70%	0.698	59%	0.589	S	S	*	*	H	α-helix	trans	-59.8	-41.2	173.5	-80.7	-174.5	179.2	-170.8	-0.5	112.2	R142 R143 R148 L149 Q150	R142-R146 WeakPolarHBondContact O-CB 3.31Å; R142-R146 WeakPolarHBondContact O-CG 3.27Å; R142-R146 PolarHBondContact O-N 3.1Å; R143-R146 PolarHBondContact O-N 3.29Å; R146-R148 VanDerWaalsContact C-N 3.34Å; R146-R148 PolarHBondContact O-N 2.86Å; R146-L149 PolarHBondContact O-N 3.04Å; R146-Q150 PolarHBondContact O-N 3.28Å
147	G	71.4	Confident	70.4	Confident	28 Å²	28	123.6 Å²	123.6	29%	0.289	60%	0.596	S	S	.	*	H	α-helix	trans	-69.8	-26	176.4	0	0	0	0	0	114.4	R143 L144 H145	R143-G147 PolarHBondContact O-N 3.08Å; L144-G147 PolarHBondContact O-N 3.04Å; H145-G147 VanDerWaalsContact C-N 3.33Å; H145-G147 PolarHBondContact O-N 3.44Å
148	R	68.4	Low	68.4	Low	182 Å²	182	128.7 Å²	128.7	69%	0.687	61%	0.611	S	S	*	*	H	α-helix	trans	-76	-40.1	168.7	-78.7	-175.5	178.2	-165.8	-0.7	111.6	L144 H145 R146 R151 L152	L144-R148 PolarHBondContact O-N 3.49Å; H145-R148 PolarHBondContact O-N 2.96Å; R146-R148 VanDerWaalsContact C-N 3.34Å; R146-R148 PolarHBondContact O-N 2.86Å; R148-R151 PolarHBondContact O-N 3.37Å; R148-L152 PolarHBondContact O-N 3.35Å; R148-L152 VanDerWaalsContact O-N 3.13Å
149	L	64.4	Low	66	Low	89 Å²	89	133.8 Å²	133.8	47%	0.466	63%	0.63	S	S	.	*	H	α-helix	trans	-66.7	-41.8	-180	-152.6	79.8	0	0	0	111.8	H145 R146 R151 L152 Q153	H145-L149 WeakPolarHBondContact O-CB 3.41Å; H145-L149 PolarHBondContact O-N 2.68Å; R146-L149 PolarHBondContact O-N 3.04Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.11Å; L149-L152 PolarHBondContact O-N 3.1Å; L149-L152 VanDerWaalsContact O-N 3.16Å; L149-Q153 PolarHBondContact O-N 3.21Å
150	Q	66.6	Low	63.3	Low	134 Å²	134	133.2 Å²	133.2	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-62.7	-35.2	174.9	-78.3	178.8	-33.9	0	0	112.7	R146 Q153 E154	R146-Q150 PolarHBondContact O-N 3.28Å; Q150-Q153 PolarHBondContact O-N 2.77Å; Q150-E154 PolarHBondContact O-N 3.46Å; Q150-E154 VanDerWaalsContact O-N 3.13Å
151	R	59.5	Low	60.8	Low	179 Å²	179	139.6 Å²	139.6	68%	0.675	68%	0.675	S	S	*	*	H	α-helix	trans	-69.8	-30.1	173.8	-93.9	-169.6	-76.3	-179.8	-8.3	113.9	R148 L149	R148-R151 PolarHBondContact O-N 3.37Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.11Å
152	L	56.8	Low	58.4	Low	110 Å²	110	138.6 Å²	138.6	58%	0.576	68%	0.679	S	S	*	*	H	α-helix	trans	-73.9	-35.8	173.3	-72.6	162.1	0	0	0	110.8	R148 L149 F155 D156	R148-L152 PolarHBondContact O-N 3.35Å; R148-L152 VanDerWaalsContact O-N 3.13Å; L149-L152 PolarHBondContact O-N 3.1Å; L149-L152 VanDerWaalsContact O-N 3.16Å; L152-F155 WeakPolarHBondContact O-CB 3.46Å; L152-F155 PolarHBondContact O-N 3.49Å; L152-F155 VanDerWaalsContact O-N 3.15Å; L152-D156 PolarHBondContact O-N 3.39Å
153	Q	54.3	Low	55.8	Low	122 Å²	122	138.5 Å²	138.5	57%	0.57	69%	0.69	S	S	*	*	H	α-helix	trans	-69.6	-34.7	179.2	-135.8	165.1	-13.1	0	0	113.2	L149 Q150 F155 D156 T157	L149-Q153 PolarHBondContact O-N 3.21Å; Q150-Q153 PolarHBondContact O-N 2.77Å; Q153-F155 PolarHBondContact O-N 3.04Å; Q153-D156 PolarHBondContact O-N 3.38Å; Q153-T157 PolarHBondContact O-N 3.48Å; Q153-T157 PolarHBondContact O-OG1 2.83Å
154	E	52	Low	53.4	Low	155 Å²	155	135.8 Å²	135.8	72%	0.724	69%	0.69	S	S	*	*	H	α-helix	trans	-63.5	-27.7	170.7	-83.8	-178.9	162.5	0	0	112.7	Q150	Q150-E154 PolarHBondContact O-N 3.46Å; Q150-E154 VanDerWaalsContact O-N 3.13Å
155	F	50.5	Low	51.1	Low	177 Å²	177	135.4 Å²	135.4	78%	0.776	69%	0.693	S	S	*	*	H	α-helix	trans	-78.1	-31	176.6	-160.8	-96.3	0	0	0	112.5	L152 Q153	L152-F155 WeakPolarHBondContact O-CB 3.46Å; L152-F155 PolarHBondContact O-N 3.49Å; L152-F155 VanDerWaalsContact O-N 3.15Å; Q153-F155 PolarHBondContact O-N 3.04Å
156	D	47.6	Very low	48.9	Very low	118 Å²	118	135.3 Å²	135.3	63%	0.631	71%	0.706	S	S	*	*	H	α-helix	trans	-83.8	-7.9	180	-72.6	-26.9	0	0	0	113.8	L152 Q153 E158	L152-D156 PolarHBondContact O-N 3.39Å; Q153-D156 PolarHBondContact O-N 3.38Å; D156-E158 VanDerWaalsContact C-N 3.35Å
157	T	46.3	Very low	46.9	Very low	116 Å²	116	133.6 Å²	133.6	71%	0.712	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-7.4	-178.2	-41.7	0	0	0	0	113.4	Q153	Q153-T157 PolarHBondContact O-N 3.48Å; Q153-T157 PolarHBondContact O-OG1 2.83Å
158	E	45.2	Very low	45	Very low	182 Å²	182	139.4 Å²	139.4	85%	0.85	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-6.5	176.7	-75	-162.7	147.5	0	0	114.7	D156	D156-E158 VanDerWaalsContact C-N 3.35Å
159	Q	40.4	Very low	43.4	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	74%	0.738	S	S	*	*	S	Bend	trans	-141.5	100.2	179	-78.9	-178	-9.5	0	0	113
160	G	34.7	Very low	42.2	Very low	82 Å²	82	138.1 Å²	138.1	85%	0.845	76%	0.762	S	S	*	*			trans	136.2	97.8	155	0	0	0	0	0	115.7
161	D	36.1	Very low	40.9	Very low	179 Å²	179	136.2 Å²	136.2	96%	0.957	76%	0.763	S	S	*	*			trans	-65.6	144.7	175.5	-154.3	1.3	0	0	0	113.2
162	G	33.8	Very low	39.9	Very low	66 Å²	66	132.2 Å²	132.2	68%	0.68	76%	0.759	S	S	*	*			trans	126.8	79.4	158.8	0	0	0	0	0	120.5
163	L	30.5	Very low	39.4	Very low	166 Å²	166	133.2 Å²	133.2	87%	0.869	76%	0.764	S	S	*	*			trans	8.5	140.4	141.4	-110.5	77.9	0	0	0	119.3
164	I	34.7	Very low	39.1	Very low	151 Å²	151	130.5 Å²	130.5	77%	0.774	76%	0.763	S	S	*	*			cis	-155.8	145.1	44.9	-67.9	-173.6	0	0	0	111.1
165	T	29.5	Very low	38.7	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	76%	0.757	S	S	*	*			trans	-81.4	146.4	173.8	63.6	0	0	0	0	112.8
166	S	29.6	Very low	38.5	Very low	119 Å²	119	125.1 Å²	125.1	83%	0.832	75%	0.747	S	S	*	*			trans	-143.3	107.9	146.7	64.1	0	0	0	0	109.4
167	N	32.4	Very low	38.7	Very low	150 Å²	150	125.2 Å²	125.2	80%	0.802	75%	0.747	S	S	*	*			trans	-73.7	120.7	174	-67.3	-20.7	0	0	0	109.9
168	V	32.7	Very low	38.6	Very low	150 Å²	150	126.5 Å²	126.5	91%	0.909	75%	0.749	S	S	*	*			trans	-158	120.3	140.3	-177.2	0	0	0	0	109.1
169	G	32.9	Very low	38.3	Very low	63 Å²	63	125.3 Å²	125.3	65%	0.649	74%	0.743	S	S	*	*			trans	90.6	98.7	149.6	0	0	0	0	0	117	S171	G169-S171 PolarHBondContact O-N 2.84Å
170	D	39.7	Very low	38.4	Very low	181 Å²	181	121.2 Å²	121.2	97%	0.968	74%	0.735	S	S	*	*			trans	-46.3	103.7	169.4	-69.7	-43.9	0	0	0	112.9
171	S	39.6	Very low	39	Very low	93 Å²	93	123.4 Å²	123.4	65%	0.65	74%	0.736	S	S	*	*			trans	-140.2	114.7	153.7	37.9	0	0	0	0	107	G169 L173	G169-S171 PolarHBondContact O-N 2.84Å; S171-L173 PolarHBondContact O-N 3.14Å
172	T	39.6	Very low	39	Very low	95 Å²	95	121 Å²	121	58%	0.583	73%	0.728	S	S	*	*			trans	-62.9	129	-175.8	37.9	0	0	0	0	109.6	A174 D175	T172-A174 PolarHBondContact O-N 2.89Å; T172-D175 PolarHBondContact O-N 2.77Å
173	L	44.6	Very low	39.5	Very low	131 Å²	131	123.3 Å²	123.3	69%	0.686	73%	0.734	S	S	*	*	H	α-helix	trans	-45.7	-20.6	174.4	-174.2	64.1	0	0	0	114.5	S171 L176	S171-L173 PolarHBondContact O-N 3.14Å; L173-L176 PolarHBondContact O-N 3.44Å
174	A	48.2	Very low	40.2	Very low	66 Å²	66	118.7 Å²	118.7	55%	0.545	73%	0.726	S	S	.	*	H	α-helix	trans	-65.2	-37.3	172.3	0	0	0	0	0	113.9	T172 L176 L177 D178	T172-A174 PolarHBondContact O-N 2.89Å; A174-L176 VanDerWaalsContact C-N 3.27Å; A174-L176 PolarHBondContact O-N 2.82Å; A174-L177 PolarHBondContact O-N 3.12Å; A174-D178 PolarHBondContact O-N 3.13Å
175	D	43.5	Very low	40.3	Very low	112 Å²	112	117.1 Å²	117.1	60%	0.599	73%	0.728	S	S	*	*	H	α-helix	trans	-74.2	-19.8	179.4	-74.6	-18.4	0	0	0	112.3	T172	T172-D175 PolarHBondContact O-N 2.77Å
176	L	46	Very low	41	Very low	106 Å²	106	115.6 Å²	115.6	56%	0.555	74%	0.736	S	S	*	*	H	α-helix	trans	-82.9	-19.8	175.4	-75	169.6	0	0	0	113.1	L173 A174	L173-L176 PolarHBondContact O-N 3.44Å; A174-L176 VanDerWaalsContact C-N 3.27Å; A174-L176 PolarHBondContact O-N 2.82Å
177	L	53.6	Low	41.5	Very low	121 Å²	121	115.8 Å²	115.8	63%	0.634	74%	0.738	S	S	*	*	H	α-helix	trans	-87	-24.8	177.4	-69.3	170.4	0	0	0	112.2	A174 H179 S180	A174-L177 PolarHBondContact O-N 3.12Å; L177-H179 VanDerWaalsContact C-N 3.33Å; L177-H179 PolarHBondContact O-N 3.22Å; L177-S180 PolarHBondContact O-OG 2.6Å; L177-S180 VanDerWaalsContact O-OG 3.04Å
178	D	42.5	Very low	41.4	Very low	142 Å²	142	112 Å²	112	76%	0.759	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-5.3	-176.2	-133.5	25.1	0	0	0	114.2	A174	A174-D178 PolarHBondContact O-N 3.13Å
179	H	40.8	Very low	41.4	Very low	157 Å²	157	112.9 Å²	112.9	73%	0.727	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	53.9	171.3	-77.6	-37.5	0	0	0	112.4	L177 C181	L177-H179 VanDerWaalsContact C-N 3.33Å; L177-H179 PolarHBondContact O-N 3.22Å; H179-C181 PolarHBondContact O-N 3.39Å
180	S	41.3	Very low	41.5	Very low	98 Å²	98	115.5 Å²	115.5	69%	0.685	74%	0.738	S	S	*	*			trans	-87.8	30	169.5	-53.8	0	0	0	0	113.3	L177	L177-S180 PolarHBondContact O-OG 2.6Å; L177-S180 VanDerWaalsContact O-OG 3.04Å
181	C	47.5	Very low	41.4	Very low	127 Å²	127	114.7 Å²	114.7	86%	0.858	73%	0.726	S	S	*	*			trans	-129.5	68.5	166.7	-71.2	0	0	0	0	108.4	H179	H179-C181 PolarHBondContact O-N 3.39Å
182	T	36.8	Very low	41.5	Very low	129 Å²	129	118.3 Å²	118.3	79%	0.791	74%	0.738	S	S	*	*			trans	-109.8	110.5	170.1	-109	0	0	0	0	110.4
183	S	43.5	Very low	41.7	Very low	115 Å²	115	116.8 Å²	116.8	80%	0.804	73%	0.728	S	S	*	*			trans	-55.6	139	164.4	-167.9	0	0	0	0	109.7	S185	S183-S185 PolarHBondContact O-N 3.34Å
184	G	46.3	Very low	41.9	Very low	69 Å²	69	118.9 Å²	118.9	71%	0.711	73%	0.734	S	S	*	*			trans	-56	129.7	-175.3	0	0	0	0	0	113.6
185	S	35.3	Very low	42.3	Very low	117 Å²	117	125.6 Å²	125.6	82%	0.818	75%	0.746	S	S	*	*			trans	-151.9	112.5	149.8	-80.2	0	0	0	0	107.8	S183 S187	S183-S185 PolarHBondContact O-N 3.34Å; S185-S187 PolarHBondContact O-N 2.92Å
186	G	45.2	Very low	43.9	Very low	87 Å²	87	122.3 Å²	122.3	90%	0.897	73%	0.73	S	S	*	*			trans	-74.6	115	-175.8	0	0	0	0	0	111.9
187	S	38.9	Very low	45.8	Very low	123 Å²	123	119.1 Å²	119.1	86%	0.86	71%	0.714	S	S	*	*			trans	-172.1	55.2	160.6	50.6	0	0	0	0	111.3	S185	S185-S187 PolarHBondContact O-N 2.92Å
188	G	31.7	Very low	47.3	Very low	71 Å²	71	113.3 Å²	113.3	73%	0.732	68%	0.684	S	S	*	*	S	Bend	trans	-157	151.5	177.5	0	0	0	0	0	112.7
189	L	32.2	Very low	49.4	Very low	167 Å²	167	113.8 Å²	113.8	87%	0.874	68%	0.675	S	S	*	*			trans	-44.1	143.6	176.5	-78	156.1	0	0	0	111.4	F191	L189-F191 PolarHBondContact O-N 3.48Å
190	P	34.3	Very low	51.7	Low	118 Å²	118	109.8 Å²	109.8	77%	0.766	66%	0.657	S	S	*	*			trans	-60.1	108.5	-177.3	24.8	-32	0	0	0	109.2	L192	P190-L192 PolarHBondContact O-N 3.12Å
191	F	38.2	Very low	54.2	Low	164 Å²	164	105.3 Å²	105.3	72%	0.719	63%	0.625	S	S	*	*			trans	-62.5	123	171.5	-143.4	-97.2	0	0	0	106.8	L189 V193	L189-F191 PolarHBondContact O-N 3.48Å; F191-V193 PolarHBondContact O-N 3.45Å
192	L	40.6	Very low	56.5	Low	170 Å²	170	102.4 Å²	102.4	89%	0.89	61%	0.607	S	S	*	*			trans	-66.7	84.7	168.5	-71.6	172.9	0	0	0	107.1	P190 Q194	P190-L192 PolarHBondContact O-N 3.12Å; L192-Q194 PolarHBondContact O-N 2.72Å; L192-Q194 VanDerWaalsContact O-N 3.08Å
193	V	45.4	Very low	59.2	Low	63 Å²	63	98.4 Å²	98.4	38%	0.382	58%	0.58	S	S	.	*			trans	-62.4	115.3	174	175.4	0	0	0	0	106.8	F191 R195 T196 R199	F191-V193 PolarHBondContact O-N 3.45Å; V193-R195 PolarHBondContact O-N 2.87Å; V193-T196 HydrophobicContact CG1-CG2 4.44Å; V193-R199 VanDerWaalsContact CB-NH1 3.28Å; V193-R199 VanDerWaalsContact CG1-CZ 3.49Å
194	Q	48.6	Very low	61.7	Low	174 Å²	174	96.2 Å²	96.2	81%	0.813	56%	0.562	S	S	*	*			trans	-45.8	132.3	169.7	-167.4	170.1	-3.3	0	0	108.7	L192 T196	L192-Q194 PolarHBondContact O-N 2.72Å; L192-Q194 VanDerWaalsContact O-N 3.08Å; Q194-T196 PolarHBondContact O-N 2.68Å
195	R	56.6	Low	64	Low	207 Å²	207	97.1 Å²	97.1	78%	0.781	55%	0.548	S	S	*	.			trans	-61.9	98.4	-173.6	-72.2	-177.3	175.1	166.5	-0.9	110.3	V193 Q200	V193-R195 PolarHBondContact O-N 2.87Å; R195-Q200 HydrophobicContact CB-CG 4.32Å; R195-Q200 PolarHBondContact O-NE2 2.98Å
196	T	77.7	Confident	66.8	Low	44 Å²	44	94.1 Å²	94.1	27%	0.27	53%	0.526	S	S	.	.			trans	-68.2	156.5	172.7	81.7	0	0	0	0	110.3	V193 Q194 A198 R199 D262	V193-T196 HydrophobicContact CG1-CG2 4.44Å; Q194-T196 PolarHBondContact O-N 2.68Å; T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.77Å; T196-R199 PolarHBondContact O-N 3.08Å; T196-R199 VanDerWaalsContact O-N 3.14Å; T196-D262 WeakPolarHBondContact CB-OD2 3.49Å; T196-D262 PolarHBondContact OG1-OD2 2.91Å
197	V	84.7	Confident	69	Low	38 Å²	38	93.1 Å²	93.1	23%	0.23	50%	0.502	C	S	.	.	H	α-helix	trans	-58.7	-42.8	-177.3	176.3	0	0	0	0	110.5	R199 Q200 I201 W220 A260 D262	V197-R199 VanDerWaalsContact C-N 3.28Å; V197-R199 PolarHBondContact O-N 2.95Å; V197-Q200 PolarHBondContact O-N 3.11Å; V197-I201 HydrophobicContact CG1-CD1 3.82Å; V197-I201 WeakPolarHBondContact O-CG1 3.22Å; V197-I201 PolarHBondContact O-N 2.85Å; V197-W220 HydrophobicContact CG1-CH2 4.4Å; V197-W220 HydrophobicContact CG1-CZ2 4.09Å; V197-W220 HydrophobicContact CG2-CZ2 4.43Å; V197-A260 HydrophobicContact CB-CB 4.29Å; V197-A260 HydrophobicContact CG1-CB 4.07Å; V197-A260 HydrophobicContact CG2-CB 4.14Å; V197-D262 PolarHBondContact N-OD2 3.04Å
198	A	85.2	Confident	71.2	Confident	0 Å²	0	88.7 Å²	88.7	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-62.7	-29.8	179.1	0	0	0	0	0	113.8	T196 Q200 I201 D262 T264 R266 W273	T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.77Å; A198-Q200 VanDerWaalsContact C-N 3.27Å; A198-Q200 PolarHBondContact O-N 3.24Å; A198-I201 PolarHBondContact O-N 2.85Å; A198-D262 HydrophobicContact CB-CB 3.88Å; A198-D262 WeakPolarHBondContact CB-OD2 3.37Å; A198-D262 PolarHBondContact N-OD2 3.34Å; A198-T264 HydrophobicContact CB-CG2 4.4Å; A198-R266 PolarHBondContact O-NH2 3.09Å; A198-W273 HydrophobicContact CB-CD2 4.03Å; A198-W273 HydrophobicContact CB-CE3 3.57Å; A198-W273 HydrophobicContact CB-CZ3 3.97Å
199	R	85.8	Confident	73.7	Confident	151 Å²	151	93 Å²	93	57%	0.57	48%	0.475	S	S	*	.	H	α-helix	trans	-72.1	-22.5	176.3	-75.8	-173.9	172.7	-156.5	-0	113.1	V193 T196 V197	V193-R199 VanDerWaalsContact CB-NH1 3.28Å; V193-R199 VanDerWaalsContact CG1-CZ 3.49Å; T196-R199 PolarHBondContact O-N 3.08Å; T196-R199 VanDerWaalsContact O-N 3.14Å; V197-R199 VanDerWaalsContact C-N 3.28Å; V197-R199 PolarHBondContact O-N 2.95Å
200	Q	89.9	Confident	75.5	Confident	73 Å²	73	87.3 Å²	87.3	34%	0.341	46%	0.456	S	S	.	.	H	α-helix	trans	-90.3	-8.2	179.3	-58.5	-179.2	15.2	0	0	112.9	R195 V197 A198	R195-Q200 HydrophobicContact CB-CG 4.32Å; R195-Q200 PolarHBondContact O-NE2 2.98Å; V197-Q200 PolarHBondContact O-N 3.11Å; A198-Q200 VanDerWaalsContact C-N 3.27Å; A198-Q200 PolarHBondContact O-N 3.24Å
201	I	94.3	Very high	77.2	Confident	4 Å²	4	90 Å²	90	2%	0.021	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-97.5	127.3	-177.5	-66.3	169.1	0	0	0	110.3	V197 A198 L203 Q219 W220 V225 V227 R266 W273 I275	V197-I201 HydrophobicContact CG1-CD1 3.82Å; V197-I201 WeakPolarHBondContact O-CG1 3.22Å; V197-I201 PolarHBondContact O-N 2.85Å; A198-I201 PolarHBondContact O-N 2.85Å; I201-L203 HydrophobicContact CG2-CD2 4.49Å; I201-Q219 WeakPolarHBondContact CA-O 3.31Å; I201-W220 HydrophobicContact CG1-CB 3.87Å; I201-W220 HydrophobicContact CG1-CG 3.86Å; I201-V225 HydrophobicContact CD1-CG2 4.32Å; I201-V225 HydrophobicContact CG2-CG2 4.26Å; I201-V227 HydrophobicContact CG2-CG2 3.96Å; I201-R266 PolarHBondContact O-NH2 3Å; I201-R266 VanDerWaalsContact O-NH2 3.09Å; I201-W273 HydrophobicContact CB-CZ3 3.9Å; I201-W273 HydrophobicContact CD1-CZ3 4.47Å; I201-W273 HydrophobicContact CG2-CZ3 3.86Å; I201-I275 HydrophobicContact CD1-CG1 3.78Å; I201-I275 HydrophobicContact CD1-CG2 3.96Å
202	S	94.4	Very high	78.8	Confident	67 Å²	67	83.2 Å²	83.2	47%	0.469	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.2	167.3	58.1	0	0	0	0	109.4	G218 Q219	S202-G218 CarbonylContact O-C 3.43Å; S202-G218 WeakPolarHBondContact O-CA 3.03Å; S202-Q219 PolarHBondContact N-O 3.41Å; S202-Q219 VanDerWaalsContact N-O 3.15Å; S202-Q219 PolarHBondContact O-N 2.94Å; S202-Q219 WeakPolarHBondContact OG-CB 3.38Å
203	L	94.9	Very high	80.7	Confident	45 Å²	45	76 Å²	76	24%	0.236	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	131.4	173.9	-61.1	178.1	0	0	0	108.2	I201 W216 V227 I229 W273	I201-L203 HydrophobicContact CG2-CD2 4.49Å; L203-W216 HydrophobicContact CB-CD2 4.44Å; L203-W216 HydrophobicContact CB-CE3 3.89Å; L203-W216 HydrophobicContact CB-CZ3 4.42Å; L203-W216 HydrophobicContact CD1-CD2 4.41Å; L203-W216 HydrophobicContact CD2-CB 3.89Å; L203-W216 HydrophobicContact CD2-CG 4.38Å; L203-V227 HydrophobicContact CD2-CB 4.02Å; L203-V227 HydrophobicContact CD2-CG1 4.16Å; L203-V227 HydrophobicContact CD2-CG2 4.04Å; L203-I229 HydrophobicContact CD1-CD1 3.66Å; L203-I229 HydrophobicContact CD2-CD1 4.3Å; L203-W273 HydrophobicContact CD1-CH2 3.99Å; L203-W273 HydrophobicContact CD1-CZ2 3.82Å; L203-W273 HydrophobicContact CD2-CH2 3.64Å; L203-W273 HydrophobicContact CD2-CZ2 4.12Å; L203-W273 HydrophobicContact CD2-CZ3 4.11Å; L203-W273 HydrophobicContact CG-CH2 3.75Å; L203-W273 HydrophobicContact CG-CZ2 4.12Å
204	V	95.3	Very high	82.9	Confident	69 Å²	69	76.2 Å²	76.2	42%	0.418	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-60.8	-174.5	-174.1	0	0	0	0	110.6	R217 Q219	V204-R217 WeakPolarHBondContact CB-O 3.49Å; V204-R217 VanDerWaalsContact CG1-NH2 3.32Å; V204-R217 PolarHBondContact N-O 3.23Å; V204-Q219 HydrophobicContact CG2-CB 4.34Å
205	E	94.8	Very high	85.1	Confident	88 Å²	88	69.8 Å²	69.8	41%	0.411	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.3	-179	71	-164.6	135.1	0	0	112	V207 W216 R217	E205-V207 HydrophobicContact CG-CG1 3.97Å; E205-V207 PolarHBondContact O-N 3.25Å; E205-W216 CarbonylContact O-C 3.53Å; E205-W216 VanDerWaalsContact O-CA 3.28Å; E205-W216 WeakPolarHBondContact O-CA 3.49Å; E205-R217 HydrophobicContact CG-CB 4.09Å; E205-R217 PolarHBondContact N-O 2.78Å; E205-R217 PolarHBondContact O-N 3.42Å; E205-R217 IonicContact OE1-CZ 3.34Å; E205-R217 VanDerWaalsContact OE1-CZ 3.27Å; E205-R217 IonicContact OE1-NE 2.61Å; E205-R217 PolarHBondContact OE1-NE 3.09Å; E205-R217 IonicContact OE1-NH2 2.64Å; E205-R217 PolarHBondContact OE1-NH2 3.17Å
206	C	94	Very high	86.9	Confident	53 Å²	53	63 Å²	63	36%	0.358	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116.2	174	-172.2	0	0	0	0	108.7	W216	C206-W216 HydrophobicContact CB-CD2 4.02Å; C206-W216 HydrophobicContact CB-CE3 4.3Å; C206-W216 HydrophobicContact CB-CH2 4.17Å; C206-W216 HydrophobicContact CB-CZ2 3.87Å; C206-W216 HydrophobicContact CB-CZ3 4.38Å
207	V	91.7	Very high	87.9	Confident	67 Å²	67	63.4 Å²	63.4	41%	0.406	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-17.4	-176.6	-63.5	0	0	0	0	112.8	E205 V215 R217 Y278	E205-V207 HydrophobicContact CG-CG1 3.97Å; E205-V207 PolarHBondContact O-N 3.25Å; V207-V215 HydrophobicContact CG2-CB 4.03Å; V207-V215 HydrophobicContact CG2-CG1 3.71Å; V207-V215 VanDerWaalsContact CG2-O 3.28Å; V207-V215 WeakPolarHBondContact CG2-O 3.1Å; V207-V215 PolarHBondContact N-O 3.44Å; V207-R217 HydrophobicContact CG1-CB 3.89Å; V207-Y278 HydrophobicContact CG1-CE2 4.2Å
208	G	85.6	Confident	88.4	Confident	30 Å²	30	61.6 Å²	61.6	31%	0.309	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	156.6	176.9	0	0	0	0	0	113.5	V215	G208-V215 PolarHBondContact N-O 3.43Å; G208-V215 PolarHBondContact O-N 2.8Å
209	K	83.7	Confident	89	Confident	162 Å²	162	64.3 Å²	64.3	70%	0.704	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.3	168.6	-57.2	-163.5	-174.7	-143.4	0	108.3	E214	K209-E214 HydrophobicContact CD-CG 4.45Å; K209-E214 WeakPolarHBondContact CE-OE1 3.43Å; K209-E214 HydrophobicContact CG-CG 4.22Å; K209-E214 IonicContact NZ-OE1 2.75Å; K209-E214 PolarHBondContact NZ-OE1 3.18Å
210	G	70.3	Confident	89.4	Confident	47 Å²	47	59.7 Å²	59.7	49%	0.485	31%	0.312	S	S	.	.			trans	-96.4	-174.6	176.9	0	0	0	0	0	111.9	Y212 G213	G210-Y212 VanDerWaalsContact C-N 3.33Å; G210-Y212 PolarHBondContact O-N 2.84Å; G210-G213 WeakPolarHBondContact CA-O 3.5Å; G210-G213 PolarHBondContact N-O 3.46Å
211	R	69.9	Low	89.4	Confident	173 Å²	173	63.5 Å²	63.5	65%	0.653	33%	0.33	S	S	*	.	S	Bend	trans	-63	-37.7	178	176.6	175.1	174.1	165.4	2.3	113.2
212	Y	71.9	Confident	89.1	Confident	23 Å²	23	66 Å²	66	9%	0.09	36%	0.358	C	S	.	.	S	Bend	trans	-110.6	3.2	-169	-52.8	-72.3	0	0	0	113.5	G210 F230 S237 L350	G210-Y212 VanDerWaalsContact C-N 3.33Å; G210-Y212 PolarHBondContact O-N 2.84Å; Y212-F230 HydrophobicContact CG-CE1 4.43Å; Y212-F230 WeakPolarHBondContact O-CD1 3.29Å; Y212-S237 WeakPolarHBondContact CD1-OG 3.42Å; Y212-S237 VanDerWaalsContact CE1-OG 3.28Å; Y212-S237 WeakPolarHBondContact CE1-OG 3.28Å; Y212-L350 WeakPolarHBondContact OH-CD2 3.44Å
213	G	81.1	Confident	89	Confident	19 Å²	19	69.5 Å²	69.5	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	-174	-172.5	0	0	0	0	0	114.9	G210 I229	G210-G213 WeakPolarHBondContact CA-O 3.5Å; G210-G213 PolarHBondContact N-O 3.46Å; G213-I229 WeakPolarHBondContact CA-O 3.34Å
214	E	90.7	Very high	89.1	Confident	66 Å²	66	70.6 Å²	70.6	31%	0.308	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.5	178	-57.8	-173.1	152.6	0	0	109.8	K209 W216 K228 I229	K209-E214 HydrophobicContact CD-CG 4.45Å; K209-E214 WeakPolarHBondContact CE-OE1 3.43Å; K209-E214 HydrophobicContact CG-CG 4.22Å; K209-E214 IonicContact NZ-OE1 2.75Å; K209-E214 PolarHBondContact NZ-OE1 3.18Å; E214-W216 PolarHBondContact OE2-NE1 2.95Å; E214-K228 WeakPolarHBondContact O-CA 3.49Å; E214-I229 PolarHBondContact N-O 3.2Å; E214-I229 PolarHBondContact O-N 3.45Å
215	V	94.3	Very high	89.2	Confident	40 Å²	40	67.4 Å²	67.4	24%	0.242	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.2	172.3	-173.6	0	0	0	0	107.9	V207 G208 A226 V227 K228	V207-V215 HydrophobicContact CG2-CB 4.03Å; V207-V215 HydrophobicContact CG2-CG1 3.71Å; V207-V215 VanDerWaalsContact CG2-O 3.28Å; V207-V215 WeakPolarHBondContact CG2-O 3.1Å; V207-V215 PolarHBondContact N-O 3.44Å; G208-V215 PolarHBondContact N-O 3.43Å; G208-V215 PolarHBondContact O-N 2.8Å; V215-A226 HydrophobicContact CG1-CB 4.45Å; V215-V227 WeakPolarHBondContact CA-O 3.17Å; V215-K228 HydrophobicContact CG2-CB 4.25Å; V215-K228 HydrophobicContact CG2-CG 4.04Å
216	W	96	Very high	89.2	Confident	65 Å²	65	63.7 Å²	63.7	25%	0.246	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.9	-179.1	-74.8	73.5	0	0	0	110.3	L203 E205 C206 E214 A226 V227 I229	L203-W216 HydrophobicContact CB-CD2 4.44Å; L203-W216 HydrophobicContact CB-CE3 3.89Å; L203-W216 HydrophobicContact CB-CZ3 4.42Å; L203-W216 HydrophobicContact CD1-CD2 4.41Å; L203-W216 HydrophobicContact CD2-CB 3.89Å; L203-W216 HydrophobicContact CD2-CG 4.38Å; E205-W216 CarbonylContact O-C 3.53Å; E205-W216 VanDerWaalsContact O-CA 3.28Å; E205-W216 WeakPolarHBondContact O-CA 3.49Å; C206-W216 HydrophobicContact CB-CD2 4.02Å; C206-W216 HydrophobicContact CB-CE3 4.3Å; C206-W216 HydrophobicContact CB-CH2 4.17Å; C206-W216 HydrophobicContact CB-CZ2 3.87Å; C206-W216 HydrophobicContact CB-CZ3 4.38Å; E214-W216 PolarHBondContact OE2-NE1 2.95Å; W216-A226 WeakPolarHBondContact O-CA 3.49Å; W216-V227 HydrophobicContact CB-CB 4.49Å; W216-V227 PolarHBondContact N-O 3Å; W216-V227 PolarHBondContact O-N 3.24Å; W216-I229 HydrophobicContact CG-CD1 4.19Å
217	R	97.2	Very high	89.3	Confident	51 Å²	51	61.1 Å²	61.1	19%	0.192	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	126	159.1	-174.6	175	67.1	100.4	-8	107.7	V204 E205 V207 N224 Y278	V204-R217 WeakPolarHBondContact CB-O 3.49Å; V204-R217 VanDerWaalsContact CG1-NH2 3.32Å; V204-R217 PolarHBondContact N-O 3.23Å; E205-R217 HydrophobicContact CG-CB 4.09Å; E205-R217 PolarHBondContact N-O 2.78Å; E205-R217 PolarHBondContact O-N 3.42Å; E205-R217 IonicContact OE1-CZ 3.34Å; E205-R217 VanDerWaalsContact OE1-CZ 3.27Å; E205-R217 IonicContact OE1-NE 2.61Å; E205-R217 PolarHBondContact OE1-NE 3.09Å; E205-R217 IonicContact OE1-NH2 2.64Å; E205-R217 PolarHBondContact OE1-NH2 3.17Å; V207-R217 HydrophobicContact CG1-CB 3.89Å; R217-N224 PolarHBondContact NH1-OD1 3.29Å; R217-Y278 HydrophobicContact CB-CD2 4.27Å; R217-Y278 HydrophobicContact CB-CE2 3.88Å; R217-Y278 HydrophobicContact CG-CD1 4.44Å; R217-Y278 HydrophobicContact CG-CD2 4.03Å; R217-Y278 HydrophobicContact CG-CE1 4.28Å; R217-Y278 HydrophobicContact CG-CE2 3.88Å; R217-Y278 HydrophobicContact CG-CG 4.32Å
218	G	96.6	Very high	89.5	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	163.1	173.3	0	0	0	0	0	111.8	S202 N224 V225	S202-G218 CarbonylContact O-C 3.43Å; S202-G218 WeakPolarHBondContact O-CA 3.03Å; G218-N224 WeakPolarHBondContact O-CA 3.46Å; G218-V225 PolarHBondContact N-O 3.38Å; G218-V225 PolarHBondContact O-N 3.33Å
219	Q	96.7	Very high	89.9	Confident	57 Å²	57	58.5 Å²	58.5	27%	0.266	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.3	171.5	-158.1	78.8	49	0	0	109.4	I201 S202 V204 G222 E223 N224	I201-Q219 WeakPolarHBondContact CA-O 3.31Å; S202-Q219 PolarHBondContact N-O 3.41Å; S202-Q219 VanDerWaalsContact N-O 3.15Å; S202-Q219 PolarHBondContact O-N 2.94Å; S202-Q219 WeakPolarHBondContact OG-CB 3.38Å; V204-Q219 HydrophobicContact CG2-CB 4.34Å; Q219-G222 PolarHBondContact NE2-O 2.87Å; Q219-E223 WeakPolarHBondContact CA-O 3.37Å; Q219-E223 PolarHBondContact NE2-O 2.9Å; Q219-E223 VanDerWaalsContact NE2-O 3.13Å; Q219-N224 PolarHBondContact OE1-OD1 3.05Å
220	W	93.5	Very high	90.3	Very high	54 Å²	54	50.8 Å²	50.8	21%	0.205	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.9	173.3	-168.3	35.3	0	0	0	109.9	V197 I201 G222 E223 V225 M259	V197-W220 HydrophobicContact CG1-CH2 4.4Å; V197-W220 HydrophobicContact CG1-CZ2 4.09Å; V197-W220 HydrophobicContact CG2-CZ2 4.43Å; I201-W220 HydrophobicContact CG1-CB 3.87Å; I201-W220 HydrophobicContact CG1-CG 3.86Å; W220-G222 PolarHBondContact O-N 3.03Å; W220-G222 VanDerWaalsContact O-N 3.09Å; W220-E223 PolarHBondContact N-O 3.24Å; W220-E223 PolarHBondContact O-N 2.87Å; W220-V225 HydrophobicContact CB-CG1 3.98Å; W220-V225 HydrophobicContact CB-CG2 4.19Å; W220-V225 HydrophobicContact CE3-CG1 4.44Å; W220-M259 HydrophobicContact CE3-CE 3.45Å; W220-M259 VanDerWaalsContact CE3-CE 3.45Å; W220-M259 HydrophobicContact CZ3-CE 3.41Å; W220-M259 VanDerWaalsContact CZ3-CE 3.41Å
221	Q	89.9	Confident	91.1	Very high	153 Å²	153	51.1 Å²	51.1	72%	0.715	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	33.2	179.3	-57.4	-176.8	-1.5	0	0	114.5	E223	Q221-E223 VanDerWaalsContact C-N 3.32Å
222	G	88.4	Confident	91.9	Very high	58 Å²	58	46 Å²	46	60%	0.598	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.9	-1.5	-178.4	0	0	0	0	0	114.9	Q219 W220	Q219-G222 PolarHBondContact NE2-O 2.87Å; W220-G222 PolarHBondContact O-N 3.03Å; W220-G222 VanDerWaalsContact O-N 3.09Å
223	E	92.9	Very high	92.5	Very high	140 Å²	140	55.7 Å²	55.7	65%	0.654	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.2	177.6	-67	-62.6	145	0	0	112.2	Q219 W220 Q221	Q219-E223 WeakPolarHBondContact CA-O 3.37Å; Q219-E223 PolarHBondContact NE2-O 2.9Å; Q219-E223 VanDerWaalsContact NE2-O 3.13Å; W220-E223 PolarHBondContact N-O 3.24Å; W220-E223 PolarHBondContact O-N 2.87Å; Q221-E223 VanDerWaalsContact C-N 3.32Å
224	N	96.3	Very high	92.7	Very high	67 Å²	67	57.3 Å²	57.3	36%	0.358	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	131.7	175.1	-75	-54.9	0	0	0	110.4	R217 G218 Q219 Y278	R217-N224 PolarHBondContact NH1-OD1 3.29Å; G218-N224 WeakPolarHBondContact O-CA 3.46Å; Q219-N224 PolarHBondContact OE1-OD1 3.05Å; N224-Y278 HydrophobicContact CB-CD1 3.74Å; N224-Y278 HydrophobicContact CB-CG 4.07Å; N224-Y278 WeakPolarHBondContact O-CB 3.27Å
225	V	96.9	Very high	92.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.4	174.8	-62.3	0	0	0	0	110.6	I201 G218 W220 V227 M259 I275	I201-V225 HydrophobicContact CD1-CG2 4.32Å; I201-V225 HydrophobicContact CG2-CG2 4.26Å; G218-V225 PolarHBondContact N-O 3.38Å; G218-V225 PolarHBondContact O-N 3.33Å; W220-V225 HydrophobicContact CB-CG1 3.98Å; W220-V225 HydrophobicContact CB-CG2 4.19Å; W220-V225 HydrophobicContact CE3-CG1 4.44Å; V225-V227 HydrophobicContact CG2-CG2 4.13Å; V225-M259 HydrophobicContact CB-SD 4.5Å; V225-M259 HydrophobicContact CG1-CE 3.75Å; V225-M259 HydrophobicContact CG1-SD 3.82Å; V225-I275 HydrophobicContact CB-CG2 4.08Å; V225-I275 HydrophobicContact CG1-CG2 4.47Å; V225-I275 HydrophobicContact CG2-CG2 4.28Å
226	A	96.8	Very high	92.1	Very high	10 Å²	10	66.3 Å²	66.3	8%	0.083	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.2	171.1	0	0	0	0	0	109.2	V215 W216 I275 T276 Y278	V215-A226 HydrophobicContact CG1-CB 4.45Å; W216-A226 WeakPolarHBondContact O-CA 3.49Å; A226-I275 WeakPolarHBondContact O-CA 3.4Å; A226-T276 WeakPolarHBondContact CB-OG1 3.01Å; A226-T276 PolarHBondContact N-O 3.39Å; A226-T276 PolarHBondContact O-N 3.04Å; A226-T276 PolarHBondContact O-OG1 3.26Å; A226-Y278 HydrophobicContact CB-CD2 4.18Å
227	V	96.1	Very high	91.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	107	-179.6	-173.7	0	0	0	0	108.7	I201 L203 V215 W216 V225 I229 W273	I201-V227 HydrophobicContact CG2-CG2 3.96Å; L203-V227 HydrophobicContact CD2-CB 4.02Å; L203-V227 HydrophobicContact CD2-CG1 4.16Å; L203-V227 HydrophobicContact CD2-CG2 4.04Å; V215-V227 WeakPolarHBondContact CA-O 3.17Å; W216-V227 HydrophobicContact CB-CB 4.49Å; W216-V227 PolarHBondContact N-O 3Å; W216-V227 PolarHBondContact O-N 3.24Å; V225-V227 HydrophobicContact CG2-CG2 4.13Å; V227-I229 HydrophobicContact CG1-CD1 4.42Å; V227-I229 HydrophobicContact CG1-CG1 3.84Å; V227-W273 HydrophobicContact CG1-CB 4.17Å; V227-W273 HydrophobicContact CG1-CD2 3.48Å; V227-W273 VanDerWaalsContact CG1-CD2 3.48Å; V227-W273 HydrophobicContact CG1-CE3 3.36Å; V227-W273 HydrophobicContact CG1-CG 3.85Å; V227-W273 HydrophobicContact CG1-CH2 4.47Å; V227-W273 HydrophobicContact CG1-CZ3 3.88Å; V227-W273 HydrophobicContact CG2-CE3 4.46Å; V227-W273 HydrophobicContact CG2-CZ3 4.43Å
228	K	94.8	Very high	91.3	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.096	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	117.2	171	-171.5	178.1	-174.6	-171.2	0	108.1	E214 V215 F230 E241 W273 L274 D347	E214-K228 WeakPolarHBondContact O-CA 3.49Å; V215-K228 HydrophobicContact CG2-CB 4.25Å; V215-K228 HydrophobicContact CG2-CG 4.04Å; K228-F230 HydrophobicContact CB-CE2 4.07Å; K228-F230 HydrophobicContact CD-CE1 4.36Å; K228-F230 HydrophobicContact CD-CE2 3.73Å; K228-F230 HydrophobicContact CD-CZ 3.46Å; K228-F230 VanDerWaalsContact CD-CZ 3.46Å; K228-F230 VanDerWaalsContact CE-CZ 3.46Å; K228-F230 HydrophobicContact CG-CD2 4.3Å; K228-F230 HydrophobicContact CG-CE2 3.58Å; K228-F230 HydrophobicContact CG-CZ 3.77Å; K228-E241 IonicContact NZ-OE1 3.21Å; K228-E241 PolarHBondContact NZ-OE1 3.06Å; K228-E241 IonicContact NZ-OE2 3.03Å; K228-E241 PolarHBondContact NZ-OE2 3.15Å; K228-W273 WeakPolarHBondContact O-CA 3.18Å; K228-L274 HydrophobicContact CB-CB 4.29Å; K228-L274 HydrophobicContact CD-CD2 4.42Å; K228-L274 PolarHBondContact N-O 3.05Å; K228-L274 PolarHBondContact O-N 3.45Å; K228-D347 IonicContact NZ-OD1 3.9Å; K228-D347 PolarHBondContact NZ-OD1 3.25Å
229	I	93.5	Very high	91	Very high	19 Å²	19	69.1 Å²	69.1	10%	0.097	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.1	-175.4	-54.8	179.7	0	0	0	108.5	L203 G213 E214 W216 V227 Q271 W273	L203-I229 HydrophobicContact CD1-CD1 3.66Å; L203-I229 HydrophobicContact CD2-CD1 4.3Å; G213-I229 WeakPolarHBondContact CA-O 3.34Å; E214-I229 PolarHBondContact N-O 3.2Å; E214-I229 PolarHBondContact O-N 3.45Å; W216-I229 HydrophobicContact CG-CD1 4.19Å; V227-I229 HydrophobicContact CG1-CD1 4.42Å; V227-I229 HydrophobicContact CG1-CG1 3.84Å; I229-Q271 HydrophobicContact CG2-CB 3.93Å; I229-Q271 HydrophobicContact CG2-CG 4.09Å; I229-W273 HydrophobicContact CD1-CZ2 4.23Å; I229-W273 HydrophobicContact CG1-CG 4.49Å
230	F	91.8	Very high	90.6	Very high	1 Å²	1	68 Å²	68	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.7	176.1	-57.1	-107.6	0	0	0	110.4	Y212 K228 D234 W238 E241 L272 L274	Y212-F230 HydrophobicContact CG-CE1 4.43Å; Y212-F230 WeakPolarHBondContact O-CD1 3.29Å; K228-F230 HydrophobicContact CB-CE2 4.07Å; K228-F230 HydrophobicContact CD-CE1 4.36Å; K228-F230 HydrophobicContact CD-CE2 3.73Å; K228-F230 HydrophobicContact CD-CZ 3.46Å; K228-F230 VanDerWaalsContact CD-CZ 3.46Å; K228-F230 VanDerWaalsContact CE-CZ 3.46Å; K228-F230 HydrophobicContact CG-CD2 4.3Å; K228-F230 HydrophobicContact CG-CE2 3.58Å; K228-F230 HydrophobicContact CG-CZ 3.77Å; F230-D234 HydrophobicContact CB-CB 4.48Å; F230-D234 HydrophobicContact CD1-CB 4.39Å; F230-W238 HydrophobicContact CB-CB 4.17Å; F230-W238 HydrophobicContact CD1-CB 4.06Å; F230-W238 HydrophobicContact CD2-CB 3.9Å; F230-W238 AromaticContact CD2-CD1 3.66Å; F230-W238 HydrophobicContact CD2-CG 4.15Å; F230-W238 HydrophobicContact CE1-CB 4.38Å; F230-W238 HydrophobicContact CE2-CB 4.25Å; F230-W238 AromaticContact CE2-CD1 3.85Å; F230-W238 HydrophobicContact CE2-CG 4.48Å; F230-W238 HydrophobicContact CG-CB 3.8Å; F230-W238 HydrophobicContact CG-CG 4.48Å; F230-W238 HydrophobicContact CZ-CB 4.46Å; F230-E241 VanDerWaalsContact CZ-OE2 3.32Å; F230-E241 WeakPolarHBondContact CZ-OE2 3.5Å; F230-L272 HydrophobicContact CB-CB 4.19Å; F230-L272 PolarHBondContact N-O 3.33Å; F230-L272 PolarHBondContact O-N 2.76Å; F230-L272 VanDerWaalsContact O-N 3.14Å; F230-L274 HydrophobicContact CE2-CB 3.94Å
231	S	88.3	Confident	90.5	Very high	53 Å²	53	65.6 Å²	65.6	37%	0.371	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	152.3	165.8	-175.8	0	0	0	0	109.9	R233 D234	S231-R233 PolarHBondContact O-N 2.95Å; S231-R233 PolarHBondContact OG-N 3.15Å; S231-D234 PolarHBondContact O-N 3.25Å
232	S	85.8	Confident	90.6	Very high	65 Å²	65	59 Å²	59	46%	0.455	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-56.4	-21	168.5	57	0	0	0	0	113.5	D234	S232-D234 VanDerWaalsContact C-N 3.27Å; S232-D234 PolarHBondContact O-N 3.33Å
233	R	85.3	Confident	90.8	Very high	228 Å²	228	60.2 Å²	60.2	86%	0.86	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-69.6	-24.6	173.5	-62	-179.5	-178.9	178.9	0.5	113.3	S231	S231-R233 PolarHBondContact O-N 2.95Å; S231-R233 PolarHBondContact OG-N 3.15Å
234	D	85.1	Confident	90.8	Very high	53 Å²	53	53.6 Å²	53.6	28%	0.283	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-104.4	22.7	-177	-61.8	-60.2	0	0	0	112	F230 S231 S232 K236 S237 W238	F230-D234 HydrophobicContact CB-CB 4.48Å; F230-D234 HydrophobicContact CD1-CB 4.39Å; S231-D234 PolarHBondContact O-N 3.25Å; S232-D234 VanDerWaalsContact C-N 3.27Å; S232-D234 PolarHBondContact O-N 3.33Å; D234-K236 VanDerWaalsContact C-N 3.26Å; D234-K236 PolarHBondContact O-N 3.23Å; D234-S237 WeakPolarHBondContact O-CB 3.29Å; D234-S237 PolarHBondContact O-N 2.83Å; D234-W238 PolarHBondContact O-N 2.93Å; D234-W238 VanDerWaalsContact O-N 3.11Å
235	E	87.3	Confident	90.6	Very high	107 Å²	107	51.1 Å²	51.1	50%	0.5	24%	0.241	S	C	.	.	H	α-helix	trans	-53.1	-40.3	-178.2	-177.6	-179.4	-177.3	0	0	113.1	S237 W238 F239 L272	E235-S237 VanDerWaalsContact C-N 3.29Å; E235-S237 PolarHBondContact O-N 2.69Å; E235-W238 PolarHBondContact O-N 3.31Å; E235-F239 VanDerWaalsContact O-CB 3.29Å; E235-F239 WeakPolarHBondContact O-CB 3.28Å; E235-F239 PolarHBondContact O-N 2.82Å; E235-L272 HydrophobicContact CB-CD1 3.79Å; E235-L272 HydrophobicContact CG-CD1 3.95Å
236	K	84.9	Confident	90.4	Very high	187 Å²	187	55.6 Å²	55.6	81%	0.813	27%	0.265	S	S	*	.	H	α-helix	trans	-61.3	-37.7	177.7	-66.7	-176.5	179	-178.6	0	112.5	D234 R240	D234-K236 VanDerWaalsContact C-N 3.26Å; D234-K236 PolarHBondContact O-N 3.23Å; K236-R240 WeakPolarHBondContact O-CB 3.46Å; K236-R240 PolarHBondContact O-N 3.37Å
237	S	85.7	Confident	90.1	Very high	22 Å²	22	56.5 Å²	56.5	15%	0.154	27%	0.269	C	S	.	.	H	α-helix	trans	-72.1	-42.5	178.3	-67.1	0	0	0	0	111.3	Y212 D234 E235 E241	Y212-S237 WeakPolarHBondContact CD1-OG 3.42Å; Y212-S237 VanDerWaalsContact CE1-OG 3.28Å; Y212-S237 WeakPolarHBondContact CE1-OG 3.28Å; D234-S237 WeakPolarHBondContact O-CB 3.29Å; D234-S237 PolarHBondContact O-N 2.83Å; E235-S237 VanDerWaalsContact C-N 3.29Å; E235-S237 PolarHBondContact O-N 2.69Å; S237-E241 WeakPolarHBondContact O-CB 3.37Å; S237-E241 PolarHBondContact O-N 3.47Å
238	W	90.5	Very high	89.8	Confident	31 Å²	31	59.5 Å²	59.5	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-45.9	173.1	169.4	80.1	0	0	0	112.1	F230 D234 E235 E241 T242 L272 W273	F230-W238 HydrophobicContact CB-CB 4.17Å; F230-W238 HydrophobicContact CD1-CB 4.06Å; F230-W238 HydrophobicContact CD2-CB 3.9Å; F230-W238 AromaticContact CD2-CD1 3.66Å; F230-W238 HydrophobicContact CD2-CG 4.15Å; F230-W238 HydrophobicContact CE1-CB 4.38Å; F230-W238 HydrophobicContact CE2-CB 4.25Å; F230-W238 AromaticContact CE2-CD1 3.85Å; F230-W238 HydrophobicContact CE2-CG 4.48Å; F230-W238 HydrophobicContact CG-CB 3.8Å; F230-W238 HydrophobicContact CG-CG 4.48Å; F230-W238 HydrophobicContact CZ-CB 4.46Å; D234-W238 PolarHBondContact O-N 2.93Å; D234-W238 VanDerWaalsContact O-N 3.11Å; E235-W238 PolarHBondContact O-N 3.31Å; W238-E241 PolarHBondContact O-N 2.91Å; W238-T242 VanDerWaalsContact O-CB 3.22Å; W238-T242 WeakPolarHBondContact O-CB 3.4Å; W238-T242 PolarHBondContact O-N 3.39Å; W238-T242 PolarHBondContact O-OG1 3.07Å; W238-L272 HydrophobicContact CB-CB 4.2Å; W238-L272 HydrophobicContact CB-CD1 4.09Å; W238-L272 HydrophobicContact CD2-CB 3.75Å; W238-L272 HydrophobicContact CD2-CD1 4.1Å; W238-L272 HydrophobicContact CD2-CD2 4.43Å; W238-L272 HydrophobicContact CD2-CG 4.32Å; W238-L272 HydrophobicContact CE3-CB 4.37Å; W238-L272 HydrophobicContact CE3-CD1 4Å; W238-L272 HydrophobicContact CE3-CD2 4.28Å; W238-L272 HydrophobicContact CE3-CG 4.46Å; W238-L272 HydrophobicContact CG-CB 3.64Å; W238-L272 HydrophobicContact CG-CD1 4.16Å; W238-L272 HydrophobicContact CG-CG 4.47Å; W238-L272 HydrophobicContact CZ3-CD2 4.37Å; W238-W273 PolarHBondContact NE1-O 3.36Å
239	F	89.9	Confident	89.7	Confident	122 Å²	122	62.9 Å²	62.9	54%	0.535	31%	0.306	S	S	.	.	H	α-helix	trans	-60.8	-49.1	179.1	-179	-91.8	0	0	0	110.7	E235 E241 T242 E243	E235-F239 VanDerWaalsContact O-CB 3.29Å; E235-F239 WeakPolarHBondContact O-CB 3.28Å; E235-F239 PolarHBondContact O-N 2.82Å; F239-E241 PolarHBondContact O-N 2.87Å; F239-T242 PolarHBondContact O-N 2.76Å; F239-E243 VanDerWaalsContact O-CB 3.3Å; F239-E243 WeakPolarHBondContact O-CB 3.22Å; F239-E243 PolarHBondContact O-N 3.4Å
240	R	88.2	Confident	89.8	Confident	35 Å²	35	62.1 Å²	62.1	13%	0.132	30%	0.303	C	S	.	.	H	α-helix	trans	-58.9	-48.6	178.2	-179.3	53.4	170.4	-166.5	-5.9	112	K236 T242 E243 I244 A351 D362	K236-R240 WeakPolarHBondContact O-CB 3.46Å; K236-R240 PolarHBondContact O-N 3.37Å; R240-T242 VanDerWaalsContact C-N 3.32Å; R240-T242 PolarHBondContact O-N 3.36Å; R240-E243 IonicContact CZ-OE2 2.81Å; R240-E243 IonicContact NH1-OE2 2.71Å; R240-E243 PolarHBondContact NH1-OE2 3.11Å; R240-E243 PolarHBondContact O-N 2.98Å; R240-I244 VanDerWaalsContact O-CG1 3.29Å; R240-I244 WeakPolarHBondContact O-CG1 3.35Å; R240-I244 PolarHBondContact O-N 3.21Å; R240-A351 PolarHBondContact NE-O 3.47Å; R240-A351 PolarHBondContact NH2-O 3.01Å; R240-D362 IonicContact CZ-OD2 3.94Å; R240-D362 VanDerWaalsContact CZ-OD2 3.26Å; R240-D362 IonicContact NH1-OD2 2.58Å; R240-D362 PolarHBondContact NH1-OD2 3.13Å; R240-D362 PolarHBondContact NH2-O 3.28Å; R240-D362 IonicContact NH2-OD2 3.73Å; R240-D362 PolarHBondContact NH2-OD2 3.16Å
241	E	91.9	Very high	89.9	Confident	3 Å²	3	72.8 Å²	72.8	1%	0.014	34%	0.343	C	S	.	.	H	α-helix	trans	-64.5	-40	-179	-165	166.6	173.4	0	0	111.4	K228 F230 S237 W238 F239 I244 Y245 L274	K228-E241 IonicContact NZ-OE1 3.21Å; K228-E241 PolarHBondContact NZ-OE1 3.06Å; K228-E241 IonicContact NZ-OE2 3.03Å; K228-E241 PolarHBondContact NZ-OE2 3.15Å; F230-E241 VanDerWaalsContact CZ-OE2 3.32Å; F230-E241 WeakPolarHBondContact CZ-OE2 3.5Å; S237-E241 WeakPolarHBondContact O-CB 3.37Å; S237-E241 PolarHBondContact O-N 3.47Å; W238-E241 PolarHBondContact O-N 2.91Å; F239-E241 PolarHBondContact O-N 2.87Å; E241-I244 PolarHBondContact O-N 3.09Å; E241-Y245 HydrophobicContact CG-CD2 3.82Å; E241-Y245 HydrophobicContact CG-CE2 3.66Å; E241-Y245 WeakPolarHBondContact O-CB 3.42Å; E241-Y245 WeakPolarHBondContact O-CD2 3.45Å; E241-Y245 PolarHBondContact O-N 2.72Å; E241-L274 HydrophobicContact CG-CD2 3.78Å; E241-L274 WeakPolarHBondContact OE1-CD2 3.39Å
242	T	91.9	Very high	90.4	Very high	13 Å²	13	72.9 Å²	72.9	8%	0.08	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-44.4	175.3	-61.8	0	0	0	0	112.1	W238 F239 R240 Y245 N246 S261	W238-T242 VanDerWaalsContact O-CB 3.22Å; W238-T242 WeakPolarHBondContact O-CB 3.4Å; W238-T242 PolarHBondContact O-N 3.39Å; W238-T242 PolarHBondContact O-OG1 3.07Å; F239-T242 PolarHBondContact O-N 2.76Å; R240-T242 VanDerWaalsContact C-N 3.32Å; R240-T242 PolarHBondContact O-N 3.36Å; T242-Y245 PolarHBondContact O-N 2.75Å; T242-N246 VanDerWaalsContact CG2-ND2 3.33Å; T242-N246 WeakPolarHBondContact CG2-ND2 3.37Å; T242-N246 WeakPolarHBondContact O-CB 3.32Å; T242-N246 PolarHBondContact O-N 3.44Å; T242-N246 PolarHBondContact O-ND2 2.71Å; T242-S261 VanDerWaalsContact CG2-CB 3.49Å; T242-S261 WeakPolarHBondContact CG2-OG 3.48Å
243	E	92.3	Very high	90.9	Very high	84 Å²	84	76.3 Å²	76.3	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-48.7	176.4	176.1	-175	-137.6	0	0	110.9	F239 R240 Y245 N246 T247	F239-E243 VanDerWaalsContact O-CB 3.3Å; F239-E243 WeakPolarHBondContact O-CB 3.22Å; F239-E243 PolarHBondContact O-N 3.4Å; R240-E243 IonicContact CZ-OE2 2.81Å; R240-E243 IonicContact NH1-OE2 2.71Å; R240-E243 PolarHBondContact NH1-OE2 3.11Å; R240-E243 PolarHBondContact O-N 2.98Å; E243-Y245 PolarHBondContact O-N 3.31Å; E243-N246 PolarHBondContact O-N 3.4Å; E243-T247 PolarHBondContact O-N 3.27Å; E243-T247 PolarHBondContact O-OG1 2.9Å
244	I	93.2	Very high	91.5	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-48.9	177.3	-62.4	-68.9	0	0	0	109.8	R240 E241 N246 T247 L250 L348 A351 T353	R240-I244 VanDerWaalsContact O-CG1 3.29Å; R240-I244 WeakPolarHBondContact O-CG1 3.35Å; R240-I244 PolarHBondContact O-N 3.21Å; E241-I244 PolarHBondContact O-N 3.09Å; I244-N246 VanDerWaalsContact C-N 3.25Å; I244-N246 PolarHBondContact O-N 3.39Å; I244-T247 WeakPolarHBondContact O-CB 3.5Å; I244-T247 PolarHBondContact O-N 3.18Å; I244-T247 PolarHBondContact O-OG1 3.43Å; I244-L250 HydrophobicContact CG2-CD2 4.27Å; I244-L250 WeakPolarHBondContact O-CD2 3.44Å; I244-L348 HydrophobicContact CB-CB 4.32Å; I244-L348 HydrophobicContact CG2-CB 3.78Å; I244-L348 HydrophobicContact CG2-CD1 3.7Å; I244-L348 HydrophobicContact CG2-CG 4.32Å; I244-A351 HydrophobicContact CD1-CB 4.29Å; I244-A351 HydrophobicContact CG1-CB 4.23Å; I244-A351 HydrophobicContact CG2-CB 4.37Å; I244-T353 HydrophobicContact CD1-CG2 3.62Å
245	Y	93.6	Very high	92.2	Very high	15 Å²	15	63.4 Å²	63.4	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-29.8	179.8	-85.7	-58.5	0	0	0	114.4	E241 T242 E243 T247 L250 F258 L274 D347 L348	E241-Y245 HydrophobicContact CG-CD2 3.82Å; E241-Y245 HydrophobicContact CG-CE2 3.66Å; E241-Y245 WeakPolarHBondContact O-CB 3.42Å; E241-Y245 WeakPolarHBondContact O-CD2 3.45Å; E241-Y245 PolarHBondContact O-N 2.72Å; T242-Y245 PolarHBondContact O-N 2.75Å; E243-Y245 PolarHBondContact O-N 3.31Å; Y245-T247 VanDerWaalsContact C-N 3.26Å; Y245-T247 PolarHBondContact O-N 3.14Å; Y245-L250 HydrophobicContact CD1-CD2 4.29Å; Y245-F258 HydrophobicContact CD1-CB 3.66Å; Y245-F258 HydrophobicContact CD1-CG 4.37Å; Y245-F258 HydrophobicContact CD2-CD2 4.35Å; Y245-F258 HydrophobicContact CE1-CB 4.43Å; Y245-F258 HydrophobicContact CG-CB 3.86Å; Y245-F258 AromaticContact CG-CD2 4Å; Y245-F258 HydrophobicContact CG-CD2 4Å; Y245-F258 HydrophobicContact CG-CG 4.07Å; Y245-L274 HydrophobicContact CD2-CD1 4.21Å; Y245-L274 HydrophobicContact CD2-CD2 4.03Å; Y245-L274 HydrophobicContact CE2-CD2 3.89Å; Y245-D347 PolarHBondContact OH-N 3.37Å; Y245-L348 HydrophobicContact CD1-CD1 3.99Å; Y245-L348 HydrophobicContact CE1-CD1 3.65Å; Y245-L348 HydrophobicContact CE1-CG 4.29Å; Y245-L348 HydrophobicContact CE2-CB 4.45Å; Y245-L348 HydrophobicContact CE2-CD1 4.45Å; Y245-L348 HydrophobicContact CE2-CG 4.46Å
246	N	91.4	Very high	92.7	Very high	95 Å²	95	58.9 Å²	58.9	51%	0.508	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.5	174.8	-78.3	-60.2	0	0	0	113.9	T242 E243 I244 V248 F258	T242-N246 VanDerWaalsContact CG2-ND2 3.33Å; T242-N246 WeakPolarHBondContact CG2-ND2 3.37Å; T242-N246 WeakPolarHBondContact O-CB 3.32Å; T242-N246 PolarHBondContact O-N 3.44Å; T242-N246 PolarHBondContact O-ND2 2.71Å; E243-N246 PolarHBondContact O-N 3.4Å; I244-N246 VanDerWaalsContact C-N 3.25Å; I244-N246 PolarHBondContact O-N 3.39Å; N246-V248 PolarHBondContact O-N 3.08Å; N246-F258 VanDerWaalsContact OD1-CE1 3.27Å; N246-F258 WeakPolarHBondContact OD1-CE1 3.41Å
247	T	91.1	Very high	93.1	Very high	29 Å²	29	50.6 Å²	50.6	18%	0.178	24%	0.241	C	C	.	.	S	Bend	trans	-59.5	131.7	177.5	-63.8	0	0	0	0	110.9	E243 I244 Y245 L250 K322 P323	E243-T247 PolarHBondContact O-N 3.27Å; E243-T247 PolarHBondContact O-OG1 2.9Å; I244-T247 WeakPolarHBondContact O-CB 3.5Å; I244-T247 PolarHBondContact O-N 3.18Å; I244-T247 PolarHBondContact O-OG1 3.43Å; Y245-T247 VanDerWaalsContact C-N 3.26Å; Y245-T247 PolarHBondContact O-N 3.14Å; T247-L250 WeakPolarHBondContact O-CB 3.28Å; T247-L250 PolarHBondContact O-N 3.47Å; T247-L250 VanDerWaalsContact O-N 3.15Å; T247-K322 HydrophobicContact CG2-CG 3.91Å; T247-P323 HydrophobicContact CG2-CG 4.04Å
248	V	89.6	Confident	93.5	Very high	64 Å²	64	51.7 Å²	51.7	39%	0.388	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	140.7	-179.9	-164.4	0	0	0	0	110.2	N246 L250 E320 K322	N246-V248 PolarHBondContact O-N 3.08Å; V248-L250 PolarHBondContact O-N 3.36Å; V248-L250 VanDerWaalsContact O-N 3.1Å; V248-E320 HydrophobicContact CB-CB 4.36Å; V248-E320 HydrophobicContact CG1-CB 3.98Å; V248-E320 HydrophobicContact CG2-CB 4.26Å; V248-K322 WeakPolarHBondContact O-CB 3.44Å; V248-K322 WeakPolarHBondContact O-CG 3.4Å
249	L	93.1	Very high	93.6	Very high	92 Å²	92	53.7 Å²	53.7	48%	0.482	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	15.8	-175.9	-49	175.4	0	0	0	115.1	H311 I316 K322	L249-H311 PolarHBondContact O-CE1 2.8Å; L249-H311 VanDerWaalsContact O-CE1 3.26Å; L249-H311 PolarHBondContact O-NE2 3.3Å; L249-H311 VanDerWaalsContact O-NE2 3.12Å; L249-I316 HydrophobicContact CB-CD1 4.25Å; L249-I316 HydrophobicContact CD1-CB 4.28Å; L249-I316 HydrophobicContact CD1-CG2 3.67Å; L249-K322 HydrophobicContact CB-CB 4.21Å
250	L	94.6	Very high	93.7	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	24%	0.236	C	C	.	.			trans	-70.5	-31.3	174.9	-178.8	62.7	0	0	0	113	I244 Y245 T247 V248 H252 I255 H311 L312 K322 I325 L348	I244-L250 HydrophobicContact CG2-CD2 4.27Å; I244-L250 WeakPolarHBondContact O-CD2 3.44Å; Y245-L250 HydrophobicContact CD1-CD2 4.29Å; T247-L250 WeakPolarHBondContact O-CB 3.28Å; T247-L250 PolarHBondContact O-N 3.47Å; T247-L250 VanDerWaalsContact O-N 3.15Å; V248-L250 PolarHBondContact O-N 3.36Å; V248-L250 VanDerWaalsContact O-N 3.1Å; L250-H252 PolarHBondContact O-N 3.02Å; L250-I255 HydrophobicContact CG-CG2 4.46Å; L250-H311 PolarHBondContact O-CD2 3.35Å; L250-H311 PolarHBondContact O-NE2 3.04Å; L250-L312 HydrophobicContact CD1-CD2 3.74Å; L250-K322 HydrophobicContact CD1-CD 4.43Å; L250-I325 HydrophobicContact CD1-CD1 3.78Å; L250-L348 HydrophobicContact CD2-CD1 4.08Å
251	R	94.6	Very high	94	Very high	224 Å²	224	49 Å²	49	85%	0.845	24%	0.244	S	C	*	.			trans	-56.1	124.5	-176.8	-174.9	175.5	178.8	142.3	-1.4	111.6
252	H	97.6	Very high	94	Very high	56 Å²	56	50.1 Å²	50.1	26%	0.259	25%	0.25	S	C	.	.			trans	-155.4	150.9	-179.1	-179.3	-91.6	0	0	0	109.6	L250 N254 I255 H311	L250-H252 PolarHBondContact O-N 3.02Å; H252-N254 PolarHBondContact CE1-OD1 2.9Å; H252-N254 PolarHBondContact ND1-N 3.42Å; H252-N254 PolarHBondContact O-N 2.76Å; H252-N254 VanDerWaalsContact O-N 3.15Å; H252-I255 HydrophobicContact CB-CB 4.3Å; H252-I255 HydrophobicContact CB-CG1 3.96Å; H252-I255 PolarHBondContact O-N 3.43Å; H252-H311 HydrophobicContact CB-CB 4.49Å; H252-H311 VanDerWaalsContact CB-CD2 3.44Å; H252-H311 WeakPolarHBondContact CB-CD2 3.44Å; H252-H311 AromaticContact CD2-CG 3.84Å; H252-H311 AromaticContact CD2-ND1 3.92Å; H252-H311 AromaticContact CG-CD2 3.92Å; H252-H311 AromaticContact CG-CG 3.8Å
253	E	97.3	Very high	93.8	Very high	136 Å²	136	54.3 Å²	54.3	64%	0.636	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.8	-176.7	55.5	169.1	-174.5	0	0	114
254	N	98.7	Very high	93.6	Very high	3 Å²	3	51 Å²	51	2%	0.016	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	20	179.4	-49.4	126.1	0	0	0	113.5	H252 S304 N307 C343 C344 I345	H252-N254 PolarHBondContact CE1-OD1 2.9Å; H252-N254 PolarHBondContact ND1-N 3.42Å; H252-N254 PolarHBondContact O-N 2.76Å; H252-N254 VanDerWaalsContact O-N 3.15Å; N254-S304 WeakPolarHBondContact CB-O 3.45Å; N254-S304 WeakPolarHBondContact ND2-CB 3.24Å; N254-S304 PolarHBondContact OD1-O 3.4Å; N254-N307 WeakPolarHBondContact OD1-CB 3.42Å; N254-C343 WeakPolarHBondContact CA-O 3.27Å; N254-C343 WeakPolarHBondContact CB-O 3.42Å; N254-C343 PolarHBondContact ND2-O 2.79Å; N254-C344 CarbonylContact O-C 3.55Å; N254-C344 VanDerWaalsContact O-CA 3.29Å; N254-C344 WeakPolarHBondContact O-CA 3.02Å; N254-I345 PolarHBondContact O-N 2.88Å
255	I	98.4	Very high	93.1	Very high	7 Å²	7	55.1 Å²	55.1	4%	0.036	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-121.8	134.9	167.5	-58.4	-61	0	0	0	107.3	L250 H252 G257 L312 I345 L348	L250-I255 HydrophobicContact CG-CG2 4.46Å; H252-I255 HydrophobicContact CB-CB 4.3Å; H252-I255 HydrophobicContact CB-CG1 3.96Å; H252-I255 PolarHBondContact O-N 3.43Å; I255-G257 PolarHBondContact O-N 2.96Å; I255-L312 HydrophobicContact CD1-CD1 3.85Å; I255-L312 HydrophobicContact CD1-CD2 3.89Å; I255-L312 HydrophobicContact CD1-CG 3.62Å; I255-I345 HydrophobicContact CD1-CB 4.03Å; I255-I345 HydrophobicContact CD1-CD1 4.34Å; I255-I345 HydrophobicContact CD1-CG1 4.49Å; I255-L348 HydrophobicContact CG2-CD1 4.49Å
256	L	97.7	Very high	92.4	Very high	12 Å²	12	58.1 Å²	58.1	6%	0.063	30%	0.296	C	S	.	.			trans	-54.1	127.7	-177.1	178.2	57.2	0	0	0	111	F258 T276 Q277 L336 I345 A346	L256-F258 PolarHBondContact O-N 3.49Å; L256-T276 HydrophobicContact CD2-CG2 3.95Å; L256-T276 HydrophobicContact CG-CG2 4.22Å; L256-Q277 HydrophobicContact CD1-CB 4.38Å; L256-L336 HydrophobicContact CD1-CD1 3.8Å; L256-L336 HydrophobicContact CD2-CD1 3.96Å; L256-L336 HydrophobicContact CG-CD1 4.43Å; L256-I345 WeakPolarHBondContact CB-O 3.04Å; L256-I345 PolarHBondContact N-O 3.39Å; L256-A346 HydrophobicContact CB-CB 4.05Å; L256-A346 HydrophobicContact CD2-CB 3.63Å; L256-A346 HydrophobicContact CG-CB 4.46Å
257	G	94.9	Very high	91.7	Very high	14 Å²	14	60.9 Å²	60.9	14%	0.144	31%	0.31	C	S	.	.			trans	-66.9	102.9	-179.2	0	0	0	0	0	112	I255 T276 Q277	I255-G257 PolarHBondContact O-N 2.96Å; G257-T276 CarbonylContact O-C 3.56Å; G257-T276 VanDerWaalsContact O-CA 3.29Å; G257-T276 WeakPolarHBondContact O-CA 3.49Å; G257-Q277 PolarHBondContact O-N 3.13Å
258	F	94.1	Very high	91.4	Very high	44 Å²	44	65.7 Å²	65.7	19%	0.193	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	139.1	168.8	174.6	-107.7	0	0	0	111	Y245 N246 L256 A260 L274	Y245-F258 HydrophobicContact CD1-CB 3.66Å; Y245-F258 HydrophobicContact CD1-CG 4.37Å; Y245-F258 HydrophobicContact CD2-CD2 4.35Å; Y245-F258 HydrophobicContact CE1-CB 4.43Å; Y245-F258 HydrophobicContact CG-CB 3.86Å; Y245-F258 AromaticContact CG-CD2 4Å; Y245-F258 HydrophobicContact CG-CD2 4Å; Y245-F258 HydrophobicContact CG-CG 4.07Å; N246-F258 VanDerWaalsContact OD1-CE1 3.27Å; N246-F258 WeakPolarHBondContact OD1-CE1 3.41Å; L256-F258 PolarHBondContact O-N 3.49Å; F258-A260 WeakPolarHBondContact CE2-O 3.4Å; F258-L274 HydrophobicContact CD2-CD1 3.96Å; F258-L274 HydrophobicContact CE2-CD1 3.57Å; F258-L274 HydrophobicContact CE2-CG 4.46Å
259	M	92.2	Very high	91	Very high	73 Å²	73	65.1 Å²	65.1	36%	0.36	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-51.9	-179.3	-60	176.2	64.2	0	0	111.1	W220 V225 I275 T276 Q277	W220-M259 HydrophobicContact CE3-CE 3.45Å; W220-M259 VanDerWaalsContact CE3-CE 3.45Å; W220-M259 HydrophobicContact CZ3-CE 3.41Å; W220-M259 VanDerWaalsContact CZ3-CE 3.41Å; V225-M259 HydrophobicContact CB-SD 4.5Å; V225-M259 HydrophobicContact CG1-CE 3.75Å; V225-M259 HydrophobicContact CG1-SD 3.82Å; M259-I275 HydrophobicContact CB-CG2 4.24Å; M259-I275 WeakPolarHBondContact CB-O 3.33Å; M259-I275 PolarHBondContact N-O 3.49Å; M259-I275 HydrophobicContact SD-CG2 4.4Å; M259-T276 VanDerWaalsContact SD-C 3.59Å; M259-Q277 HydrophobicContact SD-CG 4.29Å
260	A	91.8	Very high	90.8	Very high	17 Å²	17	63.9 Å²	63.9	14%	0.14	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	163.2	-179.2	0	0	0	0	0	111.3	V197 F258 I275	V197-A260 HydrophobicContact CB-CB 4.29Å; V197-A260 HydrophobicContact CG1-CB 4.07Å; V197-A260 HydrophobicContact CG2-CB 4.14Å; F258-A260 WeakPolarHBondContact CE2-O 3.4Å; A260-I275 HydrophobicContact CB-CB 4.48Å; A260-I275 HydrophobicContact CB-CD1 4.22Å; A260-I275 PolarHBondContact N-O 2.94Å; A260-I275 WeakPolarHBondContact O-CA 3.45Å; A260-I275 WeakPolarHBondContact O-CB 3.17Å; A260-I275 WeakPolarHBondContact O-CD1 3.43Å; A260-I275 PolarHBondContact O-N 3.3Å
261	S	93.2	Very high	90.7	Very high	42 Å²	42	65.2 Å²	65.2	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.2	164.2	56.4	0	0	0	0	108.2	T242 W273	T242-S261 VanDerWaalsContact CG2-CB 3.49Å; T242-S261 WeakPolarHBondContact CG2-OG 3.48Å; S261-W273 CarbonylContact C-O 3.48Å; S261-W273 VanDerWaalsContact CA-O 3.28Å; S261-W273 WeakPolarHBondContact CA-O 3.4Å
262	D	92.6	Very high	90.6	Very high	27 Å²	27	54.7 Å²	54.7	14%	0.144	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	156.7	-176.6	-159.8	-3.8	0	0	0	110.9	T196 V197 A198 W273 I275	T196-D262 WeakPolarHBondContact CB-OD2 3.49Å; T196-D262 PolarHBondContact OG1-OD2 2.91Å; V197-D262 PolarHBondContact N-OD2 3.04Å; A198-D262 HydrophobicContact CB-CB 3.88Å; A198-D262 WeakPolarHBondContact CB-OD2 3.37Å; A198-D262 PolarHBondContact N-OD2 3.34Å; D262-W273 PolarHBondContact N-O 2.86Å; D262-W273 PolarHBondContact O-N 2.94Å; D262-I275 HydrophobicContact CB-CD1 4.33Å
263	M	88.7	Confident	90.5	Very high	101 Å²	101	52 Å²	52	50%	0.498	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.2	175.1	-178.3	-177.3	-49.6	0	0	108.6	T270 L272	M263-T270 HydrophobicContact CG-CG2 3.7Å; M263-T270 HydrophobicContact SD-CG2 3.81Å; M263-L272 HydrophobicContact CB-CD2 4.19Å; M263-L272 HydrophobicContact CE-CD2 3.69Å; M263-L272 HydrophobicContact CG-CD2 3.82Å; M263-L272 HydrophobicContact SD-CD2 4.29Å
264	T	86.5	Confident	90.3	Very high	15 Å²	15	45.7 Å²	45.7	9%	0.092	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150	-179.7	-164.4	0	0	0	0	111.4	A198 R266 Q271 W273	A198-T264 HydrophobicContact CB-CG2 4.4Å; T264-R266 HydrophobicContact CG2-CG 4.37Å; T264-Q271 HydrophobicContact CG2-CB 3.95Å; T264-Q271 PolarHBondContact N-O 2.82Å; T264-Q271 PolarHBondContact O-N 3.46Å; T264-W273 HydrophobicContact CG2-CD2 4.13Å; T264-W273 HydrophobicContact CG2-CG 4.31Å; T264-W273 HydrophobicContact CG2-CZ2 4Å
265	S	84.6	Confident	90.1	Very high	88 Å²	88	45.5 Å²	45.5	62%	0.615	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	113.2	171.8	-177.6	0	0	0	0	108.5	S269	S265-S269 WeakPolarHBondContact CA-O 3.36Å
266	R	77.8	Confident	90	Very high	78 Å²	78	45.7 Å²	45.7	29%	0.294	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.1	174	-69.9	-166	-175.3	-168.9	4.5	109.3	A198 I201 T264 S268 S269	A198-R266 PolarHBondContact O-NH2 3.09Å; I201-R266 PolarHBondContact O-NH2 3Å; I201-R266 VanDerWaalsContact O-NH2 3.09Å; T264-R266 HydrophobicContact CG2-CG 4.37Å; R266-S268 PolarHBondContact O-N 3.41Å; R266-S269 PolarHBondContact N-O 3.31Å; R266-S269 PolarHBondContact O-N 3.2Å; R266-S269 PolarHBondContact O-OG 2.96Å
267	N	77.9	Confident	89.9	Confident	153 Å²	153	49.3 Å²	49.3	82%	0.818	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	40.5	179.4	-55.7	-23.8	0	0	0	113.4	S269	N267-S269 PolarHBondContact O-N 3.33Å
268	S	82.7	Confident	90	Very high	130 Å²	130	51.5 Å²	51.5	91%	0.909	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	23.4	-177.2	-50.8	0	0	0	0	114.5	R266	R266-S268 PolarHBondContact O-N 3.41Å
269	S	83	Confident	90.1	Very high	52 Å²	52	51 Å²	51	36%	0.364	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136	176.1	68.4	0	0	0	0	110.9	S265 R266 N267 Q271	S265-S269 WeakPolarHBondContact CA-O 3.36Å; R266-S269 PolarHBondContact N-O 3.31Å; R266-S269 PolarHBondContact O-N 3.2Å; R266-S269 PolarHBondContact O-OG 2.96Å; N267-S269 PolarHBondContact O-N 3.33Å; S269-Q271 PolarHBondContact O-N 3.16Å
270	T	88.6	Confident	90.3	Very high	65 Å²	65	54.1 Å²	54.1	40%	0.399	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.6	169.7	-55.6	0	0	0	0	108.9	M263	M263-T270 HydrophobicContact CG-CG2 3.7Å; M263-T270 HydrophobicContact SD-CG2 3.81Å
271	Q	91.3	Very high	90.5	Very high	33 Å²	33	55.1 Å²	55.1	15%	0.154	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.4	177.7	-64.7	-175.7	-9.9	0	0	108.8	I229 T264 S269 W273	I229-Q271 HydrophobicContact CG2-CB 3.93Å; I229-Q271 HydrophobicContact CG2-CG 4.09Å; T264-Q271 HydrophobicContact CG2-CB 3.95Å; T264-Q271 PolarHBondContact N-O 2.82Å; T264-Q271 PolarHBondContact O-N 3.46Å; S269-Q271 PolarHBondContact O-N 3.16Å; Q271-W273 VanDerWaalsContact OE1-NE1 3.13Å
272	L	92.8	Very high	90.7	Very high	3 Å²	3	54 Å²	54	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.3	175.9	-51.1	168	0	0	0	107.5	F230 E235 W238 M263	F230-L272 HydrophobicContact CB-CB 4.19Å; F230-L272 PolarHBondContact N-O 3.33Å; F230-L272 PolarHBondContact O-N 2.76Å; F230-L272 VanDerWaalsContact O-N 3.14Å; E235-L272 HydrophobicContact CB-CD1 3.79Å; E235-L272 HydrophobicContact CG-CD1 3.95Å; W238-L272 HydrophobicContact CB-CB 4.2Å; W238-L272 HydrophobicContact CB-CD1 4.09Å; W238-L272 HydrophobicContact CD2-CB 3.75Å; W238-L272 HydrophobicContact CD2-CD1 4.1Å; W238-L272 HydrophobicContact CD2-CD2 4.43Å; W238-L272 HydrophobicContact CD2-CG 4.32Å; W238-L272 HydrophobicContact CE3-CB 4.37Å; W238-L272 HydrophobicContact CE3-CD1 4Å; W238-L272 HydrophobicContact CE3-CD2 4.28Å; W238-L272 HydrophobicContact CE3-CG 4.46Å; W238-L272 HydrophobicContact CG-CB 3.64Å; W238-L272 HydrophobicContact CG-CD1 4.16Å; W238-L272 HydrophobicContact CG-CG 4.47Å; W238-L272 HydrophobicContact CZ3-CD2 4.37Å; M263-L272 HydrophobicContact CB-CD2 4.19Å; M263-L272 HydrophobicContact CE-CD2 3.69Å; M263-L272 HydrophobicContact CG-CD2 3.82Å; M263-L272 HydrophobicContact SD-CD2 4.29Å
273	W	94.9	Very high	90.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.9	-173.6	-73.4	23.7	0	0	0	109.7	A198 I201 L203 V227 K228 I229 W238 S261 D262 T264 Q271 I275	A198-W273 HydrophobicContact CB-CD2 4.03Å; A198-W273 HydrophobicContact CB-CE3 3.57Å; A198-W273 HydrophobicContact CB-CZ3 3.97Å; I201-W273 HydrophobicContact CB-CZ3 3.9Å; I201-W273 HydrophobicContact CD1-CZ3 4.47Å; I201-W273 HydrophobicContact CG2-CZ3 3.86Å; L203-W273 HydrophobicContact CD1-CH2 3.99Å; L203-W273 HydrophobicContact CD1-CZ2 3.82Å; L203-W273 HydrophobicContact CD2-CH2 3.64Å; L203-W273 HydrophobicContact CD2-CZ2 4.12Å; L203-W273 HydrophobicContact CD2-CZ3 4.11Å; L203-W273 HydrophobicContact CG-CH2 3.75Å; L203-W273 HydrophobicContact CG-CZ2 4.12Å; V227-W273 HydrophobicContact CG1-CB 4.17Å; V227-W273 HydrophobicContact CG1-CD2 3.48Å; V227-W273 VanDerWaalsContact CG1-CD2 3.48Å; V227-W273 HydrophobicContact CG1-CE3 3.36Å; V227-W273 HydrophobicContact CG1-CG 3.85Å; V227-W273 HydrophobicContact CG1-CH2 4.47Å; V227-W273 HydrophobicContact CG1-CZ3 3.88Å; V227-W273 HydrophobicContact CG2-CE3 4.46Å; V227-W273 HydrophobicContact CG2-CZ3 4.43Å; K228-W273 WeakPolarHBondContact O-CA 3.18Å; I229-W273 HydrophobicContact CD1-CZ2 4.23Å; I229-W273 HydrophobicContact CG1-CG 4.49Å; W238-W273 PolarHBondContact NE1-O 3.36Å; S261-W273 CarbonylContact C-O 3.48Å; S261-W273 VanDerWaalsContact CA-O 3.28Å; S261-W273 WeakPolarHBondContact CA-O 3.4Å; D262-W273 PolarHBondContact N-O 2.86Å; D262-W273 PolarHBondContact O-N 2.94Å; T264-W273 HydrophobicContact CG2-CD2 4.13Å; T264-W273 HydrophobicContact CG2-CG 4.31Å; T264-W273 HydrophobicContact CG2-CZ2 4Å; Q271-W273 VanDerWaalsContact OE1-NE1 3.13Å; W273-I275 HydrophobicContact CB-CD1 3.91Å
274	L	94.1	Very high	91.4	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.2	165.5	-174.8	83.5	0	0	0	107.3	K228 F230 E241 Y245 F258 T276	K228-L274 HydrophobicContact CB-CB 4.29Å; K228-L274 HydrophobicContact CD-CD2 4.42Å; K228-L274 PolarHBondContact N-O 3.05Å; K228-L274 PolarHBondContact O-N 3.45Å; F230-L274 HydrophobicContact CE2-CB 3.94Å; E241-L274 HydrophobicContact CG-CD2 3.78Å; E241-L274 WeakPolarHBondContact OE1-CD2 3.39Å; Y245-L274 HydrophobicContact CD2-CD1 4.21Å; Y245-L274 HydrophobicContact CD2-CD2 4.03Å; Y245-L274 HydrophobicContact CE2-CD2 3.89Å; F258-L274 HydrophobicContact CD2-CD1 3.96Å; F258-L274 HydrophobicContact CE2-CD1 3.57Å; F258-L274 HydrophobicContact CE2-CG 4.46Å; L274-T276 HydrophobicContact CD2-CG2 4.48Å; L274-T276 HydrophobicContact CG-CG2 4.44Å
275	I	95.6	Very high	91.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.9	-174.2	-54.5	89.8	0	0	0	109	I201 V225 A226 M259 A260 D262 W273	I201-I275 HydrophobicContact CD1-CG1 3.78Å; I201-I275 HydrophobicContact CD1-CG2 3.96Å; V225-I275 HydrophobicContact CB-CG2 4.08Å; V225-I275 HydrophobicContact CG1-CG2 4.47Å; V225-I275 HydrophobicContact CG2-CG2 4.28Å; A226-I275 WeakPolarHBondContact O-CA 3.4Å; M259-I275 HydrophobicContact CB-CG2 4.24Å; M259-I275 WeakPolarHBondContact CB-O 3.33Å; M259-I275 PolarHBondContact N-O 3.49Å; M259-I275 HydrophobicContact SD-CG2 4.4Å; A260-I275 HydrophobicContact CB-CB 4.48Å; A260-I275 HydrophobicContact CB-CD1 4.22Å; A260-I275 PolarHBondContact N-O 2.94Å; A260-I275 WeakPolarHBondContact O-CA 3.45Å; A260-I275 WeakPolarHBondContact O-CB 3.17Å; A260-I275 WeakPolarHBondContact O-CD1 3.43Å; A260-I275 PolarHBondContact O-N 3.3Å; D262-I275 HydrophobicContact CB-CD1 4.33Å; W273-I275 HydrophobicContact CB-CD1 3.91Å
276	T	95.8	Very high	92.5	Very high	10 Å²	10	48.9 Å²	48.9	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	168.8	-177.1	59.5	0	0	0	0	110.8	A226 L256 G257 M259 L274	A226-T276 WeakPolarHBondContact CB-OG1 3.01Å; A226-T276 PolarHBondContact N-O 3.39Å; A226-T276 PolarHBondContact O-N 3.04Å; A226-T276 PolarHBondContact O-OG1 3.26Å; L256-T276 HydrophobicContact CD2-CG2 3.95Å; L256-T276 HydrophobicContact CG-CG2 4.22Å; G257-T276 CarbonylContact O-C 3.56Å; G257-T276 VanDerWaalsContact O-CA 3.29Å; G257-T276 WeakPolarHBondContact O-CA 3.49Å; M259-T276 VanDerWaalsContact SD-C 3.59Å; L274-T276 HydrophobicContact CD2-CG2 4.48Å; L274-T276 HydrophobicContact CG-CG2 4.44Å
277	Q	95.4	Very high	93.5	Very high	89 Å²	89	46 Å²	46	42%	0.416	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	138.2	171.6	-71.7	-178.5	-27.6	0	0	111.2	L256 G257 M259	L256-Q277 HydrophobicContact CD1-CB 4.38Å; G257-Q277 PolarHBondContact O-N 3.13Å; M259-Q277 HydrophobicContact SD-CG 4.29Å
278	Y	96.9	Very high	94.5	Very high	60 Å²	60	38.7 Å²	38.7	24%	0.235	21%	0.211	C	C	.	.			trans	-87.7	134.2	173.8	-175.6	-105	0	0	0	111	V207 R217 N224 A226 E280	V207-Y278 HydrophobicContact CG1-CE2 4.2Å; R217-Y278 HydrophobicContact CB-CD2 4.27Å; R217-Y278 HydrophobicContact CB-CE2 3.88Å; R217-Y278 HydrophobicContact CG-CD1 4.44Å; R217-Y278 HydrophobicContact CG-CD2 4.03Å; R217-Y278 HydrophobicContact CG-CE1 4.28Å; R217-Y278 HydrophobicContact CG-CE2 3.88Å; R217-Y278 HydrophobicContact CG-CG 4.32Å; N224-Y278 HydrophobicContact CB-CD1 3.74Å; N224-Y278 HydrophobicContact CB-CG 4.07Å; N224-Y278 WeakPolarHBondContact O-CB 3.27Å; A226-Y278 HydrophobicContact CB-CD2 4.18Å; Y278-E280 HydrophobicContact CE1-CB 4.11Å
279	H	96.9	Very high	95.2	Very high	33 Å²	33	36.8 Å²	36.8	15%	0.153	19%	0.187	C	C	.	.			trans	-119.3	113.9	174	-70	-56.6	0	0	0	110.1	N281 G282 L336 C344	H279-N281 VanDerWaalsContact C-N 3.32Å; H279-N281 PolarHBondContact O-N 2.91Å; H279-G282 PolarHBondContact O-N 3.34Å; H279-G282 VanDerWaalsContact O-N 3.1Å; H279-L336 HydrophobicContact CB-CB 4.28Å; H279-C344 PolarHBondContact NE2-SG 3.24Å; H279-C344 VanDerWaalsContact NE2-SG 3.41Å
280	E	95.2	Very high	95.8	Very high	139 Å²	139	41.7 Å²	41.7	65%	0.65	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.1	-172.4	66.5	-169.6	157.4	0	0	114.4	Y278 G282	Y278-E280 HydrophobicContact CE1-CB 4.11Å; E280-G282 PolarHBondContact O-N 3.11Å
281	N	96.8	Very high	96.2	Very high	37 Å²	37	41 Å²	41	20%	0.198	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-9.6	176.3	-73.9	-40.2	0	0	0	112.5	H279 Y287 R290 V337 T338	H279-N281 VanDerWaalsContact C-N 3.32Å; H279-N281 PolarHBondContact O-N 2.91Å; N281-Y287 HydrophobicContact CB-CD2 3.88Å; N281-Y287 HydrophobicContact CB-CE2 4.28Å; N281-R290 PolarHBondContact O-NH2 2.99Å; N281-V337 HydrophobicContact CB-CB 3.79Å; N281-V337 HydrophobicContact CB-CG1 3.96Å; N281-V337 WeakPolarHBondContact CB-O 3.47Å; N281-T338 PolarHBondContact ND2-O 3.46Å
282	G	96.1	Very high	96.5	Very high	20 Å²	20	40.4 Å²	40.4	21%	0.206	19%	0.194	C	C	.	.			trans	71.6	-153.5	178.3	0	0	0	0	0	112.6	H279 E280 L336 V337	H279-G282 PolarHBondContact O-N 3.34Å; H279-G282 VanDerWaalsContact O-N 3.1Å; E280-G282 PolarHBondContact O-N 3.11Å; G282-L336 WeakPolarHBondContact O-CA 3.44Å; G282-V337 PolarHBondContact O-N 3.24Å
283	S	97.7	Very high	96.7	Very high	8 Å²	8	40.2 Å²	40.2	6%	0.056	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-74.8	158	176.2	73.3	0	0	0	0	111.8	Y285 D286 Y287 K333 I335	S283-Y285 PolarHBondContact O-N 3.41Å; S283-D286 WeakPolarHBondContact CB-OD2 3.44Å; S283-D286 PolarHBondContact N-OD2 3.47Å; S283-D286 PolarHBondContact O-N 3.24Å; S283-D286 PolarHBondContact OG-N 3.28Å; S283-D286 PolarHBondContact OG-OD2 3.49Å; S283-Y287 WeakPolarHBondContact O-CB 3.23Å; S283-Y287 PolarHBondContact O-N 2.76Å; S283-K333 WeakPolarHBondContact CB-O 3.18Å; S283-I335 CarbonylContact C-O 3.52Å; S283-I335 VanDerWaalsContact CA-O 3.23Å; S283-I335 WeakPolarHBondContact CA-O 3.5Å
284	L	98.7	Very high	96.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.2	-36.7	172.7	-179.4	68.4	0	0	0	110.5	Y287 L288 M301 I305 S332 I335 V337 V403 I407	L284-Y287 PolarHBondContact O-N 2.9Å; L284-L288 HydrophobicContact CD1-CD1 3.86Å; L284-L288 HydrophobicContact CD1-CD2 4.15Å; L284-L288 HydrophobicContact CD1-CG 3.76Å; L284-L288 HydrophobicContact CD2-CD1 4.34Å; L284-L288 HydrophobicContact CG-CD1 3.76Å; L284-L288 HydrophobicContact CG-CG 4.03Å; L284-L288 VanDerWaalsContact O-CB 3.24Å; L284-L288 WeakPolarHBondContact O-CB 3.16Å; L284-L288 WeakPolarHBondContact O-CG 3.47Å; L284-L288 PolarHBondContact O-N 3.08Å; L284-M301 HydrophobicContact CD1-SD 4.09Å; L284-I305 HydrophobicContact CD2-CD1 3.95Å; L284-S332 WeakPolarHBondContact CB-O 3.08Å; L284-S332 PolarHBondContact N-O 3Å; L284-I335 HydrophobicContact CB-CB 4.14Å; L284-I335 HydrophobicContact CB-CG2 4.06Å; L284-I335 HydrophobicContact CD2-CD1 4.46Å; L284-I335 HydrophobicContact CD2-CG2 4.22Å; L284-I335 PolarHBondContact N-O 3.4Å; L284-V337 HydrophobicContact CB-CG2 4.19Å; L284-V337 HydrophobicContact CD1-CG2 3.99Å; L284-V403 HydrophobicContact CD2-CG1 3.67Å; L284-I407 HydrophobicContact CD2-CD1 4.09Å; L284-I407 HydrophobicContact CD2-CG1 4.05Å
285	Y	98.1	Very high	96.8	Very high	57 Å²	57	46.2 Å²	46.2	22%	0.224	22%	0.223	C	C	.	.	H	α-helix	trans	-55.5	-51.3	171.4	172.2	-87.6	0	0	0	111.8	S283 Q289 S332 K333 Y420	S283-Y285 PolarHBondContact O-N 3.41Å; Y285-Q289 VanDerWaalsContact CE1-NE2 3.32Å; Y285-Q289 WeakPolarHBondContact O-CG 3.45Å; Y285-Q289 PolarHBondContact O-N 3.04Å; Y285-Q289 PolarHBondContact OH-NE2 2.91Å; Y285-S332 PolarHBondContact N-O 3.36Å; Y285-K333 HydrophobicContact CD1-CD 4.45Å; Y285-K333 HydrophobicContact CD1-CG 3.99Å; Y285-K333 HydrophobicContact CD2-CG 3.99Å; Y285-K333 HydrophobicContact CG-CD 4.36Å; Y285-K333 HydrophobicContact CG-CG 3.59Å; Y285-Y420 AromaticContact CD2-CE1 3.98Å; Y285-Y420 HydrophobicContact CD2-CE1 3.98Å; Y285-Y420 AromaticContact CD2-CZ 3.65Å; Y285-Y420 WeakPolarHBondContact CD2-OH 3.3Å; Y285-Y420 AromaticContact CE2-CE1 3.69Å; Y285-Y420 HydrophobicContact CE2-CE1 3.69Å; Y285-Y420 AromaticContact CE2-CZ 3.84Å; Y285-Y420 WeakPolarHBondContact CE2-OH 3.46Å
286	D	96.9	Very high	96.8	Very high	57 Å²	57	48 Å²	48	31%	0.305	24%	0.235	S	C	.	.	H	α-helix	trans	-67.3	-39.1	-178.6	-56.2	-49.9	0	0	0	111.5	S283 R290	S283-D286 WeakPolarHBondContact CB-OD2 3.44Å; S283-D286 PolarHBondContact N-OD2 3.47Å; S283-D286 PolarHBondContact O-N 3.24Å; S283-D286 PolarHBondContact OG-N 3.28Å; S283-D286 PolarHBondContact OG-OD2 3.49Å; D286-R290 VanDerWaalsContact O-CZ 3.29Å; D286-R290 PolarHBondContact O-NE 2.86Å
287	Y	98.4	Very high	96.8	Very high	18 Å²	18	50.5 Å²	50.5	7%	0.071	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-51.1	179.8	-170.6	-90.2	0	0	0	111.6	N281 S283 L284 Q289 R290 V291 V293 M301 V337 L341	N281-Y287 HydrophobicContact CB-CD2 3.88Å; N281-Y287 HydrophobicContact CB-CE2 4.28Å; S283-Y287 WeakPolarHBondContact O-CB 3.23Å; S283-Y287 PolarHBondContact O-N 2.76Å; L284-Y287 PolarHBondContact O-N 2.9Å; Y287-Q289 PolarHBondContact O-N 3.39Å; Y287-R290 PolarHBondContact O-N 3.37Å; Y287-V291 HydrophobicContact CD1-CB 4.21Å; Y287-V291 HydrophobicContact CE1-CB 3.77Å; Y287-V291 HydrophobicContact CE1-CG1 3.84Å; Y287-V291 HydrophobicContact CE1-CG2 4.39Å; Y287-V291 HydrophobicContact CE2-CB 4.48Å; Y287-V291 HydrophobicContact CE2-CG2 4.22Å; Y287-V291 PolarHBondContact O-N 3.26Å; Y287-V293 HydrophobicContact CE1-CG1 3.74Å; Y287-M301 HydrophobicContact CD1-CE 4.14Å; Y287-M301 HydrophobicContact CE1-CE 3.65Å; Y287-V337 HydrophobicContact CD2-CB 4.41Å; Y287-V337 HydrophobicContact CD2-CG1 4.13Å; Y287-V337 HydrophobicContact CE2-CG1 4.3Å; Y287-V337 HydrophobicContact CG-CB 4.43Å; Y287-V337 HydrophobicContact CG-CG1 4.33Å; Y287-V337 HydrophobicContact CG-CG2 4.04Å; Y287-L341 HydrophobicContact CE2-CD2 4.07Å; Y287-L341 WeakPolarHBondContact OH-CD2 3.47Å
288	L	98.5	Very high	96.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-23.3	-177.6	-70.9	-174.1	0	0	0	113.3	L284 E406 I407 R410 Y420	L284-L288 HydrophobicContact CD1-CD1 3.86Å; L284-L288 HydrophobicContact CD1-CD2 4.15Å; L284-L288 HydrophobicContact CD1-CG 3.76Å; L284-L288 HydrophobicContact CD2-CD1 4.34Å; L284-L288 HydrophobicContact CG-CD1 3.76Å; L284-L288 HydrophobicContact CG-CG 4.03Å; L284-L288 VanDerWaalsContact O-CB 3.24Å; L284-L288 WeakPolarHBondContact O-CB 3.16Å; L284-L288 WeakPolarHBondContact O-CG 3.47Å; L284-L288 PolarHBondContact O-N 3.08Å; L288-E406 HydrophobicContact CD1-CB 4.21Å; L288-I407 HydrophobicContact CD1-CG1 4.12Å; L288-R410 HydrophobicContact CB-CG 4.04Å; L288-R410 HydrophobicContact CD2-CB 3.85Å; L288-R410 HydrophobicContact CD2-CG 4.28Å; L288-R410 WeakPolarHBondContact O-CD 3.29Å; L288-R410 PolarHBondContact O-NE 3.01Å; L288-Y420 HydrophobicContact CB-CD2 3.77Å; L288-Y420 HydrophobicContact CB-CE2 4.15Å
289	Q	97.5	Very high	96.9	Very high	89 Å²	89	43.6 Å²	43.6	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-68.6	-35.1	171.3	-78.8	-172.5	1	0	0	113.5	Y285 Y287 Y420	Y285-Q289 VanDerWaalsContact CE1-NE2 3.32Å; Y285-Q289 WeakPolarHBondContact O-CG 3.45Å; Y285-Q289 PolarHBondContact O-N 3.04Å; Y285-Q289 PolarHBondContact OH-NE2 2.91Å; Y287-Q289 PolarHBondContact O-N 3.39Å; Q289-Y420 HydrophobicContact CG-CD1 3.33Å; Q289-Y420 HydrophobicContact CG-CD2 4.34Å; Q289-Y420 HydrophobicContact CG-CE1 3.87Å; Q289-Y420 HydrophobicContact CG-CG 3.62Å; Q289-Y420 VanDerWaalsContact NE2-CE1 3.35Å
290	R	96.9	Very high	97	Very high	156 Å²	156	42.9 Å²	42.9	59%	0.589	22%	0.216	S	C	*	.	H	α-helix	trans	-94.3	-36.2	-174.8	-63.5	-178.4	-64.5	-115	0	112.2	N281 D286 Y287	N281-R290 PolarHBondContact O-NH2 2.99Å; D286-R290 VanDerWaalsContact O-CZ 3.29Å; D286-R290 PolarHBondContact O-NE 2.86Å; Y287-R290 PolarHBondContact O-N 3.37Å
291	V	96.4	Very high	97.2	Very high	50 Å²	50	36.2 Å²	36.2	30%	0.303	19%	0.185	S	C	.	.			trans	-120.6	131.6	-166.9	-176.1	0	0	0	0	109.7	Y287 V293 R410	Y287-V291 HydrophobicContact CD1-CB 4.21Å; Y287-V291 HydrophobicContact CE1-CB 3.77Å; Y287-V291 HydrophobicContact CE1-CG1 3.84Å; Y287-V291 HydrophobicContact CE1-CG2 4.39Å; Y287-V291 HydrophobicContact CE2-CB 4.48Å; Y287-V291 HydrophobicContact CE2-CG2 4.22Å; Y287-V291 PolarHBondContact O-N 3.26Å; V291-V293 HydrophobicContact CG1-CG1 4.5Å; V291-R410 VanDerWaalsContact C-NH2 3.3Å; V291-R410 PolarHBondContact O-NH2 3.39Å
292	A	97	Very high	97.3	Very high	20 Å²	20	34.5 Å²	34.5	17%	0.165	18%	0.176	C	C	.	.			trans	-89.3	141.4	161.6	0	0	0	0	0	107.3	R410 Y412 V417	A292-R410 CarbonylContact C-O 3.22Å; A292-R410 WeakPolarHBondContact CA-O 3.39Å; A292-R410 VanDerWaalsContact N-NH2 3.11Å; A292-Y412 HydrophobicContact CB-CD2 4.04Å; A292-Y412 HydrophobicContact CB-CE1 4.43Å; A292-Y412 HydrophobicContact CB-CE2 3.35Å; A292-V417 HydrophobicContact CB-CB 4.48Å; A292-V417 HydrophobicContact CB-CG1 4.11Å; A292-V417 HydrophobicContact CB-CG2 4.01Å
293	V	96.7	Very high	97.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-110	149.7	-173.9	-62.4	0	0	0	0	111.2	Y287 V291 E297 M301 R410 T411 Y412	Y287-V293 HydrophobicContact CE1-CG1 3.74Å; V291-V293 HydrophobicContact CG1-CG1 4.5Å; V293-E297 HydrophobicContact CB-CB 4.2Å; V293-M301 HydrophobicContact CG1-CE 4.1Å; V293-M301 HydrophobicContact CG1-SD 4.31Å; V293-R410 PolarHBondContact N-O 3.38Å; V293-T411 VanDerWaalsContact O-CA 3.32Å; V293-T411 WeakPolarHBondContact O-CA 3.29Å; V293-Y412 PolarHBondContact O-N 3.45Å
294	E	96.3	Very high	97.4	Very high	103 Å²	103	33.9 Å²	33.9	48%	0.481	17%	0.169	S	C	.	.			trans	-69.7	158.9	170.2	-69	-58.9	150.9	0	0	111	S296 E297 G298	E294-S296 VanDerWaalsContact C-N 3.3Å; E294-S296 PolarHBondContact O-N 2.97Å; E294-E297 HydrophobicContact CB-CG 4.22Å; E294-E297 PolarHBondContact N-OE2 3.12Å; E294-E297 PolarHBondContact O-N 3.21Å; E294-E297 VanDerWaalsContact O-N 3.09Å; E294-G298 PolarHBondContact O-N 3.27Å
295	T	95.4	Very high	97.4	Very high	24 Å²	24	33.9 Å²	33.9	15%	0.147	17%	0.169	C	C	.	.	H	α-helix	trans	-57	-42.3	-177.9	-53.9	0	0	0	0	112.9	L299 T411 Y412 T459 L495	T295-L299 WeakPolarHBondContact O-CB 3Å; T295-L299 WeakPolarHBondContact O-CG 3.12Å; T295-L299 PolarHBondContact O-N 2.93Å; T295-L299 VanDerWaalsContact O-N 3.09Å; T295-T411 HydrophobicContact CG2-CG2 4.39Å; T295-Y412 PolarHBondContact OG1-O 3.4Å; T295-Y412 VanDerWaalsContact OG1-O 3.1Å; T295-T459 HydrophobicContact CG2-CG2 3.5Å; T295-L495 HydrophobicContact CG2-CD1 4.28Å; T295-L495 HydrophobicContact CG2-CD2 3.91Å
296	S	94.9	Very high	97.5	Very high	38 Å²	38	31.1 Å²	31.1	27%	0.266	16%	0.158	S	C	.	.	H	α-helix	trans	-65.6	-38.6	177.3	47.1	0	0	0	0	112.5	E294 A300	E294-S296 VanDerWaalsContact C-N 3.3Å; E294-S296 PolarHBondContact O-N 2.97Å; S296-A300 WeakPolarHBondContact O-CB 3.32Å; S296-A300 PolarHBondContact O-N 3.12Å
297	E	96.3	Very high	97.6	Very high	62 Å²	62	29.6 Å²	29.6	29%	0.29	15%	0.15	S	C	.	.	H	α-helix	trans	-69.9	-45.9	179.1	-63.4	176.4	145.2	0	0	111.1	V293 E294 L299 A300 M301 L341	V293-E297 HydrophobicContact CB-CB 4.2Å; E294-E297 HydrophobicContact CB-CG 4.22Å; E294-E297 PolarHBondContact N-OE2 3.12Å; E294-E297 PolarHBondContact O-N 3.21Å; E294-E297 VanDerWaalsContact O-N 3.09Å; E297-L299 VanDerWaalsContact C-N 3.3Å; E297-L299 PolarHBondContact O-N 3.1Å; E297-A300 WeakPolarHBondContact O-CB 3.41Å; E297-A300 PolarHBondContact O-N 3.15Å; E297-A300 VanDerWaalsContact O-N 3.07Å; E297-M301 WeakPolarHBondContact O-CG 3.24Å; E297-M301 PolarHBondContact O-N 3.15Å; E297-L341 WeakPolarHBondContact OE1-CD1 3.4Å
298	G	97.6	Very high	97.6	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-40.8	176	0	0	0	0	0	112.3	E294 A302	E294-G298 PolarHBondContact O-N 3.27Å; G298-A302 WeakPolarHBondContact O-CB 3.04Å; G298-A302 PolarHBondContact O-N 3.3Å
299	L	97.6	Very high	97.6	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-40.7	172.7	-73.7	176.9	0	0	0	112.5	T295 E297 A302 A303 T459 L463 L488 I491 H492 L495	T295-L299 WeakPolarHBondContact O-CB 3Å; T295-L299 WeakPolarHBondContact O-CG 3.12Å; T295-L299 PolarHBondContact O-N 2.93Å; T295-L299 VanDerWaalsContact O-N 3.09Å; E297-L299 VanDerWaalsContact C-N 3.3Å; E297-L299 PolarHBondContact O-N 3.1Å; L299-A302 PolarHBondContact O-N 3.48Å; L299-A303 VanDerWaalsContact O-CB 3.26Å; L299-A303 WeakPolarHBondContact O-CB 3.37Å; L299-A303 PolarHBondContact O-N 3.22Å; L299-T459 HydrophobicContact CD1-CG2 3.79Å; L299-T459 HydrophobicContact CD2-CG2 4.07Å; L299-T459 HydrophobicContact CG-CG2 4.11Å; L299-L463 HydrophobicContact CD2-CD1 4.13Å; L299-L463 HydrophobicContact CD2-CD2 4.02Å; L299-L463 HydrophobicContact CD2-CG 4.28Å; L299-L488 HydrophobicContact CD2-CD2 4.29Å; L299-I491 HydrophobicContact CD1-CG2 4Å; L299-I491 HydrophobicContact CD2-CG2 3.85Å; L299-H492 HydrophobicContact CD1-CB 4.29Å; L299-L495 HydrophobicContact CD1-CD2 3.92Å
300	A	97.9	Very high	97.6	Very high	17 Å²	17	25.6 Å²	25.6	14%	0.14	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-40.6	178	0	0	0	0	0	112	S296 E297 A303 S304	S296-A300 WeakPolarHBondContact O-CB 3.32Å; S296-A300 PolarHBondContact O-N 3.12Å; E297-A300 WeakPolarHBondContact O-CB 3.41Å; E297-A300 PolarHBondContact O-N 3.15Å; E297-A300 VanDerWaalsContact O-N 3.07Å; A300-A303 PolarHBondContact O-N 3.37Å; A300-S304 WeakPolarHBondContact O-CB 3.46Å; A300-S304 PolarHBondContact O-N 3.15Å; A300-S304 PolarHBondContact O-OG 3.13Å; A300-S304 VanDerWaalsContact O-OG 3.1Å
301	M	98.7	Very high	97.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.2	-52.9	171.6	-70.6	-177.9	-177.2	0	0	110.6	L284 Y287 V293 E297 A303 S304 I305 V337 L341 I407	L284-M301 HydrophobicContact CD1-SD 4.09Å; Y287-M301 HydrophobicContact CD1-CE 4.14Å; Y287-M301 HydrophobicContact CE1-CE 3.65Å; V293-M301 HydrophobicContact CG1-CE 4.1Å; V293-M301 HydrophobicContact CG1-SD 4.31Å; E297-M301 WeakPolarHBondContact O-CG 3.24Å; E297-M301 PolarHBondContact O-N 3.15Å; M301-A303 VanDerWaalsContact C-N 3.34Å; M301-A303 PolarHBondContact O-N 2.74Å; M301-S304 WeakPolarHBondContact CA-OG 3.32Å; M301-S304 PolarHBondContact O-N 3.49Å; M301-S304 PolarHBondContact O-OG 3.12Å; M301-I305 WeakPolarHBondContact O-CG1 3.43Å; M301-I305 PolarHBondContact O-N 3.14Å; M301-V337 HydrophobicContact CE-CG1 4.15Å; M301-L341 HydrophobicContact CE-CB 4.05Å; M301-L341 WeakPolarHBondContact CG-O 3.42Å; M301-I407 HydrophobicContact CB-CD1 4.49Å
302	A	98.7	Very high	97.8	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-56.6	-45.2	177.3	0	0	0	0	0	112.6	G298 L299 I305 A306 F400 L404 I407 L488	G298-A302 WeakPolarHBondContact O-CB 3.04Å; G298-A302 PolarHBondContact O-N 3.3Å; L299-A302 PolarHBondContact O-N 3.48Å; A302-I305 PolarHBondContact O-N 2.88Å; A302-A306 PolarHBondContact O-N 3.23Å; A302-F400 WeakPolarHBondContact O-CZ 3.41Å; A302-L404 HydrophobicContact CB-CD2 3.57Å; A302-I407 HydrophobicContact CB-CD1 4.26Å; A302-L488 HydrophobicContact CB-CD1 4.06Å; A302-L488 HydrophobicContact CB-CD2 4.09Å
303	A	98.5	Very high	97.9	Very high	14 Å²	14	17 Å²	17	12%	0.116	9%	0.093	C	C	.	.	H	α-helix	trans	-64.9	-41	179.6	0	0	0	0	0	112	L299 A300 M301 A306 N307 L488	L299-A303 VanDerWaalsContact O-CB 3.26Å; L299-A303 WeakPolarHBondContact O-CB 3.37Å; L299-A303 PolarHBondContact O-N 3.22Å; A300-A303 PolarHBondContact O-N 3.37Å; M301-A303 VanDerWaalsContact C-N 3.34Å; M301-A303 PolarHBondContact O-N 2.74Å; A303-A306 WeakPolarHBondContact O-CB 3.47Å; A303-A306 PolarHBondContact O-N 2.85Å; A303-N307 PolarHBondContact O-N 3.29Å; A303-L488 HydrophobicContact CB-CB 4.4Å
304	S	98.8	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.9	-39.8	176.4	63.5	0	0	0	0	112.7	N254 A300 M301 N307 G308 C343	N254-S304 WeakPolarHBondContact CB-O 3.45Å; N254-S304 WeakPolarHBondContact ND2-CB 3.24Å; N254-S304 PolarHBondContact OD1-O 3.4Å; A300-S304 WeakPolarHBondContact O-CB 3.46Å; A300-S304 PolarHBondContact O-N 3.15Å; A300-S304 PolarHBondContact O-OG 3.13Å; A300-S304 VanDerWaalsContact O-OG 3.1Å; M301-S304 WeakPolarHBondContact CA-OG 3.32Å; M301-S304 PolarHBondContact O-N 3.49Å; M301-S304 PolarHBondContact O-OG 3.12Å; S304-N307 PolarHBondContact O-N 3.43Å; S304-G308 PolarHBondContact O-N 3.46Å; S304-C343 WeakPolarHBondContact OG-CB 3.2Å; S304-C343 PolarHBondContact OG-N 3.33Å
305	I	98.9	Very high	97.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.3	-44.9	173	-58.9	160.1	0	0	0	110.2	L284 M301 A302 N307 G308 L309 I335 C343 F400 V403 I407	L284-I305 HydrophobicContact CD2-CD1 3.95Å; M301-I305 WeakPolarHBondContact O-CG1 3.43Å; M301-I305 PolarHBondContact O-N 3.14Å; A302-I305 PolarHBondContact O-N 2.88Å; I305-N307 VanDerWaalsContact C-N 3.32Å; I305-N307 PolarHBondContact O-N 3.35Å; I305-G308 PolarHBondContact O-N 3.12Å; I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 PolarHBondContact O-N 3.23Å; I305-I335 HydrophobicContact CD1-CD1 4.09Å; I305-I335 HydrophobicContact CD1-CG2 4.1Å; I305-I335 HydrophobicContact CG1-CD1 4.31Å; I305-I335 HydrophobicContact CG1-CG2 3.91Å; I305-I335 HydrophobicContact CG2-CD1 4Å; I305-C343 HydrophobicContact CD1-CB 4.23Å; I305-C343 HydrophobicContact CG1-CB 3.52Å; I305-F400 HydrophobicContact CB-CD2 4.5Å; I305-F400 HydrophobicContact CB-CE2 3.67Å; I305-F400 HydrophobicContact CB-CZ 4.07Å; I305-F400 HydrophobicContact CD1-CE2 4.29Å; I305-F400 HydrophobicContact CG2-CD2 3.69Å; I305-F400 HydrophobicContact CG2-CE2 3.35Å; I305-F400 HydrophobicContact CG2-CZ 4.01Å; I305-V403 HydrophobicContact CD1-CG1 4.08Å; I305-I407 HydrophobicContact CD1-CD1 3.77Å
306	A	98.8	Very high	97.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.6	-40.7	177.8	0	0	0	0	0	112	A302 A303 L309 V310 F400 I484 K485 L488	A302-A306 PolarHBondContact O-N 3.23Å; A303-A306 WeakPolarHBondContact O-CB 3.47Å; A303-A306 PolarHBondContact O-N 2.85Å; A306-L309 PolarHBondContact O-N 3.44Å; A306-V310 WeakPolarHBondContact O-CB 3.29Å; A306-V310 VanDerWaalsContact O-CG2 3.23Å; A306-V310 WeakPolarHBondContact O-CG2 3.18Å; A306-V310 PolarHBondContact O-N 3.49Å; A306-F400 HydrophobicContact CB-CE1 3.81Å; A306-F400 HydrophobicContact CB-CZ 3.91Å; A306-I484 HydrophobicContact CB-CG2 4.35Å; A306-K485 HydrophobicContact CB-CB 4.12Å; A306-L488 HydrophobicContact CB-CD1 3.94Å
307	N	98.8	Very high	97.6	Very high	25 Å²	25	23.1 Å²	23.1	13%	0.134	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-46.7	174.9	-76.3	-22.7	0	0	0	111.9	N254 A303 S304 I305 L309 V310 H311 K485	N254-N307 WeakPolarHBondContact OD1-CB 3.42Å; A303-N307 PolarHBondContact O-N 3.29Å; S304-N307 PolarHBondContact O-N 3.43Å; I305-N307 VanDerWaalsContact C-N 3.32Å; I305-N307 PolarHBondContact O-N 3.35Å; N307-L309 VanDerWaalsContact C-N 3.33Å; N307-L309 PolarHBondContact O-N 2.91Å; N307-V310 PolarHBondContact O-N 3.5Å; N307-H311 PolarHBondContact O-N 2.89Å; N307-K485 WeakPolarHBondContact OD1-CD 3.5Å; N307-K485 WeakPolarHBondContact OD1-CE 3.38Å; N307-K485 VanDerWaalsContact OD1-CG 3.32Å; N307-K485 WeakPolarHBondContact OD1-CG 3.5Å; N307-K485 PolarHBondContact OD1-NZ 3.36Å
308	G	98.8	Very high	96.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-44.6	175.2	0	0	0	0	0	111.9	S304 I305 H311 L312	S304-G308 PolarHBondContact O-N 3.46Å; I305-G308 PolarHBondContact O-N 3.12Å; G308-H311 WeakPolarHBondContact O-CB 3.15Å; G308-H311 PolarHBondContact O-N 3.4Å; G308-L312 PolarHBondContact O-N 2.87Å
309	L	98.8	Very high	96.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-38.3	-179.8	-165	63	0	0	0	112.4	I305 A306 N307 H311 L312 H313 L330 I345 D396 I397 F400 A481	I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 PolarHBondContact O-N 3.23Å; A306-L309 PolarHBondContact O-N 3.44Å; N307-L309 VanDerWaalsContact C-N 3.33Å; N307-L309 PolarHBondContact O-N 2.91Å; L309-H311 VanDerWaalsContact C-N 3.33Å; L309-L312 PolarHBondContact O-N 3.47Å; L309-H313 WeakPolarHBondContact CD1-NE2 3.44Å; L309-H313 VanDerWaalsContact O-CB 3.3Å; L309-H313 WeakPolarHBondContact O-CB 3.46Å; L309-H313 PolarHBondContact O-CD2 3.17Å; L309-H313 VanDerWaalsContact O-CG 3.25Å; L309-H313 PolarHBondContact O-N 3.29Å; L309-L330 HydrophobicContact CD1-CD2 4.32Å; L309-L330 HydrophobicContact CD2-CD2 4.19Å; L309-I345 HydrophobicContact CB-CD1 4.15Å; L309-I345 HydrophobicContact CD1-CD1 4.44Å; L309-D396 HydrophobicContact CD1-CB 4.06Å; L309-D396 HydrophobicContact CD2-CB 4.4Å; L309-I397 HydrophobicContact CD2-CD1 4.09Å; L309-F400 HydrophobicContact CD2-CB 4.22Å; L309-F400 HydrophobicContact CD2-CD1 4.15Å; L309-F400 HydrophobicContact CD2-CG 4.35Å; L309-A481 HydrophobicContact CB-CB 4.19Å; L309-A481 HydrophobicContact CD2-CB 4.13Å; L309-A481 HydrophobicContact CG-CB 4.01Å
310	V	98.8	Very high	95.3	Very high	22 Å²	22	36.7 Å²	36.7	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-47.5	170.9	168.2	0	0	0	0	110.6	A306 N307 L312 H313 T314 A481 L482 K485	A306-V310 WeakPolarHBondContact O-CB 3.29Å; A306-V310 VanDerWaalsContact O-CG2 3.23Å; A306-V310 WeakPolarHBondContact O-CG2 3.18Å; A306-V310 PolarHBondContact O-N 3.49Å; N307-V310 PolarHBondContact O-N 3.5Å; V310-L312 VanDerWaalsContact C-N 3.35Å; V310-L312 PolarHBondContact O-N 3.11Å; V310-H313 PolarHBondContact O-N 3.49Å; V310-T314 VanDerWaalsContact O-CB 3.26Å; V310-T314 WeakPolarHBondContact O-CB 3.34Å; V310-T314 PolarHBondContact O-N 3.14Å; V310-T314 PolarHBondContact O-OG1 3.02Å; V310-A481 HydrophobicContact CG2-CB 3.69Å; V310-A481 WeakPolarHBondContact CG2-O 3.04Å; V310-L482 HydrophobicContact CG1-CD1 4.37Å; V310-L482 VanDerWaalsContact CG2-CA 3.49Å; V310-L482 HydrophobicContact CG2-CB 4.16Å; V310-L482 VanDerWaalsContact CG2-N 3.33Å; V310-K485 HydrophobicContact CG2-CB 4.31Å
311	H	98.7	Very high	94.7	Very high	29 Å²	29	37.4 Å²	37.4	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-43.1	-180	-175.9	68.8	0	0	0	111.8	L249 L250 H252 N307 G308 L309 K322	L249-H311 PolarHBondContact O-CE1 2.8Å; L249-H311 VanDerWaalsContact O-CE1 3.26Å; L249-H311 PolarHBondContact O-NE2 3.3Å; L249-H311 VanDerWaalsContact O-NE2 3.12Å; L250-H311 PolarHBondContact O-CD2 3.35Å; L250-H311 PolarHBondContact O-NE2 3.04Å; H252-H311 HydrophobicContact CB-CB 4.49Å; H252-H311 VanDerWaalsContact CB-CD2 3.44Å; H252-H311 WeakPolarHBondContact CB-CD2 3.44Å; H252-H311 AromaticContact CD2-CG 3.84Å; H252-H311 AromaticContact CD2-ND1 3.92Å; H252-H311 AromaticContact CG-CD2 3.92Å; H252-H311 AromaticContact CG-CG 3.8Å; N307-H311 PolarHBondContact O-N 2.89Å; G308-H311 WeakPolarHBondContact O-CB 3.15Å; G308-H311 PolarHBondContact O-N 3.4Å; L309-H311 VanDerWaalsContact C-N 3.33Å; H311-K322 WeakPolarHBondContact O-CE 3.34Å; H311-K322 PolarHBondContact O-NZ 3.08Å
312	L	98.4	Very high	94.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-53.7	173.9	-70.4	175.3	0	0	0	111.3	L250 I255 G308 L309 V310 T314 K322 I325 I345 L348	L250-L312 HydrophobicContact CD1-CD2 3.74Å; I255-L312 HydrophobicContact CD1-CD1 3.85Å; I255-L312 HydrophobicContact CD1-CD2 3.89Å; I255-L312 HydrophobicContact CD1-CG 3.62Å; G308-L312 PolarHBondContact O-N 2.87Å; L309-L312 PolarHBondContact O-N 3.47Å; V310-L312 VanDerWaalsContact C-N 3.35Å; V310-L312 PolarHBondContact O-N 3.11Å; L312-T314 VanDerWaalsContact C-N 3.25Å; L312-T314 PolarHBondContact O-N 2.83Å; L312-K322 PolarHBondContact O-NZ 3.29Å; L312-I325 CarbonylContact C-O 3.42Å; L312-I325 VanDerWaalsContact C-O 3.22Å; L312-I325 HydrophobicContact CB-CB 4.34Å; L312-I325 HydrophobicContact CD2-CB 4.23Å; L312-I325 HydrophobicContact CD2-CD1 4.3Å; L312-I325 HydrophobicContact CD2-CG2 4.11Å; L312-I325 PolarHBondContact O-N 3.15Å; L312-I345 HydrophobicContact CD1-CD1 4.14Å; L312-I345 HydrophobicContact CD1-CG2 4.33Å; L312-L348 HydrophobicContact CD1-CD2 4.3Å; L312-L348 HydrophobicContact CD2-CD2 4.47Å
313	H	98.3	Very high	94.3	Very high	17 Å²	17	38.3 Å²	38.3	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-69	-19.4	-172.2	-74.3	-165.3	0	0	0	114.5	L309 V310 I325 K393 D396	L309-H313 WeakPolarHBondContact CD1-NE2 3.44Å; L309-H313 VanDerWaalsContact O-CB 3.3Å; L309-H313 WeakPolarHBondContact O-CB 3.46Å; L309-H313 PolarHBondContact O-CD2 3.17Å; L309-H313 VanDerWaalsContact O-CG 3.25Å; L309-H313 PolarHBondContact O-N 3.29Å; V310-H313 PolarHBondContact O-N 3.49Å; H313-I325 PolarHBondContact CD2-O 3.01Å; H313-I325 VanDerWaalsContact CD2-O 3.25Å; H313-I325 PolarHBondContact N-O 3.27Å; H313-K393 HydrophobicContact CB-CD 3.78Å; H313-K393 HydrophobicContact CB-CG 4.28Å; H313-K393 PolarHBondContact CE1-O 2.63Å; H313-D396 IonicContact CD2-OD2 2.63Å; H313-D396 IonicContact CE1-OD2 3.02Å; H313-D396 IonicContact NE2-OD2 3.85Å; H313-D396 PolarHBondContact NE2-OD2 2.91Å
314	T	97.2	Very high	94.2	Very high	68 Å²	68	37.9 Å²	37.9	42%	0.417	22%	0.22	S	C	.	.	S	Bend	trans	-91.1	128.5	-177	-55	0	0	0	0	110.3	V310 L312 K322	V310-T314 VanDerWaalsContact O-CB 3.26Å; V310-T314 WeakPolarHBondContact O-CB 3.34Å; V310-T314 PolarHBondContact O-N 3.14Å; V310-T314 PolarHBondContact O-OG1 3.02Å; L312-T314 VanDerWaalsContact C-N 3.25Å; L312-T314 PolarHBondContact O-N 2.83Å; T314-K322 WeakPolarHBondContact O-CE 3.32Å; T314-K322 PolarHBondContact O-NZ 3.21Å
315	E	95.2	Very high	94.1	Very high	24 Å²	24	37.9 Å²	37.9	11%	0.112	22%	0.22	C	C	.	.			trans	-76.3	137.5	167.9	-171.8	171.6	-173	0	0	109.8	F317 K322 A324 Q356	E315-F317 HydrophobicContact CG-CE1 4.39Å; E315-F317 HydrophobicContact CG-CZ 4.49Å; E315-K322 WeakPolarHBondContact CA-O 3.18Å; E315-K322 WeakPolarHBondContact CG-O 3.22Å; E315-A324 HydrophobicContact CB-CB 4.2Å; E315-Q356 PolarHBondContact OE1-N 2.99Å; E315-Q356 WeakPolarHBondContact OE2-CB 3.29Å; E315-Q356 WeakPolarHBondContact OE2-CG 3.43Å; E315-Q356 PolarHBondContact OE2-N 3.1Å; E315-Q356 PolarHBondContact OE2-NE2 3.47Å
316	I	93.8	Very high	94.1	Very high	53 Å²	53	37.9 Å²	37.9	27%	0.272	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-113.4	114.8	177	-55.1	173.9	0	0	0	107.7	L249 G321 K322	L249-I316 HydrophobicContact CB-CD1 4.25Å; L249-I316 HydrophobicContact CD1-CB 4.28Å; L249-I316 HydrophobicContact CD1-CG2 3.67Å; I316-G321 CarbonylContact O-C 3.54Å; I316-G321 WeakPolarHBondContact O-CA 3.3Å; I316-K322 HydrophobicContact CB-CB 3.87Å; I316-K322 HydrophobicContact CD1-CB 4.09Å; I316-K322 HydrophobicContact CD1-CD 4.14Å; I316-K322 HydrophobicContact CG1-CB 4.09Å; I316-K322 PolarHBondContact N-O 3.47Å; I316-K322 PolarHBondContact O-N 3.32Å
317	F	90.1	Very high	94	Very high	148 Å²	148	37.9 Å²	37.9	65%	0.649	22%	0.22	S	C	*	.			trans	-77.3	143.9	179.2	-57.4	-80.3	0	0	0	111.6	E315	E315-F317 HydrophobicContact CG-CE1 4.39Å; E315-F317 HydrophobicContact CG-CZ 4.49Å
318	G	82.8	Confident	93.9	Very high	58 Å²	58	37.9 Å²	37.9	60%	0.598	22%	0.218	S	C	*	.	S	Bend	trans	168.6	177.1	179.9	0	0	0	0	0	111.2	E320 G321	G318-E320 PolarHBondContact O-N 3.45Å; G318-G321 PolarHBondContact O-N 3Å
319	T	80	Confident	93.7	Very high	158 Å²	158	38.4 Å²	38.4	97%	0.969	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-37.6	174.9	47.1	0	0	0	0	112
320	E	80.4	Confident	93.7	Very high	137 Å²	137	38.4 Å²	38.4	64%	0.64	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.3	72.2	168.5	-62.3	-169.4	138.9	0	0	107.7	V248 G318	V248-E320 HydrophobicContact CB-CB 4.36Å; V248-E320 HydrophobicContact CG1-CB 3.98Å; V248-E320 HydrophobicContact CG2-CB 4.26Å; G318-E320 PolarHBondContact O-N 3.45Å
321	G	87.4	Confident	93.7	Very high	31 Å²	31	38.7 Å²	38.7	32%	0.32	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-66.8	164.3	-178.8	0	0	0	0	0	113.4	I316 G318	I316-G321 CarbonylContact O-C 3.54Å; I316-G321 WeakPolarHBondContact O-CA 3.3Å; G318-G321 PolarHBondContact O-N 3Å
322	K	93.8	Very high	93.7	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-96.6	122.4	170.1	-165.7	-169.2	69.9	63	0	109.3	T247 V248 L249 L250 H311 L312 T314 E315 I316	T247-K322 HydrophobicContact CG2-CG 3.91Å; V248-K322 WeakPolarHBondContact O-CB 3.44Å; V248-K322 WeakPolarHBondContact O-CG 3.4Å; L249-K322 HydrophobicContact CB-CB 4.21Å; L250-K322 HydrophobicContact CD1-CD 4.43Å; H311-K322 WeakPolarHBondContact O-CE 3.34Å; H311-K322 PolarHBondContact O-NZ 3.08Å; L312-K322 PolarHBondContact O-NZ 3.29Å; T314-K322 WeakPolarHBondContact O-CE 3.32Å; T314-K322 PolarHBondContact O-NZ 3.21Å; E315-K322 WeakPolarHBondContact CA-O 3.18Å; E315-K322 WeakPolarHBondContact CG-O 3.22Å; I316-K322 HydrophobicContact CB-CB 3.87Å; I316-K322 HydrophobicContact CD1-CB 4.09Å; I316-K322 HydrophobicContact CD1-CD 4.14Å; I316-K322 HydrophobicContact CG1-CB 4.09Å; I316-K322 PolarHBondContact N-O 3.47Å; I316-K322 PolarHBondContact O-N 3.32Å
323	P	94.8	Very high	93.6	Very high	20 Å²	20	42.7 Å²	42.7	13%	0.13	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-61	156.9	170	27.7	-35.4	0	0	0	110.9	T247 T353 H354	T247-P323 HydrophobicContact CG2-CG 4.04Å; P323-T353 HydrophobicContact CB-CG2 4.34Å; P323-T353 HydrophobicContact CG-CG2 3.91Å; P323-H354 WeakPolarHBondContact CA-O 3.35Å; P323-H354 WeakPolarHBondContact CB-O 3.44Å
324	A	96.4	Very high	93.6	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.033	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.5	165.8	0	0	0	0	0	109.2	E315 T353 H354 F389	E315-A324 HydrophobicContact CB-CB 4.2Å; A324-T353 CarbonylContact O-C 3.57Å; A324-T353 VanDerWaalsContact O-CA 3.28Å; A324-T353 WeakPolarHBondContact O-CA 3.35Å; A324-H354 PolarHBondContact N-O 2.67Å; A324-H354 PolarHBondContact O-N 3.05Å; A324-F389 VanDerWaalsContact C-CZ 3.47Å; A324-F389 HydrophobicContact CB-CD1 4.26Å; A324-F389 HydrophobicContact CB-CE1 3.42Å; A324-F389 VanDerWaalsContact CB-CE1 3.42Å; A324-F389 HydrophobicContact CB-CZ 3.77Å; A324-F389 WeakPolarHBondContact O-CZ 3.36Å
325	I	97.1	Very high	93.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.6	-175.5	-62	161.2	0	0	0	109.2	L250 L312 H313 A351 V352 T353	L250-I325 HydrophobicContact CD1-CD1 3.78Å; L312-I325 CarbonylContact C-O 3.42Å; L312-I325 VanDerWaalsContact C-O 3.22Å; L312-I325 HydrophobicContact CB-CB 4.34Å; L312-I325 HydrophobicContact CD2-CB 4.23Å; L312-I325 HydrophobicContact CD2-CD1 4.3Å; L312-I325 HydrophobicContact CD2-CG2 4.11Å; L312-I325 PolarHBondContact O-N 3.15Å; H313-I325 PolarHBondContact CD2-O 3.01Å; H313-I325 VanDerWaalsContact CD2-O 3.25Å; H313-I325 PolarHBondContact N-O 3.27Å; I325-A351 HydrophobicContact CG2-CB 3.83Å; I325-V352 WeakPolarHBondContact CA-O 3.42Å; I325-T353 HydrophobicContact CG1-CG2 3.83Å
326	A	97.4	Very high	93.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.6	168.1	0	0	0	0	0	109.9	A351 V352 F389 K393 D396	A326-A351 WeakPolarHBondContact O-CA 3.33Å; A326-A351 WeakPolarHBondContact O-CB 3.38Å; A326-V352 HydrophobicContact CB-CG2 3.92Å; A326-V352 PolarHBondContact N-O 3.18Å; A326-V352 PolarHBondContact O-N 3.16Å; A326-F389 HydrophobicContact CB-CE2 4.04Å; A326-F389 HydrophobicContact CB-CZ 4Å; A326-K393 HydrophobicContact CB-CG 4.43Å; A326-D396 WeakPolarHBondContact CA-OD2 3.4Å
327	H	97.4	Very high	94.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.			trans	-79.9	-43.4	-167.3	-174.6	-74	0	0	0	113.3	D329 L330 I345 A346 D347 L348 D396	H327-D329 PolarHBondContact CE1-O 3.14Å; H327-D329 VanDerWaalsContact CE1-O 3.27Å; H327-D329 PolarHBondContact ND1-N 3.45Å; H327-D329 VanDerWaalsContact ND1-N 3.17Å; H327-D329 PolarHBondContact O-N 3.37Å; H327-L330 PolarHBondContact ND1-N 2.78Å; H327-I345 WeakPolarHBondContact CD2-CG2 3.49Å; H327-I345 WeakPolarHBondContact NE2-CG2 3.42Å; H327-A346 PolarHBondContact NE2-O 3.29Å; H327-D347 PolarHBondContact CE1-O 2.84Å; H327-D347 PolarHBondContact NE2-O 3.36Å; H327-L348 VanDerWaalsContact CD2-CD2 3.48Å; H327-L348 WeakPolarHBondContact CD2-CD2 3.27Å; H327-D396 PolarHBondContact N-OD1 3.49Å; H327-D396 PolarHBondContact N-OD2 3.43Å
328	R	95.4	Very high	94.4	Very high	25 Å²	25	30.8 Å²	30.8	9%	0.094	18%	0.181	C	C	.	.	S	Bend	trans	67	-13.5	177	-58	177.1	61.4	-157.5	9.5	117.6	L350 V352 N366 P367 V369 Y392 D396	R328-L350 WeakPolarHBondContact CD-O 3.32Å; R328-V352 HydrophobicContact CG-CG2 4.35Å; R328-V352 VanDerWaalsContact NH1-CG1 3.3Å; R328-N366 PolarHBondContact NH2-O 2.64Å; R328-P367 PolarHBondContact NH2-O 3.42Å; R328-V369 VanDerWaalsContact CZ-CG2 3.4Å; R328-Y392 HydrophobicContact CG-CD1 4.12Å; R328-D396 PolarHBondContact N-OD1 3.2Å
329	D	96	Very high	95	Very high	11 Å²	11	35.3 Å²	35.3	6%	0.059	18%	0.184	C	C	.	.			trans	-131	41.7	170.7	-164.9	30.1	0	0	0	113.4	H327 K331 N334 L350 G370 T371	H327-D329 PolarHBondContact CE1-O 3.14Å; H327-D329 VanDerWaalsContact CE1-O 3.27Å; H327-D329 PolarHBondContact ND1-N 3.45Å; H327-D329 VanDerWaalsContact ND1-N 3.17Å; H327-D329 PolarHBondContact O-N 3.37Å; D329-K331 PolarHBondContact O-N 2.77Å; D329-K331 IonicContact OD1-NZ 2.67Å; D329-K331 PolarHBondContact OD1-NZ 3.14Å; D329-K331 IonicContact OD2-NZ 2.64Å; D329-K331 PolarHBondContact OD2-NZ 3.01Å; D329-N334 PolarHBondContact O-ND2 3.23Å; D329-N334 PolarHBondContact OD2-ND2 2.81Å; D329-L350 HydrophobicContact CB-CD1 3.85Å; D329-G370 VanDerWaalsContact OD1-CA 3.29Å; D329-G370 WeakPolarHBondContact OD1-CA 3.3Å; D329-T371 WeakPolarHBondContact OD1-CB 2.83Å; D329-T371 PolarHBondContact OD1-N 2.88Å; D329-T371 PolarHBondContact OD1-OG1 2.9Å
330	L	98.4	Very high	95.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.163	C	C	.	.			trans	-70	125.7	-179.6	-169.2	71.1	0	0	0	109.7	L309 H327 I335 I345 A399 F400	L309-L330 HydrophobicContact CD1-CD2 4.32Å; L309-L330 HydrophobicContact CD2-CD2 4.19Å; H327-L330 PolarHBondContact ND1-N 2.78Å; L330-I335 HydrophobicContact CD1-CD1 4.14Å; L330-I335 HydrophobicContact CD1-CG1 4.23Å; L330-I345 HydrophobicContact CD1-CD1 4.26Å; L330-I345 HydrophobicContact CD1-CG1 4.4Å; L330-I345 HydrophobicContact CD1-CG2 3.98Å; L330-A399 HydrophobicContact CB-CB 4.1Å; L330-A399 WeakPolarHBondContact O-CB 3.18Å; L330-F400 HydrophobicContact CD2-CB 3.76Å; L330-F400 HydrophobicContact CD2-CG 4.43Å
331	K	98.3	Very high	96.5	Very high	27 Å²	27	28.8 Å²	28.8	12%	0.117	14%	0.143	C	C	.	.			trans	-163.9	163.2	179.9	64.1	-161.5	-177.3	-150.1	0	109.8	D329 K333 N334 I335 T371 Y374	D329-K331 PolarHBondContact O-N 2.77Å; D329-K331 IonicContact OD1-NZ 2.67Å; D329-K331 PolarHBondContact OD1-NZ 3.14Å; D329-K331 IonicContact OD2-NZ 2.64Å; D329-K331 PolarHBondContact OD2-NZ 3.01Å; K331-K333 HydrophobicContact CG-CB 4.25Å; K331-K333 PolarHBondContact O-N 2.82Å; K331-K333 VanDerWaalsContact O-N 3.12Å; K331-N334 VanDerWaalsContact CE-CG 3.41Å; K331-N334 WeakPolarHBondContact CE-ND2 3.49Å; K331-N334 WeakPolarHBondContact CE-OD1 3.46Å; K331-N334 HydrophobicContact CG-CB 4.06Å; K331-N334 PolarHBondContact O-N 3.48Å; K331-I335 PolarHBondContact O-N 3.42Å; K331-T371 HydrophobicContact CD-CG2 4.19Å; K331-T371 WeakPolarHBondContact CD-OG1 3.11Å; K331-T371 WeakPolarHBondContact CE-OG1 3.26Å; K331-T371 PolarHBondContact NZ-OG1 3.4Å; K331-Y374 HydrophobicContact CB-CD1 3.95Å; K331-Y374 HydrophobicContact CB-CD2 3.8Å; K331-Y374 HydrophobicContact CB-CE1 3.9Å; K331-Y374 HydrophobicContact CB-CE2 3.75Å; K331-Y374 HydrophobicContact CB-CG 3.91Å
332	S	98.6	Very high	97	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.007	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-59.1	-26.5	-178.9	53.6	0	0	0	0	114.3	L284 Y285 Y374 E406	L284-S332 WeakPolarHBondContact CB-O 3.08Å; L284-S332 PolarHBondContact N-O 3Å; Y285-S332 PolarHBondContact N-O 3.36Å; S332-Y374 PolarHBondContact OG-OH 2.97Å; S332-E406 VanDerWaalsContact CB-OE2 3.26Å; S332-E406 WeakPolarHBondContact CB-OE2 3.49Å; S332-E406 PolarHBondContact OG-OE1 2.87Å; S332-E406 PolarHBondContact OG-OE2 3.47Å
333	K	97	Very high	97.3	Very high	112 Å²	112	32.3 Å²	32.3	49%	0.487	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-72.9	-22.7	173.2	-71.2	-172.9	175.6	-173.2	0	114.6	S283 Y285 K331	S283-K333 WeakPolarHBondContact CB-O 3.18Å; Y285-K333 HydrophobicContact CD1-CD 4.45Å; Y285-K333 HydrophobicContact CD1-CG 3.99Å; Y285-K333 HydrophobicContact CD2-CG 3.99Å; Y285-K333 HydrophobicContact CG-CD 4.36Å; Y285-K333 HydrophobicContact CG-CG 3.59Å; K331-K333 HydrophobicContact CG-CB 4.25Å; K331-K333 PolarHBondContact O-N 2.82Å; K331-K333 VanDerWaalsContact O-N 3.12Å
334	N	97.8	Very high	97.5	Very high	15 Å²	15	31.5 Å²	31.5	8%	0.08	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-102.4	16.4	-179.9	-71.6	8.6	0	0	0	111.8	D329 K331 A346 D347	D329-N334 PolarHBondContact O-ND2 3.23Å; D329-N334 PolarHBondContact OD2-ND2 2.81Å; K331-N334 VanDerWaalsContact CE-CG 3.41Å; K331-N334 WeakPolarHBondContact CE-ND2 3.49Å; K331-N334 WeakPolarHBondContact CE-OD1 3.46Å; K331-N334 HydrophobicContact CG-CB 4.06Å; K331-N334 PolarHBondContact O-N 3.48Å; N334-A346 PolarHBondContact O-N 2.96Å; N334-D347 HydrophobicContact CB-CB 4.18Å; N334-D347 WeakPolarHBondContact ND2-CB 3.48Å; N334-D347 PolarHBondContact ND2-OD2 2.99Å; N334-D347 PolarHBondContact OD1-OD2 3.33Å
335	I	98.8	Very high	97.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.8	174.2	-65.5	163.7	0	0	0	105.8	S283 L284 I305 L330 K331 C343 C344 V403	S283-I335 CarbonylContact C-O 3.52Å; S283-I335 VanDerWaalsContact CA-O 3.23Å; S283-I335 WeakPolarHBondContact CA-O 3.5Å; L284-I335 HydrophobicContact CB-CB 4.14Å; L284-I335 HydrophobicContact CB-CG2 4.06Å; L284-I335 HydrophobicContact CD2-CD1 4.46Å; L284-I335 HydrophobicContact CD2-CG2 4.22Å; L284-I335 PolarHBondContact N-O 3.4Å; I305-I335 HydrophobicContact CD1-CD1 4.09Å; I305-I335 HydrophobicContact CD1-CG2 4.1Å; I305-I335 HydrophobicContact CG1-CD1 4.31Å; I305-I335 HydrophobicContact CG1-CG2 3.91Å; I305-I335 HydrophobicContact CG2-CD1 4Å; L330-I335 HydrophobicContact CD1-CD1 4.14Å; L330-I335 HydrophobicContact CD1-CG1 4.23Å; K331-I335 PolarHBondContact O-N 3.42Å; I335-C343 HydrophobicContact CG2-CB 3.64Å; I335-C344 CarbonylContact C-O 3.42Å; I335-C344 WeakPolarHBondContact CA-O 3.43Å; I335-V403 HydrophobicContact CD1-CG1 3.88Å; I335-V403 HydrophobicContact CD1-CG2 4.21Å
336	L	98.5	Very high	97.5	Very high	33 Å²	33	31.7 Å²	31.7	17%	0.173	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.8	179.2	-58.1	177.5	0	0	0	110.3	L256 H279 G282 C343 C344 A346	L256-L336 HydrophobicContact CD1-CD1 3.8Å; L256-L336 HydrophobicContact CD2-CD1 3.96Å; L256-L336 HydrophobicContact CG-CD1 4.43Å; H279-L336 HydrophobicContact CB-CB 4.28Å; G282-L336 WeakPolarHBondContact O-CA 3.44Å; L336-C343 CarbonylContact O-C 3.55Å; L336-C343 WeakPolarHBondContact O-CA 3.39Å; L336-C344 PolarHBondContact N-O 3.5Å; L336-C344 PolarHBondContact O-N 3.04Å; L336-A346 HydrophobicContact CD1-CB 4.21Å; L336-A346 HydrophobicContact CG-CB 4.2Å
337	V	98.7	Very high	97.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.8	176.6	-177.3	0	0	0	0	109	N281 G282 L284 Y287 M301 L341 R342	N281-V337 HydrophobicContact CB-CB 3.79Å; N281-V337 HydrophobicContact CB-CG1 3.96Å; N281-V337 WeakPolarHBondContact CB-O 3.47Å; G282-V337 PolarHBondContact O-N 3.24Å; L284-V337 HydrophobicContact CB-CG2 4.19Å; L284-V337 HydrophobicContact CD1-CG2 3.99Å; Y287-V337 HydrophobicContact CD2-CB 4.41Å; Y287-V337 HydrophobicContact CD2-CG1 4.13Å; Y287-V337 HydrophobicContact CE2-CG1 4.3Å; Y287-V337 HydrophobicContact CG-CB 4.43Å; Y287-V337 HydrophobicContact CG-CG1 4.33Å; Y287-V337 HydrophobicContact CG-CG2 4.04Å; M301-V337 HydrophobicContact CE-CG1 4.15Å; V337-L341 HydrophobicContact CG1-CD2 4.34Å; V337-R342 CarbonylContact C-O 3.39Å; V337-R342 WeakPolarHBondContact CA-O 3.45Å
338	T	97.6	Very high	97.1	Very high	13 Å²	13	33.2 Å²	33.2	8%	0.08	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-78.7	171.7	178.4	79.4	0	0	0	0	111	N281 E340 L341 R342	N281-T338 PolarHBondContact ND2-O 3.46Å; T338-E340 WeakPolarHBondContact CB-OE2 3.4Å; T338-E340 PolarHBondContact O-N 3Å; T338-E340 PolarHBondContact OG1-N 3.25Å; T338-E340 PolarHBondContact OG1-OE2 3.39Å; T338-L341 PolarHBondContact O-N 3.36Å; T338-L341 VanDerWaalsContact O-N 3.14Å; T338-R342 PolarHBondContact N-O 2.85Å; T338-R342 PolarHBondContact OG1-N 2.93Å
339	K	95.5	Very high	96.8	Very high	152 Å²	152	32.2 Å²	32.2	66%	0.661	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.5	176.1	67.3	-176.2	-176.7	-179.2	0	112.5	L341	K339-L341 PolarHBondContact O-N 3.45Å
340	E	95.8	Very high	96.6	Very high	116 Å²	116	32.9 Å²	32.9	54%	0.542	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	12.2	174.3	-56.1	76.9	-166.7	0	0	113.3	T338 R342	T338-E340 WeakPolarHBondContact CB-OE2 3.4Å; T338-E340 PolarHBondContact O-N 3Å; T338-E340 PolarHBondContact OG1-N 3.25Å; T338-E340 PolarHBondContact OG1-OE2 3.39Å; E340-R342 HydrophobicContact CB-CG 4.45Å; E340-R342 PolarHBondContact O-N 3.46Å
341	L	96.6	Very high	96.4	Very high	42 Å²	42	33 Å²	33	22%	0.22	15%	0.153	C	C	.	.	S	Bend	trans	56.5	31.8	-178.4	-53.2	-176.9	0	0	0	113.3	Y287 E297 M301 V337 T338 K339	Y287-L341 HydrophobicContact CE2-CD2 4.07Å; Y287-L341 WeakPolarHBondContact OH-CD2 3.47Å; E297-L341 WeakPolarHBondContact OE1-CD1 3.4Å; M301-L341 HydrophobicContact CE-CB 4.05Å; M301-L341 WeakPolarHBondContact CG-O 3.42Å; V337-L341 HydrophobicContact CG1-CD2 4.34Å; T338-L341 PolarHBondContact O-N 3.36Å; T338-L341 VanDerWaalsContact O-N 3.14Å; K339-L341 PolarHBondContact O-N 3.45Å
342	R	98	Very high	96.1	Very high	107 Å²	107	31.7 Å²	31.7	40%	0.404	15%	0.148	S	C	.	.			trans	-100.5	175.2	165.9	-58.8	-51.7	-171	86.8	-3.1	109.7	V337 T338 E340	V337-R342 CarbonylContact C-O 3.39Å; V337-R342 WeakPolarHBondContact CA-O 3.45Å; T338-R342 PolarHBondContact N-O 2.85Å; T338-R342 PolarHBondContact OG1-N 2.93Å; E340-R342 HydrophobicContact CB-CG 4.45Å; E340-R342 PolarHBondContact O-N 3.46Å
343	C	98.8	Very high	95.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	150.2	-180	-63	0	0	0	0	112.3	N254 S304 I305 I335 L336	N254-C343 WeakPolarHBondContact CA-O 3.27Å; N254-C343 WeakPolarHBondContact CB-O 3.42Å; N254-C343 PolarHBondContact ND2-O 2.79Å; S304-C343 WeakPolarHBondContact OG-CB 3.2Å; S304-C343 PolarHBondContact OG-N 3.33Å; I305-C343 HydrophobicContact CD1-CB 4.23Å; I305-C343 HydrophobicContact CG1-CB 3.52Å; I335-C343 HydrophobicContact CG2-CB 3.64Å; L336-C343 CarbonylContact O-C 3.55Å; L336-C343 WeakPolarHBondContact O-CA 3.39Å
344	C	98.6	Very high	95.7	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145	166.3	67.1	0	0	0	0	110.9	N254 H279 I335 L336	N254-C344 CarbonylContact O-C 3.55Å; N254-C344 VanDerWaalsContact O-CA 3.29Å; N254-C344 WeakPolarHBondContact O-CA 3.02Å; H279-C344 PolarHBondContact NE2-SG 3.24Å; H279-C344 VanDerWaalsContact NE2-SG 3.41Å; I335-C344 CarbonylContact C-O 3.42Å; I335-C344 WeakPolarHBondContact CA-O 3.43Å; L336-C344 PolarHBondContact N-O 3.5Å; L336-C344 PolarHBondContact O-N 3.04Å
345	I	98.8	Very high	95.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135.3	-179.7	-56.1	173.7	0	0	0	109.3	N254 I255 L256 L309 L312 H327 L330	N254-I345 PolarHBondContact O-N 2.88Å; I255-I345 HydrophobicContact CD1-CB 4.03Å; I255-I345 HydrophobicContact CD1-CD1 4.34Å; I255-I345 HydrophobicContact CD1-CG1 4.49Å; L256-I345 WeakPolarHBondContact CB-O 3.04Å; L256-I345 PolarHBondContact N-O 3.39Å; L309-I345 HydrophobicContact CB-CD1 4.15Å; L309-I345 HydrophobicContact CD1-CD1 4.44Å; L312-I345 HydrophobicContact CD1-CD1 4.14Å; L312-I345 HydrophobicContact CD1-CG2 4.33Å; H327-I345 WeakPolarHBondContact CD2-CG2 3.49Å; H327-I345 WeakPolarHBondContact NE2-CG2 3.42Å; L330-I345 HydrophobicContact CD1-CD1 4.26Å; L330-I345 HydrophobicContact CD1-CG1 4.4Å; L330-I345 HydrophobicContact CD1-CG2 3.98Å
346	A	96.4	Very high	94.3	Very high	9 Å²	9	35.6 Å²	35.6	7%	0.074	17%	0.172	C	C	.	.			trans	-128.4	173.3	-177.8	0	0	0	0	0	111.4	L256 H327 N334 L336	L256-A346 HydrophobicContact CB-CB 4.05Å; L256-A346 HydrophobicContact CD2-CB 3.63Å; L256-A346 HydrophobicContact CG-CB 4.46Å; H327-A346 PolarHBondContact NE2-O 3.29Å; N334-A346 PolarHBondContact O-N 2.96Å; L336-A346 HydrophobicContact CD1-CB 4.21Å; L336-A346 HydrophobicContact CG-CB 4.2Å
347	D	93.1	Very high	93.3	Very high	31 Å²	31	38 Å²	38	17%	0.166	20%	0.197	C	C	.	.			trans	63.7	65.7	174.4	-164.9	24.6	0	0	0	113.7	K228 Y245 H327 N334 G349	K228-D347 IonicContact NZ-OD1 3.9Å; K228-D347 PolarHBondContact NZ-OD1 3.25Å; Y245-D347 PolarHBondContact OH-N 3.37Å; H327-D347 PolarHBondContact CE1-O 2.84Å; H327-D347 PolarHBondContact NE2-O 3.36Å; N334-D347 HydrophobicContact CB-CB 4.18Å; N334-D347 WeakPolarHBondContact ND2-CB 3.48Å; N334-D347 PolarHBondContact ND2-OD2 2.99Å; N334-D347 PolarHBondContact OD1-OD2 3.33Å; D347-G349 PolarHBondContact O-N 3.28Å
348	L	92.9	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.			trans	-85.4	12.5	-179	-57.8	177.6	0	0	0	113.5	I244 Y245 L250 I255 L312 H327 L350 A351	I244-L348 HydrophobicContact CB-CB 4.32Å; I244-L348 HydrophobicContact CG2-CB 3.78Å; I244-L348 HydrophobicContact CG2-CD1 3.7Å; I244-L348 HydrophobicContact CG2-CG 4.32Å; Y245-L348 HydrophobicContact CD1-CD1 3.99Å; Y245-L348 HydrophobicContact CE1-CD1 3.65Å; Y245-L348 HydrophobicContact CE1-CG 4.29Å; Y245-L348 HydrophobicContact CE2-CB 4.45Å; Y245-L348 HydrophobicContact CE2-CD1 4.45Å; Y245-L348 HydrophobicContact CE2-CG 4.46Å; L250-L348 HydrophobicContact CD2-CD1 4.08Å; I255-L348 HydrophobicContact CG2-CD1 4.49Å; L312-L348 HydrophobicContact CD1-CD2 4.3Å; L312-L348 HydrophobicContact CD2-CD2 4.47Å; H327-L348 VanDerWaalsContact CD2-CD2 3.48Å; H327-L348 WeakPolarHBondContact CD2-CD2 3.27Å; L348-L350 PolarHBondContact O-N 3.07Å; L348-L350 VanDerWaalsContact O-N 3.1Å; L348-A351 HydrophobicContact CB-CB 4.32Å; L348-A351 WeakPolarHBondContact O-CB 3.43Å; L348-A351 PolarHBondContact O-N 3.25Å
349	G	89.6	Confident	91.2	Very high	5 Å²	5	49.5 Å²	49.5	5%	0.052	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-12.6	-173.8	0	0	0	0	0	115.3	D347	D347-G349 PolarHBondContact O-N 3.28Å
350	L	90.7	Very high	90.3	Very high	25 Å²	25	47.7 Å²	47.7	13%	0.131	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	3.5	174.9	-68.5	177.4	0	0	0	113.5	Y212 R328 D329 L348 V369	Y212-L350 WeakPolarHBondContact OH-CD2 3.44Å; R328-L350 WeakPolarHBondContact CD-O 3.32Å; D329-L350 HydrophobicContact CB-CD1 3.85Å; L348-L350 PolarHBondContact O-N 3.07Å; L348-L350 VanDerWaalsContact O-N 3.1Å; L350-V369 HydrophobicContact CB-CG2 4.37Å; L350-V369 HydrophobicContact CD1-CB 4.03Å; L350-V369 HydrophobicContact CD1-CG2 4.09Å; L350-V369 HydrophobicContact CD2-CB 3.95Å; L350-V369 HydrophobicContact CD2-CG1 4.33Å; L350-V369 HydrophobicContact CD2-CG2 3.98Å; L350-V369 HydrophobicContact CG-CG2 4.38Å
351	A	93.4	Very high	89.7	Confident	2 Å²	2	44.2 Å²	44.2	2%	0.017	24%	0.24	C	C	.	.			trans	-67.3	149.5	-174.1	0	0	0	0	0	112.4	R240 I244 I325 A326 L348	R240-A351 PolarHBondContact NE-O 3.47Å; R240-A351 PolarHBondContact NH2-O 3.01Å; I244-A351 HydrophobicContact CD1-CB 4.29Å; I244-A351 HydrophobicContact CG1-CB 4.23Å; I244-A351 HydrophobicContact CG2-CB 4.37Å; I325-A351 HydrophobicContact CG2-CB 3.83Å; A326-A351 WeakPolarHBondContact O-CA 3.33Å; A326-A351 WeakPolarHBondContact O-CB 3.38Å; L348-A351 HydrophobicContact CB-CB 4.32Å; L348-A351 WeakPolarHBondContact O-CB 3.43Å; L348-A351 PolarHBondContact O-N 3.25Å
352	V	93.3	Very high	89	Confident	1 Å²	1	45 Å²	45	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.5	177.4	-62.4	0	0	0	0	109.2	I325 A326 R328 V363 F389 Y392	I325-V352 WeakPolarHBondContact CA-O 3.42Å; A326-V352 HydrophobicContact CB-CG2 3.92Å; A326-V352 PolarHBondContact N-O 3.18Å; A326-V352 PolarHBondContact O-N 3.16Å; R328-V352 HydrophobicContact CG-CG2 4.35Å; R328-V352 VanDerWaalsContact NH1-CG1 3.3Å; V352-V363 HydrophobicContact CB-CG2 3.99Å; V352-V363 HydrophobicContact CG1-CB 4.43Å; V352-V363 HydrophobicContact CG1-CG2 3.86Å; V352-V363 HydrophobicContact CG2-CG2 4.45Å; V352-F389 HydrophobicContact CG2-CE2 4.12Å; V352-Y392 HydrophobicContact CG2-CD1 4.36Å; V352-Y392 HydrophobicContact CG2-CD2 4.1Å; V352-Y392 HydrophobicContact CG2-CG 3.93Å
353	T	93.4	Very high	87.7	Confident	20 Å²	20	41.7 Å²	41.7	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.6	-175.2	45.8	0	0	0	0	110.7	I244 P323 A324 I325 D362	I244-T353 HydrophobicContact CD1-CG2 3.62Å; P323-T353 HydrophobicContact CB-CG2 4.34Å; P323-T353 HydrophobicContact CG-CG2 3.91Å; A324-T353 CarbonylContact O-C 3.57Å; A324-T353 VanDerWaalsContact O-CA 3.28Å; A324-T353 WeakPolarHBondContact O-CA 3.35Å; I325-T353 HydrophobicContact CG1-CG2 3.83Å; T353-D362 PolarHBondContact O-N 3.4Å; T353-D362 VanDerWaalsContact O-N 3.09Å
354	H	92.9	Very high	86	Confident	30 Å²	30	43.7 Å²	43.7	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132.7	172.6	175	-83	0	0	0	110.5	P323 A324 L360 F389	P323-H354 WeakPolarHBondContact CA-O 3.35Å; P323-H354 WeakPolarHBondContact CB-O 3.44Å; A324-H354 PolarHBondContact N-O 2.67Å; A324-H354 PolarHBondContact O-N 3.05Å; H354-L360 WeakPolarHBondContact CA-O 3.24Å; H354-F389 HydrophobicContact CB-CB 3.89Å; H354-F389 HydrophobicContact CB-CD1 3.83Å; H354-F389 HydrophobicContact CB-CD2 3.34Å; H354-F389 HydrophobicContact CB-CE1 4.2Å; H354-F389 HydrophobicContact CB-CE2 3.73Å; H354-F389 HydrophobicContact CB-CG 3.38Å; H354-F389 HydrophobicContact CB-CZ 4.16Å; H354-F389 AromaticContact CG-CG 3.84Å
355	T	87.1	Confident	84.1	Confident	45 Å²	45	52.1 Å²	52.1	28%	0.276	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.2	174.9	-52.6	0	0	0	0	109.1	A357 N359 L360	T355-A357 VanDerWaalsContact C-N 3.29Å; T355-A357 HydrophobicContact CG2-CB 4.06Å; T355-A357 PolarHBondContact O-N 3.06Å; T355-N359 WeakPolarHBondContact O-CA 3.35Å; T355-N359 PolarHBondContact O-N 2.97Å; T355-N359 VanDerWaalsContact O-N 3.08Å; T355-L360 PolarHBondContact N-O 2.92Å
356	Q	81.2	Confident	82.8	Confident	114 Å²	114	55.8 Å²	55.8	53%	0.533	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-31.6	-179.9	-83.2	172.4	56.3	0	0	112.9	E315 D358	E315-Q356 PolarHBondContact OE1-N 2.99Å; E315-Q356 WeakPolarHBondContact OE2-CB 3.29Å; E315-Q356 WeakPolarHBondContact OE2-CG 3.43Å; E315-Q356 PolarHBondContact OE2-N 3.1Å; E315-Q356 PolarHBondContact OE2-NE2 3.47Å; Q356-D358 VanDerWaalsContact C-N 3.32Å; Q356-D358 PolarHBondContact O-N 2.75Å
357	A	76.9	Confident	81.6	Confident	85 Å²	85	57.6 Å²	57.6	70%	0.702	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-41.1	-177.6	0	0	0	0	0	112.9	T355	T355-A357 VanDerWaalsContact C-N 3.29Å; T355-A357 HydrophobicContact CG2-CB 4.06Å; T355-A357 PolarHBondContact O-N 3.06Å
358	D	75.3	Confident	80.8	Confident	126 Å²	126	60 Å²	60	67%	0.674	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-3	-175.7	-56.7	-40.8	0	0	0	112.6	Q356 L360	Q356-D358 VanDerWaalsContact C-N 3.32Å; Q356-D358 PolarHBondContact O-N 2.75Å; D358-L360 HydrophobicContact CB-CB 4.07Å; D358-L360 PolarHBondContact O-N 3.36Å
359	N	76.7	Confident	80.4	Confident	128 Å²	128	60.9 Å²	60.9	68%	0.684	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	28.6	-168.3	-102.3	-10.7	0	0	0	112.7	T355 L361	T355-N359 WeakPolarHBondContact O-CA 3.35Å; T355-N359 PolarHBondContact O-N 2.97Å; T355-N359 VanDerWaalsContact O-N 3.08Å; N359-L361 PolarHBondContact O-N 3.16Å
360	L	77.1	Confident	80.3	Confident	113 Å²	113	61.2 Å²	61.2	59%	0.592	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	117.3	-176	-173.9	69	0	0	0	108.9	H354 T355 D358	H354-L360 WeakPolarHBondContact CA-O 3.24Å; T355-L360 PolarHBondContact N-O 2.92Å; D358-L360 HydrophobicContact CB-CB 4.07Å; D358-L360 PolarHBondContact O-N 3.36Å
361	L	83.4	Confident	80.5	Confident	44 Å²	44	62.3 Å²	62.3	23%	0.23	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	105.5	173.3	178.5	126.4	0	0	0	108.3	N359 V363 T386 F389 Y392	N359-L361 PolarHBondContact O-N 3.16Å; L361-V363 HydrophobicContact CD1-CG2 4.32Å; L361-V363 HydrophobicContact CD2-CB 3.72Å; L361-V363 HydrophobicContact CD2-CG2 3.19Å; L361-V363 HydrophobicContact CG-CG2 3.63Å; L361-V363 PolarHBondContact O-N 3.32Å; L361-T386 WeakPolarHBondContact CD2-O 3.44Å; L361-F389 HydrophobicContact CD1-CB 3.78Å; L361-F389 HydrophobicContact CD1-CD2 4.28Å; L361-Y392 HydrophobicContact CD1-CE2 4.29Å
362	D	80.6	Confident	80.7	Confident	58 Å²	58	65.8 Å²	65.8	31%	0.31	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	85.6	179.6	174.5	26.5	0	0	0	110	R240 T353	R240-D362 IonicContact CZ-OD2 3.94Å; R240-D362 VanDerWaalsContact CZ-OD2 3.26Å; R240-D362 IonicContact NH1-OD2 2.58Å; R240-D362 PolarHBondContact NH1-OD2 3.13Å; R240-D362 PolarHBondContact NH2-O 3.28Å; R240-D362 IonicContact NH2-OD2 3.73Å; R240-D362 PolarHBondContact NH2-OD2 3.16Å; T353-D362 PolarHBondContact O-N 3.4Å; T353-D362 VanDerWaalsContact O-N 3.09Å
363	V	70.6	Confident	80.9	Confident	38 Å²	38	66.5 Å²	66.5	23%	0.23	37%	0.374	C	S	.	.			trans	-108.2	113.2	176.5	170.8	0	0	0	0	108.6	V352 L361 Y392	V352-V363 HydrophobicContact CB-CG2 3.99Å; V352-V363 HydrophobicContact CG1-CB 4.43Å; V352-V363 HydrophobicContact CG1-CG2 3.86Å; V352-V363 HydrophobicContact CG2-CG2 4.45Å; L361-V363 HydrophobicContact CD1-CG2 4.32Å; L361-V363 HydrophobicContact CD2-CB 3.72Å; L361-V363 HydrophobicContact CD2-CG2 3.19Å; L361-V363 HydrophobicContact CG-CG2 3.63Å; L361-V363 PolarHBondContact O-N 3.32Å; V363-Y392 HydrophobicContact CG2-CE2 3.78Å
364	G	63.8	Low	81.2	Confident	42 Å²	42	66.4 Å²	66.4	43%	0.433	37%	0.372	S	S	.	.			trans	-58.1	166.4	169.2	0	0	0	0	0	112.4	N366	G364-N366 PolarHBondContact O-N 3.34Å
365	N	58.4	Low	81.4	Confident	178 Å²	178	65.6 Å²	65.6	95%	0.952	37%	0.368	S	S	*	.	S	Bend	trans	-63	3.2	-162.4	-64.9	1.1	0	0	0	118.8
366	N	72.2	Confident	81.9	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	36%	0.355	S	S	.	.			trans	-139.5	117.6	-176.2	-170.4	1.4	0	0	0	113.4	R328 G364 K368 V369	R328-N366 PolarHBondContact NH2-O 2.64Å; G364-N366 PolarHBondContact O-N 3.34Å; N366-K368 PolarHBondContact ND2-O 2.9Å; N366-K368 WeakPolarHBondContact OD1-CB 3.35Å; N366-K368 PolarHBondContact OD1-N 2.61Å; N366-V369 HydrophobicContact CB-CG1 4.04Å; N366-V369 WeakPolarHBondContact O-CG1 3.34Å
367	P	70.5	Confident	82.8	Confident	46 Å²	46	58 Å²	58	30%	0.299	33%	0.33	S	S	.	.	S	Bend	trans	-72.1	-28.3	173.7	28.1	-32.8	0	0	0	113.1	R328 V369 I384 T386	R328-P367 PolarHBondContact NH2-O 3.42Å; P367-V369 PolarHBondContact O-N 3.2Å; P367-V369 VanDerWaalsContact O-N 3.09Å; P367-I384 HydrophobicContact CB-CG2 4.4Å; P367-T386 HydrophobicContact CB-CG2 3.7Å; P367-T386 HydrophobicContact CG-CG2 4.15Å
368	K	76.4	Confident	83.7	Confident	83 Å²	83	54.3 Å²	54.3	36%	0.361	30%	0.298	S	S	.	.	S	Bend	trans	-86	68.6	-177.9	-60.1	177.8	-165.3	174	0	112.1	N366 E382 F434	N366-K368 PolarHBondContact ND2-O 2.9Å; N366-K368 WeakPolarHBondContact OD1-CB 3.35Å; N366-K368 PolarHBondContact OD1-N 2.61Å; K368-E382 WeakPolarHBondContact CE-OE1 3.21Å; K368-E382 WeakPolarHBondContact CE-OE2 3.18Å; K368-E382 IonicContact NZ-OE1 3.75Å; K368-E382 PolarHBondContact NZ-OE1 3.29Å; K368-E382 IonicContact NZ-OE2 3.79Å; K368-E382 PolarHBondContact NZ-OE2 3.47Å; K368-F434 HydrophobicContact CD-CZ 4.49Å
369	V	84.1	Confident	84.8	Confident	18 Å²	18	48.8 Å²	48.8	11%	0.109	27%	0.269	C	S	.	.			trans	-125.7	168	176.1	-57.3	0	0	0	0	110.6	R328 L350 N366 P367 M375	R328-V369 VanDerWaalsContact CZ-CG2 3.4Å; L350-V369 HydrophobicContact CB-CG2 4.37Å; L350-V369 HydrophobicContact CD1-CB 4.03Å; L350-V369 HydrophobicContact CD1-CG2 4.09Å; L350-V369 HydrophobicContact CD2-CB 3.95Å; L350-V369 HydrophobicContact CD2-CG1 4.33Å; L350-V369 HydrophobicContact CD2-CG2 3.98Å; L350-V369 HydrophobicContact CG-CG2 4.38Å; N366-V369 HydrophobicContact CB-CG1 4.04Å; N366-V369 WeakPolarHBondContact O-CG1 3.34Å; P367-V369 PolarHBondContact O-N 3.2Å; P367-V369 VanDerWaalsContact O-N 3.09Å; V369-M375 VanDerWaalsContact O-CE 3.24Å; V369-M375 WeakPolarHBondContact O-CE 3.28Å
370	G	89.3	Confident	85.7	Confident	12 Å²	12	42.7 Å²	42.7	12%	0.124	24%	0.236	C	C	.	.	S	Bend	trans	94.9	-175.6	-174.7	0	0	0	0	0	113.3	D329	D329-G370 VanDerWaalsContact OD1-CA 3.29Å; D329-G370 WeakPolarHBondContact OD1-CA 3.3Å
371	T	94.3	Very high	86.6	Confident	47 Å²	47	39.8 Å²	39.8	29%	0.288	22%	0.221	S	C	.	.			trans	-87.3	118.4	-173.4	-56	0	0	0	0	110.3	D329 K331 R373 Y374 M375	D329-T371 WeakPolarHBondContact OD1-CB 2.83Å; D329-T371 PolarHBondContact OD1-N 2.88Å; D329-T371 PolarHBondContact OD1-OG1 2.9Å; K331-T371 HydrophobicContact CD-CG2 4.19Å; K331-T371 WeakPolarHBondContact CD-OG1 3.11Å; K331-T371 WeakPolarHBondContact CE-OG1 3.26Å; K331-T371 PolarHBondContact NZ-OG1 3.4Å; T371-R373 VanDerWaalsContact C-N 3.26Å; T371-R373 PolarHBondContact O-N 3.24Å; T371-R373 VanDerWaalsContact O-N 3.09Å; T371-Y374 HydrophobicContact CG2-CD2 4Å; T371-Y374 PolarHBondContact O-N 3.22Å; T371-M375 PolarHBondContact O-N 3.49Å
372	K	96.8	Very high	87.1	Confident	76 Å²	76	43.1 Å²	43.1	33%	0.33	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-51.1	-41.6	-170.4	-48.3	-167.8	-155.3	78.1	0	113.9	Y374 M375 P432 F434 M437	K372-Y374 PolarHBondContact O-N 3.12Å; K372-Y374 VanDerWaalsContact O-N 3.16Å; K372-M375 HydrophobicContact CB-SD 4.4Å; K372-M375 WeakPolarHBondContact O-CB 3.34Å; K372-M375 PolarHBondContact O-N 3.18Å; K372-M375 VanDerWaalsContact O-N 3.14Å; K372-P432 WeakPolarHBondContact CD-O 3.19Å; K372-F434 HydrophobicContact CD-CB 4.18Å; K372-M437 HydrophobicContact CB-CG 4.27Å
373	R	98.3	Very high	87.8	Confident	15 Å²	15	44.8 Å²	44.8	6%	0.057	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-57.5	-27.5	178	-174.4	-179.8	-67.2	-74.5	-2.3	114.3	T371 P423 P429 N430 P432 M437	T371-R373 VanDerWaalsContact C-N 3.26Å; T371-R373 PolarHBondContact O-N 3.24Å; T371-R373 VanDerWaalsContact O-N 3.09Å; R373-P423 VanDerWaalsContact CD-O 3.23Å; R373-P423 WeakPolarHBondContact CD-O 3.48Å; R373-P423 WeakPolarHBondContact CG-O 3.49Å; R373-P423 PolarHBondContact NH1-O 3.02Å; R373-P429 PolarHBondContact NH2-O 3.49Å; R373-N430 PolarHBondContact NH2-O 3.34Å; R373-P432 HydrophobicContact CB-CG 4.15Å; R373-M437 WeakPolarHBondContact O-CE 3.28Å
374	Y	98.6	Very high	88.9	Confident	18 Å²	18	43.9 Å²	43.9	7%	0.071	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-104.7	-0.3	-177.5	-67.1	-97.8	0	0	0	113	K331 S332 T371 K372 A376 W398 L402 V403 E406 P423	K331-Y374 HydrophobicContact CB-CD1 3.95Å; K331-Y374 HydrophobicContact CB-CD2 3.8Å; K331-Y374 HydrophobicContact CB-CE1 3.9Å; K331-Y374 HydrophobicContact CB-CE2 3.75Å; K331-Y374 HydrophobicContact CB-CG 3.91Å; S332-Y374 PolarHBondContact OG-OH 2.97Å; T371-Y374 HydrophobicContact CG2-CD2 4Å; T371-Y374 PolarHBondContact O-N 3.22Å; K372-Y374 PolarHBondContact O-N 3.12Å; K372-Y374 VanDerWaalsContact O-N 3.16Å; Y374-A376 PolarHBondContact O-N 2.81Å; Y374-W398 VanDerWaalsContact O-CD1 3.26Å; Y374-L402 HydrophobicContact CD1-CB 4.07Å; Y374-L402 HydrophobicContact CD1-CD1 3.93Å; Y374-L402 HydrophobicContact CE1-CB 4.16Å; Y374-L402 HydrophobicContact CG-CD1 4.39Å; Y374-V403 HydrophobicContact CE1-CG2 4.24Å; Y374-E406 VanDerWaalsContact CE1-OE1 3.3Å; Y374-E406 WeakPolarHBondContact CE1-OE1 3.21Å; Y374-E406 VanDerWaalsContact OH-CD 3.29Å; Y374-E406 PolarHBondContact OH-OE1 2.73Å; Y374-E406 PolarHBondContact OH-OE2 2.89Å; Y374-P423 HydrophobicContact CE1-CG 3.9Å; Y374-P423 WeakPolarHBondContact OH-CD 3.32Å
375	M	98.2	Very high	90.2	Very high	13 Å²	13	47.6 Å²	47.6	6%	0.064	25%	0.248	C	C	.	.			trans	-65.1	136.6	-179.8	-74.1	177.7	168.1	0	0	110.9	V369 T371 K372 V379 L380 W398 F434	V369-M375 VanDerWaalsContact O-CE 3.24Å; V369-M375 WeakPolarHBondContact O-CE 3.28Å; T371-M375 PolarHBondContact O-N 3.49Å; K372-M375 HydrophobicContact CB-SD 4.4Å; K372-M375 WeakPolarHBondContact O-CB 3.34Å; K372-M375 PolarHBondContact O-N 3.18Å; K372-M375 VanDerWaalsContact O-N 3.14Å; M375-V379 HydrophobicContact CB-CB 4.37Å; M375-V379 HydrophobicContact CB-CG1 4.31Å; M375-V379 HydrophobicContact CE-CG1 4.44Å; M375-V379 HydrophobicContact CG-CG1 4.1Å; M375-V379 HydrophobicContact SD-CG1 4.08Å; M375-L380 HydrophobicContact CB-CD1 4.29Å; M375-L380 HydrophobicContact CB-CD2 3.8Å; M375-L380 HydrophobicContact CB-CG 3.76Å; M375-L380 HydrophobicContact SD-CD2 3.99Å; M375-W398 PolarHBondContact O-NE1 3.09Å; M375-W398 VanDerWaalsContact O-NE1 3.11Å; M375-F434 HydrophobicContact SD-CD2 4.08Å; M375-F434 HydrophobicContact SD-CE2 4.04Å
376	A	98.3	Very high	91.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.			trans	-70.9	156.2	174.4	0	0	0	0	0	111	Y374 E378 V379 L380 V395 W398	Y374-A376 PolarHBondContact O-N 2.81Å; A376-E378 VanDerWaalsContact C-N 3.28Å; A376-E378 VanDerWaalsContact CB-OE2 3.32Å; A376-E378 WeakPolarHBondContact CB-OE2 3.39Å; A376-E378 PolarHBondContact O-N 2.72Å; A376-V379 HydrophobicContact CB-CG2 4.37Å; A376-V379 WeakPolarHBondContact O-CB 3.02Å; A376-V379 PolarHBondContact O-N 3.38Å; A376-L380 PolarHBondContact O-N 2.67Å; A376-L380 VanDerWaalsContact O-N 3.12Å; A376-V395 HydrophobicContact CB-CB 4.38Å; A376-V395 HydrophobicContact CB-CG1 4.19Å; A376-V395 HydrophobicContact CB-CG2 4.12Å; A376-W398 VanDerWaalsContact CA-CD1 3.48Å; A376-W398 HydrophobicContact CB-CB 3.8Å; A376-W398 HydrophobicContact CB-CD2 4.15Å; A376-W398 HydrophobicContact CB-CG 3.64Å
377	P	98.3	Very high	92.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-54	-43.2	-177.8	-18.9	22.8	0	0	0	113.7	V379 L380 D381 W398 V441 C442	P377-V379 PolarHBondContact O-N 3.47Å; P377-L380 PolarHBondContact O-N 3.01Å; P377-D381 PolarHBondContact O-N 2.9Å; P377-D381 VanDerWaalsContact O-OD1 3.12Å; P377-W398 VanDerWaalsContact CD-CE3 3.44Å; P377-W398 VanDerWaalsContact CD-CZ3 3.44Å; P377-W398 HydrophobicContact CG-CE3 4.02Å; P377-W398 HydrophobicContact CG-CH2 3.69Å; P377-W398 HydrophobicContact CG-CZ2 4.28Å; P377-W398 HydrophobicContact CG-CZ3 3.51Å; P377-V441 HydrophobicContact CB-CG1 4.05Å; P377-V441 HydrophobicContact CG-CG1 3.67Å; P377-C442 PolarHBondContact O-SG 3.37Å; P377-C442 VanDerWaalsContact O-SG 3.4Å
378	E	97.7	Very high	93.5	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-20	179.5	68.4	-86.6	-152.4	0	0	113.8	A376 D381 E382 T383 I384 V395 P475 R478	A376-E378 VanDerWaalsContact C-N 3.28Å; A376-E378 VanDerWaalsContact CB-OE2 3.32Å; A376-E378 WeakPolarHBondContact CB-OE2 3.39Å; A376-E378 PolarHBondContact O-N 2.72Å; E378-D381 WeakPolarHBondContact CA-OD1 3.39Å; E378-E382 PolarHBondContact O-N 3.18Å; E378-T383 PolarHBondContact O-N 3.05Å; E378-I384 HydrophobicContact CB-CB 4.27Å; E378-I384 HydrophobicContact CG-CB 3.99Å; E378-I384 HydrophobicContact CG-CG1 4.23Å; E378-I384 WeakPolarHBondContact O-CB 3.42Å; E378-I384 PolarHBondContact O-N 3.16Å; E378-V395 HydrophobicContact CG-CG2 4.41Å; E378-P475 HydrophobicContact CB-CG 4.21Å; E378-P475 VanDerWaalsContact CD-CG 3.45Å; E378-P475 HydrophobicContact CG-CG 3.97Å; E378-P475 WeakPolarHBondContact OE1-CG 3.4Å; E378-R478 IonicContact OE1-CZ 2.68Å; E378-R478 IonicContact OE1-NH1 2.65Å; E378-R478 PolarHBondContact OE1-NH1 3.46Å; E378-R478 IonicContact OE1-NH2 2.71Å; E378-R478 PolarHBondContact OE1-NH2 2.95Å; E378-R478 IonicContact OE2-CZ 2.87Å; E378-R478 IonicContact OE2-NH1 2.83Å; E378-R478 PolarHBondContact OE2-NH1 2.91Å; E378-R478 IonicContact OE2-NH2 3.44Å; E378-R478 PolarHBondContact OE2-NH2 2.93Å
379	V	96.9	Very high	94.3	Very high	9 Å²	9	41 Å²	41	6%	0.055	22%	0.218	C	C	.	.	H	α-helix	trans	-84.3	-36.2	173	-179.5	0	0	0	0	110.2	M375 A376 P377 I384 V395	M375-V379 HydrophobicContact CB-CB 4.37Å; M375-V379 HydrophobicContact CB-CG1 4.31Å; M375-V379 HydrophobicContact CE-CG1 4.44Å; M375-V379 HydrophobicContact CG-CG1 4.1Å; M375-V379 HydrophobicContact SD-CG1 4.08Å; A376-V379 HydrophobicContact CB-CG2 4.37Å; A376-V379 WeakPolarHBondContact O-CB 3.02Å; A376-V379 PolarHBondContact O-N 3.38Å; P377-V379 PolarHBondContact O-N 3.47Å; V379-I384 HydrophobicContact CG2-CD1 4.01Å; V379-V395 HydrophobicContact CG2-CG1 4.04Å; V379-V395 HydrophobicContact CG2-CG2 3.6Å
380	L	97.1	Very high	94.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76.2	-32.1	-179.1	-70.5	169.4	0	0	0	113.3	M375 A376 P377 F434 M437 R438 V441	M375-L380 HydrophobicContact CB-CD1 4.29Å; M375-L380 HydrophobicContact CB-CD2 3.8Å; M375-L380 HydrophobicContact CB-CG 3.76Å; M375-L380 HydrophobicContact SD-CD2 3.99Å; A376-L380 PolarHBondContact O-N 2.67Å; A376-L380 VanDerWaalsContact O-N 3.12Å; P377-L380 PolarHBondContact O-N 3.01Å; L380-F434 VanDerWaalsContact CA-CZ 3.48Å; L380-F434 HydrophobicContact CD2-CD2 3.95Å; L380-F434 HydrophobicContact CD2-CE2 3.88Å; L380-F434 HydrophobicContact CD2-CZ 4.4Å; L380-F434 WeakPolarHBondContact O-CE1 3.13Å; L380-F434 WeakPolarHBondContact O-CZ 3.5Å; L380-M437 HydrophobicContact CD1-CB 3.96Å; L380-M437 HydrophobicContact CD2-CB 3.69Å; L380-R438 HydrophobicContact CB-CB 4.3Å; L380-R438 HydrophobicContact CB-CG 4.33Å; L380-R438 VanDerWaalsContact O-CD 3.27Å; L380-R438 WeakPolarHBondContact O-CD 3.25Å; L380-R438 WeakPolarHBondContact O-CG 3.49Å; L380-V441 HydrophobicContact CD1-CB 3.79Å; L380-V441 HydrophobicContact CD1-CG1 3.95Å; L380-V441 HydrophobicContact CD1-CG2 4.17Å
381	D	94.6	Very high	95.2	Very high	53 Å²	53	43.1 Å²	43.1	28%	0.283	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	1.8	175.8	66.6	17.5	0	0	0	113.3	P377 E378 T383	P377-D381 PolarHBondContact O-N 2.9Å; P377-D381 VanDerWaalsContact O-OD1 3.12Å; E378-D381 WeakPolarHBondContact CA-OD1 3.39Å; D381-T383 HydrophobicContact CB-CG2 4.41Å; D381-T383 PolarHBondContact O-N 3.27Å; D381-T383 VanDerWaalsContact OD1-CB 3.27Å; D381-T383 WeakPolarHBondContact OD1-CB 3.37Å; D381-T383 VanDerWaalsContact OD1-CG2 3.27Å; D381-T383 WeakPolarHBondContact OD1-CG2 3.27Å; D381-T383 PolarHBondContact OD1-N 3.18Å; D381-T383 PolarHBondContact OD1-OG1 3.22Å
382	E	93.6	Very high	95.3	Very high	113 Å²	113	41 Å²	41	53%	0.528	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	22.1	175.4	-38.7	-175.7	-175.2	0	0	114.1	K368 E378 F434	K368-E382 WeakPolarHBondContact CE-OE1 3.21Å; K368-E382 WeakPolarHBondContact CE-OE2 3.18Å; K368-E382 IonicContact NZ-OE1 3.75Å; K368-E382 PolarHBondContact NZ-OE1 3.29Å; K368-E382 IonicContact NZ-OE2 3.79Å; K368-E382 PolarHBondContact NZ-OE2 3.47Å; E378-E382 PolarHBondContact O-N 3.18Å; E382-F434 HydrophobicContact CG-CZ 4.48Å
383	T	95.3	Very high	95.4	Very high	93 Å²	93	39.7 Å²	39.7	57%	0.571	21%	0.209	S	C	*	.			trans	-92.8	1.3	178.9	65.1	0	0	0	0	114.2	E378 D381 Q385	E378-T383 PolarHBondContact O-N 3.05Å; D381-T383 HydrophobicContact CB-CG2 4.41Å; D381-T383 PolarHBondContact O-N 3.27Å; D381-T383 VanDerWaalsContact OD1-CB 3.27Å; D381-T383 WeakPolarHBondContact OD1-CB 3.37Å; D381-T383 VanDerWaalsContact OD1-CG2 3.27Å; D381-T383 WeakPolarHBondContact OD1-CG2 3.27Å; D381-T383 PolarHBondContact OD1-N 3.18Å; D381-T383 PolarHBondContact OD1-OG1 3.22Å; T383-Q385 PolarHBondContact O-N 3.39Å
384	I	94.5	Very high	95.4	Very high	19 Å²	19	42.1 Å²	42.1	10%	0.097	22%	0.218	C	C	.	.			trans	-57.5	131.9	177.7	-172.6	171.6	0	0	0	111.9	P367 E378 V379 T386 A391 Y392 V395	P367-I384 HydrophobicContact CB-CG2 4.4Å; E378-I384 HydrophobicContact CB-CB 4.27Å; E378-I384 HydrophobicContact CG-CB 3.99Å; E378-I384 HydrophobicContact CG-CG1 4.23Å; E378-I384 WeakPolarHBondContact O-CB 3.42Å; E378-I384 PolarHBondContact O-N 3.16Å; V379-I384 HydrophobicContact CG2-CD1 4.01Å; I384-T386 HydrophobicContact CG2-CG2 4.02Å; I384-T386 PolarHBondContact O-N 3.08Å; I384-A391 HydrophobicContact CD1-CB 4.36Å; I384-A391 HydrophobicContact CG1-CB 3.91Å; I384-Y392 HydrophobicContact CD1-CD1 4.11Å; I384-Y392 HydrophobicContact CD1-CE1 4.08Å; I384-V395 HydrophobicContact CD1-CG2 3.72Å
385	Q	92	Very high	95.4	Very high	121 Å²	121	41.9 Å²	41.9	57%	0.565	22%	0.218	S	C	*	.			trans	-76.4	91.1	174.1	-66.2	172.8	25.9	0	0	109.6	T383 D387 C388 A391	T383-Q385 PolarHBondContact O-N 3.39Å; Q385-D387 PolarHBondContact O-N 3.43Å; Q385-C388 HydrophobicContact CB-CB 3.89Å; Q385-C388 PolarHBondContact O-N 3.48Å; Q385-C388 VanDerWaalsContact O-N 3.11Å; Q385-A391 HydrophobicContact CB-CB 4.36Å; Q385-A391 WeakPolarHBondContact O-CB 3.27Å
386	T	89.9	Confident	95.4	Very high	62 Å²	62	41.3 Å²	41.3	38%	0.38	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.9	-171.9	52.9	0	0	0	0	114.3	L361 P367 I384 C388 Y392	L361-T386 WeakPolarHBondContact CD2-O 3.44Å; P367-T386 HydrophobicContact CB-CG2 3.7Å; P367-T386 HydrophobicContact CG-CG2 4.15Å; I384-T386 HydrophobicContact CG2-CG2 4.02Å; I384-T386 PolarHBondContact O-N 3.08Å; T386-C388 VanDerWaalsContact C-N 3.34Å; T386-Y392 VanDerWaalsContact CA-OH 3.3Å; T386-Y392 WeakPolarHBondContact CA-OH 3.17Å; T386-Y392 WeakPolarHBondContact CB-OH 3.46Å; T386-Y392 WeakPolarHBondContact O-CE2 3.3Å; T386-Y392 PolarHBondContact O-OH 3.05Å
387	D	88.5	Confident	95.4	Very high	133 Å²	133	41.4 Å²	41.4	71%	0.711	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-12	174.5	60	-30.5	0	0	0	113.1	Q385	Q385-D387 PolarHBondContact O-N 3.43Å
388	C	91.4	Very high	95.4	Very high	39 Å²	39	41.4 Å²	41.4	26%	0.264	22%	0.216	S	C	.	.			trans	-104.5	112.7	179.7	-174.5	0	0	0	0	111.2	Q385 T386 D390 A391	Q385-C388 HydrophobicContact CB-CB 3.89Å; Q385-C388 PolarHBondContact O-N 3.48Å; Q385-C388 VanDerWaalsContact O-N 3.11Å; T386-C388 VanDerWaalsContact C-N 3.34Å; C388-D390 PolarHBondContact O-N 3.39Å; C388-A391 HydrophobicContact CB-CB 4.34Å; C388-A391 VanDerWaalsContact O-CB 3.25Å; C388-A391 WeakPolarHBondContact O-CB 3.42Å; C388-A391 PolarHBondContact O-N 3.37Å
389	F	93.4	Very high	95.5	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-38.4	178.1	-176.4	-107.5	0	0	0	113.2	A324 A326 V352 H354 L361 A391 Y392 K393	A324-F389 VanDerWaalsContact C-CZ 3.47Å; A324-F389 HydrophobicContact CB-CD1 4.26Å; A324-F389 HydrophobicContact CB-CE1 3.42Å; A324-F389 VanDerWaalsContact CB-CE1 3.42Å; A324-F389 HydrophobicContact CB-CZ 3.77Å; A324-F389 WeakPolarHBondContact O-CZ 3.36Å; A326-F389 HydrophobicContact CB-CE2 4.04Å; A326-F389 HydrophobicContact CB-CZ 4Å; V352-F389 HydrophobicContact CG2-CE2 4.12Å; H354-F389 HydrophobicContact CB-CB 3.89Å; H354-F389 HydrophobicContact CB-CD1 3.83Å; H354-F389 HydrophobicContact CB-CD2 3.34Å; H354-F389 HydrophobicContact CB-CE1 4.2Å; H354-F389 HydrophobicContact CB-CE2 3.73Å; H354-F389 HydrophobicContact CB-CG 3.38Å; H354-F389 HydrophobicContact CB-CZ 4.16Å; H354-F389 AromaticContact CG-CG 3.84Å; L361-F389 HydrophobicContact CD1-CB 3.78Å; L361-F389 HydrophobicContact CD1-CD2 4.28Å; F389-A391 PolarHBondContact O-N 3.05Å; F389-A391 VanDerWaalsContact O-N 3.17Å; F389-Y392 PolarHBondContact O-N 3.01Å; F389-K393 HydrophobicContact CD1-CD 4.23Å; F389-K393 HydrophobicContact CD1-CG 4.32Å; F389-K393 HydrophobicContact CE1-CD 3.72Å; F389-K393 HydrophobicContact CE1-CG 3.78Å; F389-K393 HydrophobicContact CZ-CG 4.32Å; F389-K393 PolarHBondContact O-N 3.29Å
390	D	95.5	Very high	95.6	Very high	68 Å²	68	40.8 Å²	40.8	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-26.3	179.2	-84.8	9.6	0	0	0	113	C388 Y392 K393 R394	C388-D390 PolarHBondContact O-N 3.39Å; D390-Y392 VanDerWaalsContact C-N 3.35Å; D390-K393 PolarHBondContact O-N 3.02Å; D390-K393 WeakPolarHBondContact OD1-CE 3.46Å; D390-K393 IonicContact OD1-NZ 3.81Å; D390-K393 PolarHBondContact OD1-NZ 2.83Å; D390-R394 VanDerWaalsContact O-CD 3.31Å; D390-R394 WeakPolarHBondContact O-CD 3.25Å; D390-R394 VanDerWaalsContact O-CG 3.24Å; D390-R394 WeakPolarHBondContact O-CG 3.31Å; D390-R394 PolarHBondContact O-N 2.65Å; D390-R394 VanDerWaalsContact O-N 3.08Å
391	A	96	Very high	95.7	Very high	8 Å²	8	40.8 Å²	40.8	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-44.7	174.3	0	0	0	0	0	110.9	I384 Q385 C388 F389 K393 R394 V395	I384-A391 HydrophobicContact CD1-CB 4.36Å; I384-A391 HydrophobicContact CG1-CB 3.91Å; Q385-A391 HydrophobicContact CB-CB 4.36Å; Q385-A391 WeakPolarHBondContact O-CB 3.27Å; C388-A391 HydrophobicContact CB-CB 4.34Å; C388-A391 VanDerWaalsContact O-CB 3.25Å; C388-A391 WeakPolarHBondContact O-CB 3.42Å; C388-A391 PolarHBondContact O-N 3.37Å; F389-A391 PolarHBondContact O-N 3.05Å; F389-A391 VanDerWaalsContact O-N 3.17Å; A391-K393 PolarHBondContact O-N 2.95Å; A391-R394 PolarHBondContact O-N 2.87Å; A391-R394 VanDerWaalsContact O-N 3.16Å; A391-V395 WeakPolarHBondContact O-CG2 3.5Å; A391-V395 PolarHBondContact O-N 2.85Å
392	Y	96.6	Very high	95.9	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-37.9	178	-58.4	-75.5	0	0	0	112.6	R328 V352 L361 V363 I384 T386 F389 D390 R394 V395 D396	R328-Y392 HydrophobicContact CG-CD1 4.12Å; V352-Y392 HydrophobicContact CG2-CD1 4.36Å; V352-Y392 HydrophobicContact CG2-CD2 4.1Å; V352-Y392 HydrophobicContact CG2-CG 3.93Å; L361-Y392 HydrophobicContact CD1-CE2 4.29Å; V363-Y392 HydrophobicContact CG2-CE2 3.78Å; I384-Y392 HydrophobicContact CD1-CD1 4.11Å; I384-Y392 HydrophobicContact CD1-CE1 4.08Å; T386-Y392 VanDerWaalsContact CA-OH 3.3Å; T386-Y392 WeakPolarHBondContact CA-OH 3.17Å; T386-Y392 WeakPolarHBondContact CB-OH 3.46Å; T386-Y392 WeakPolarHBondContact O-CE2 3.3Å; T386-Y392 PolarHBondContact O-OH 3.05Å; F389-Y392 PolarHBondContact O-N 3.01Å; D390-Y392 VanDerWaalsContact C-N 3.35Å; Y392-R394 VanDerWaalsContact C-N 3.28Å; Y392-R394 PolarHBondContact O-N 2.88Å; Y392-V395 WeakPolarHBondContact O-CB 3.47Å; Y392-V395 PolarHBondContact O-N 3.42Å; Y392-D396 PolarHBondContact O-N 3.29Å; Y392-D396 VanDerWaalsContact O-N 3.14Å
393	K	98.1	Very high	96.1	Very high	49 Å²	49	32.9 Å²	32.9	21%	0.213	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-41.2	172.5	-72.8	-172.4	-69.8	-169.9	0	111.4	H313 A326 F389 D390 A391 V395 D396 I397	H313-K393 HydrophobicContact CB-CD 3.78Å; H313-K393 HydrophobicContact CB-CG 4.28Å; H313-K393 PolarHBondContact CE1-O 2.63Å; A326-K393 HydrophobicContact CB-CG 4.43Å; F389-K393 HydrophobicContact CD1-CD 4.23Å; F389-K393 HydrophobicContact CD1-CG 4.32Å; F389-K393 HydrophobicContact CE1-CD 3.72Å; F389-K393 HydrophobicContact CE1-CG 3.78Å; F389-K393 HydrophobicContact CZ-CG 4.32Å; F389-K393 PolarHBondContact O-N 3.29Å; D390-K393 PolarHBondContact O-N 3.02Å; D390-K393 WeakPolarHBondContact OD1-CE 3.46Å; D390-K393 IonicContact OD1-NZ 3.81Å; D390-K393 PolarHBondContact OD1-NZ 2.83Å; A391-K393 PolarHBondContact O-N 2.95Å; K393-V395 VanDerWaalsContact C-N 3.32Å; K393-V395 PolarHBondContact O-N 3.41Å; K393-D396 WeakPolarHBondContact O-CB 3.07Å; K393-D396 PolarHBondContact O-N 2.85Å; K393-I397 WeakPolarHBondContact O-CG1 3.45Å; K393-I397 PolarHBondContact O-N 3.39Å; K393-I397 VanDerWaalsContact O-N 3.14Å
394	R	98.6	Very high	96.3	Very high	66 Å²	66	28.6 Å²	28.6	25%	0.249	15%	0.148	C	C	.	.	H	α-helix	trans	-70.3	-27.8	179.2	-65.6	158.6	-173	-167	2.9	112.9	D390 A391 Y392 I397 W398 P475 S476 R478	D390-R394 VanDerWaalsContact O-CD 3.31Å; D390-R394 WeakPolarHBondContact O-CD 3.25Å; D390-R394 VanDerWaalsContact O-CG 3.24Å; D390-R394 WeakPolarHBondContact O-CG 3.31Å; D390-R394 PolarHBondContact O-N 2.65Å; D390-R394 VanDerWaalsContact O-N 3.08Å; A391-R394 PolarHBondContact O-N 2.87Å; A391-R394 VanDerWaalsContact O-N 3.16Å; Y392-R394 VanDerWaalsContact C-N 3.28Å; Y392-R394 PolarHBondContact O-N 2.88Å; R394-I397 PolarHBondContact O-N 2.89Å; R394-W398 PolarHBondContact O-N 2.58Å; R394-W398 VanDerWaalsContact O-N 3.16Å; R394-P475 HydrophobicContact CB-CB 4.02Å; R394-P475 WeakPolarHBondContact CD-O 3.48Å; R394-P475 HydrophobicContact CG-CB 4.48Å; R394-S476 VanDerWaalsContact NH1-CA 3.35Å; R394-S476 PolarHBondContact NH1-OG 3.08Å; R394-R478 PolarHBondContact O-NH1 2.96Å
395	V	98.3	Very high	96.5	Very high	12 Å²	12	27.7 Å²	27.7	7%	0.073	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-44.3	169.5	173.1	0	0	0	0	110.6	A376 E378 V379 I384 A391 Y392 K393 I397 W398 A399	A376-V395 HydrophobicContact CB-CB 4.38Å; A376-V395 HydrophobicContact CB-CG1 4.19Å; A376-V395 HydrophobicContact CB-CG2 4.12Å; E378-V395 HydrophobicContact CG-CG2 4.41Å; V379-V395 HydrophobicContact CG2-CG1 4.04Å; V379-V395 HydrophobicContact CG2-CG2 3.6Å; I384-V395 HydrophobicContact CD1-CG2 3.72Å; A391-V395 WeakPolarHBondContact O-CG2 3.5Å; A391-V395 PolarHBondContact O-N 2.85Å; Y392-V395 WeakPolarHBondContact O-CB 3.47Å; Y392-V395 PolarHBondContact O-N 3.42Å; K393-V395 VanDerWaalsContact C-N 3.32Å; K393-V395 PolarHBondContact O-N 3.41Å; V395-I397 VanDerWaalsContact C-N 3.28Å; V395-I397 PolarHBondContact O-N 3.42Å; V395-W398 WeakPolarHBondContact O-CB 3.28Å; V395-W398 PolarHBondContact O-N 3.33Å; V395-A399 PolarHBondContact O-N 2.9Å; V395-A399 VanDerWaalsContact O-N 3.15Å
396	D	98.7	Very high	96.8	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-37.4	176.2	-68.1	-22.4	0	0	0	112.1	L309 H313 A326 H327 R328 Y392 K393 A399 F400	L309-D396 HydrophobicContact CD1-CB 4.06Å; L309-D396 HydrophobicContact CD2-CB 4.4Å; H313-D396 IonicContact CD2-OD2 2.63Å; H313-D396 IonicContact CE1-OD2 3.02Å; H313-D396 IonicContact NE2-OD2 3.85Å; H313-D396 PolarHBondContact NE2-OD2 2.91Å; A326-D396 WeakPolarHBondContact CA-OD2 3.4Å; H327-D396 PolarHBondContact N-OD1 3.49Å; H327-D396 PolarHBondContact N-OD2 3.43Å; R328-D396 PolarHBondContact N-OD1 3.2Å; Y392-D396 PolarHBondContact O-N 3.29Å; Y392-D396 VanDerWaalsContact O-N 3.14Å; K393-D396 WeakPolarHBondContact O-CB 3.07Å; K393-D396 PolarHBondContact O-N 2.85Å; D396-A399 PolarHBondContact O-N 3.03Å; D396-F400 WeakPolarHBondContact O-CB 3.28Å; D396-F400 PolarHBondContact O-N 2.8Å
397	I	98.9	Very high	97.3	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.015	10%	0.099	C	C	.	.	H	α-helix	trans	-64.4	-41.7	177.9	-63.1	-66.5	0	0	0	111.6	L309 K393 R394 V395 A399 F400 G401 C470 R478 L479 A481 I484	L309-I397 HydrophobicContact CD2-CD1 4.09Å; K393-I397 WeakPolarHBondContact O-CG1 3.45Å; K393-I397 PolarHBondContact O-N 3.39Å; K393-I397 VanDerWaalsContact O-N 3.14Å; R394-I397 PolarHBondContact O-N 2.89Å; V395-I397 VanDerWaalsContact C-N 3.28Å; V395-I397 PolarHBondContact O-N 3.42Å; I397-A399 VanDerWaalsContact C-N 3.33Å; I397-A399 PolarHBondContact O-N 3.42Å; I397-F400 PolarHBondContact O-N 3.42Å; I397-G401 PolarHBondContact O-N 3.31Å; I397-C470 HydrophobicContact CG2-CB 4.04Å; I397-R478 HydrophobicContact CG2-CB 4.04Å; I397-L479 WeakPolarHBondContact CG1-O 3.39Å; I397-L479 WeakPolarHBondContact CG2-O 3.01Å; I397-A481 HydrophobicContact CD1-CB 3.98Å; I397-A481 VanDerWaalsContact CD1-N 3.31Å; I397-I484 HydrophobicContact CD1-CD1 3.72Å; I397-I484 HydrophobicContact CG2-CD1 4Å
398	W	98.8	Very high	97.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-55.8	-51.7	173	167.1	-85.2	0	0	0	110.8	Y374 M375 A376 P377 R394 V395 F400 G401 L402 F424 V441 R447 W471	Y374-W398 VanDerWaalsContact O-CD1 3.26Å; M375-W398 PolarHBondContact O-NE1 3.09Å; M375-W398 VanDerWaalsContact O-NE1 3.11Å; A376-W398 VanDerWaalsContact CA-CD1 3.48Å; A376-W398 HydrophobicContact CB-CB 3.8Å; A376-W398 HydrophobicContact CB-CD2 4.15Å; A376-W398 HydrophobicContact CB-CG 3.64Å; P377-W398 VanDerWaalsContact CD-CE3 3.44Å; P377-W398 VanDerWaalsContact CD-CZ3 3.44Å; P377-W398 HydrophobicContact CG-CE3 4.02Å; P377-W398 HydrophobicContact CG-CH2 3.69Å; P377-W398 HydrophobicContact CG-CZ2 4.28Å; P377-W398 HydrophobicContact CG-CZ3 3.51Å; R394-W398 PolarHBondContact O-N 2.58Å; R394-W398 VanDerWaalsContact O-N 3.16Å; V395-W398 WeakPolarHBondContact O-CB 3.28Å; V395-W398 PolarHBondContact O-N 3.33Å; W398-F400 VanDerWaalsContact C-N 3.31Å; W398-F400 PolarHBondContact O-N 2.71Å; W398-G401 PolarHBondContact O-N 2.58Å; W398-G401 VanDerWaalsContact O-N 3.14Å; W398-L402 PolarHBondContact O-N 3.01Å; W398-F424 HydrophobicContact CZ2-CZ 4.28Å; W398-V441 HydrophobicContact CH2-CG1 3.65Å; W398-V441 HydrophobicContact CZ2-CG1 3.6Å; W398-V441 HydrophobicContact CZ2-CG2 4.49Å; W398-R447 VanDerWaalsContact CH2-CZ 3.43Å; W398-W471 HydrophobicContact CD2-CB 4.39Å; W398-W471 VanDerWaalsContact CE3-CA 3.46Å; W398-W471 HydrophobicContact CE3-CB 3.76Å; W398-W471 HydrophobicContact CH2-CB 4.2Å; W398-W471 HydrophobicContact CZ3-CB 3.67Å; W398-W471 WeakPolarHBondContact CZ3-O 3.03Å
399	A	98.8	Very high	98	Very high	4 Å²	4	11.5 Å²	11.5	3%	0.033	6%	0.055	C	C	.	.	H	α-helix	trans	-63.2	-38.2	-179.2	0	0	0	0	0	112.1	L330 V395 D396 I397 G401 L402 V403	L330-A399 HydrophobicContact CB-CB 4.1Å; L330-A399 WeakPolarHBondContact O-CB 3.18Å; V395-A399 PolarHBondContact O-N 2.9Å; V395-A399 VanDerWaalsContact O-N 3.15Å; D396-A399 PolarHBondContact O-N 3.03Å; I397-A399 VanDerWaalsContact C-N 3.33Å; I397-A399 PolarHBondContact O-N 3.42Å; A399-G401 VanDerWaalsContact C-N 3.33Å; A399-G401 PolarHBondContact O-N 3.11Å; A399-L402 WeakPolarHBondContact O-CB 3.44Å; A399-L402 PolarHBondContact O-N 3.06Å; A399-L402 VanDerWaalsContact O-N 3.16Å; A399-V403 PolarHBondContact O-N 2.77Å; A399-V403 VanDerWaalsContact O-N 3.11Å
400	F	98.9	Very high	98.3	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.2	-37.9	175.1	-174.6	-146	0	0	0	112.1	A302 I305 A306 L309 L330 D396 I397 W398 L402 V403 L404 I484	A302-F400 WeakPolarHBondContact O-CZ 3.41Å; I305-F400 HydrophobicContact CB-CD2 4.5Å; I305-F400 HydrophobicContact CB-CE2 3.67Å; I305-F400 HydrophobicContact CB-CZ 4.07Å; I305-F400 HydrophobicContact CD1-CE2 4.29Å; I305-F400 HydrophobicContact CG2-CD2 3.69Å; I305-F400 HydrophobicContact CG2-CE2 3.35Å; I305-F400 HydrophobicContact CG2-CZ 4.01Å; A306-F400 HydrophobicContact CB-CE1 3.81Å; A306-F400 HydrophobicContact CB-CZ 3.91Å; L309-F400 HydrophobicContact CD2-CB 4.22Å; L309-F400 HydrophobicContact CD2-CD1 4.15Å; L309-F400 HydrophobicContact CD2-CG 4.35Å; L330-F400 HydrophobicContact CD2-CB 3.76Å; L330-F400 HydrophobicContact CD2-CG 4.43Å; D396-F400 WeakPolarHBondContact O-CB 3.28Å; D396-F400 PolarHBondContact O-N 2.8Å; I397-F400 PolarHBondContact O-N 3.42Å; W398-F400 VanDerWaalsContact C-N 3.31Å; W398-F400 PolarHBondContact O-N 2.71Å; F400-L402 PolarHBondContact O-N 2.98Å; F400-V403 HydrophobicContact CD2-CB 4.33Å; F400-V403 PolarHBondContact O-N 3.01Å; F400-V403 VanDerWaalsContact O-N 3.08Å; F400-L404 HydrophobicContact CD2-CG 4.23Å; F400-L404 HydrophobicContact CE1-CD1 4.41Å; F400-L404 HydrophobicContact CE2-CD2 3.82Å; F400-L404 HydrophobicContact CE2-CG 3.95Å; F400-L404 HydrophobicContact CZ-CD1 4.43Å; F400-L404 HydrophobicContact CZ-CD2 3.8Å; F400-L404 HydrophobicContact CZ-CG 4.11Å; F400-L404 WeakPolarHBondContact O-CG 3.45Å; F400-L404 PolarHBondContact O-N 3.17Å; F400-I484 HydrophobicContact CD1-CD1 3.93Å; F400-I484 HydrophobicContact CD1-CG2 4.26Å; F400-I484 HydrophobicContact CE1-CB 4.44Å; F400-I484 HydrophobicContact CE1-CD1 4.29Å; F400-I484 HydrophobicContact CE1-CG2 3.55Å; F400-I484 HydrophobicContact CZ-CG2 4.41Å
401	G	98.9	Very high	98.4	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-56.4	-37.9	172.4	0	0	0	0	0	113.2	I397 W398 A399 W405	I397-G401 PolarHBondContact O-N 3.31Å; W398-G401 PolarHBondContact O-N 2.58Å; W398-G401 VanDerWaalsContact O-N 3.14Å; A399-G401 VanDerWaalsContact C-N 3.33Å; A399-G401 PolarHBondContact O-N 3.11Å; G401-W405 PolarHBondContact O-N 3.05Å
402	L	98.9	Very high	98.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-69.5	-39.1	174.7	-56.8	178.2	0	0	0	112.1	Y374 W398 A399 F400 W405 E406 P423 F424 P448 W471	Y374-L402 HydrophobicContact CD1-CB 4.07Å; Y374-L402 HydrophobicContact CD1-CD1 3.93Å; Y374-L402 HydrophobicContact CE1-CB 4.16Å; Y374-L402 HydrophobicContact CG-CD1 4.39Å; W398-L402 PolarHBondContact O-N 3.01Å; A399-L402 WeakPolarHBondContact O-CB 3.44Å; A399-L402 PolarHBondContact O-N 3.06Å; A399-L402 VanDerWaalsContact O-N 3.16Å; F400-L402 PolarHBondContact O-N 2.98Å; L402-W405 WeakPolarHBondContact O-CB 3.3Å; L402-W405 PolarHBondContact O-N 3.19Å; L402-E406 PolarHBondContact O-N 3.09Å; L402-E406 VanDerWaalsContact O-N 3.12Å; L402-P423 HydrophobicContact CB-CB 4.18Å; L402-P423 HydrophobicContact CB-CG 3.84Å; L402-P423 HydrophobicContact CD1-CB 4.41Å; L402-P423 HydrophobicContact CD2-CB 4.23Å; L402-F424 HydrophobicContact CD1-CE2 4.02Å; L402-F424 HydrophobicContact CD2-CE2 3.86Å; L402-F424 HydrophobicContact CD2-CZ 4.19Å; L402-P448 HydrophobicContact CD2-CG 3.68Å; L402-W471 HydrophobicContact CD2-CE3 4.23Å
403	V	98.9	Very high	98.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-65.5	-39.1	175	174.5	0	0	0	0	111.4	L284 I305 I335 Y374 A399 F400 W405 E406 I407	L284-V403 HydrophobicContact CD2-CG1 3.67Å; I305-V403 HydrophobicContact CD1-CG1 4.08Å; I335-V403 HydrophobicContact CD1-CG1 3.88Å; I335-V403 HydrophobicContact CD1-CG2 4.21Å; Y374-V403 HydrophobicContact CE1-CG2 4.24Å; A399-V403 PolarHBondContact O-N 2.77Å; A399-V403 VanDerWaalsContact O-N 3.11Å; F400-V403 HydrophobicContact CD2-CB 4.33Å; F400-V403 PolarHBondContact O-N 3.01Å; F400-V403 VanDerWaalsContact O-N 3.08Å; V403-W405 PolarHBondContact O-N 3.24Å; V403-E406 WeakPolarHBondContact O-CB 3.28Å; V403-E406 PolarHBondContact O-N 3.43Å; V403-E406 VanDerWaalsContact O-N 3.13Å; V403-I407 HydrophobicContact CG1-CD1 4.21Å; V403-I407 WeakPolarHBondContact O-CG1 3.36Å; V403-I407 PolarHBondContact O-N 2.79Å
404	L	98.9	Very high	97.7	Very high	3 Å²	3	17 Å²	17	2%	0.016	8%	0.079	C	C	.	.	H	α-helix	trans	-58.7	-38.2	173.6	-71	175.9	0	0	0	111.6	A302 F400 I407 A408 L466 M467	A302-L404 HydrophobicContact CB-CD2 3.57Å; F400-L404 HydrophobicContact CD2-CG 4.23Å; F400-L404 HydrophobicContact CE1-CD1 4.41Å; F400-L404 HydrophobicContact CE2-CD2 3.82Å; F400-L404 HydrophobicContact CE2-CG 3.95Å; F400-L404 HydrophobicContact CZ-CD1 4.43Å; F400-L404 HydrophobicContact CZ-CD2 3.8Å; F400-L404 HydrophobicContact CZ-CG 4.11Å; F400-L404 WeakPolarHBondContact O-CG 3.45Å; F400-L404 PolarHBondContact O-N 3.17Å; L404-I407 PolarHBondContact O-N 3.39Å; L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.21Å; L404-L466 HydrophobicContact CD1-CD2 3.83Å; L404-L466 HydrophobicContact CD1-CG 4.09Å; L404-M467 HydrophobicContact CB-CE 4.13Å; L404-M467 HydrophobicContact CB-CG 3.9Å; L404-M467 VanDerWaalsContact O-CE 3.27Å; L404-M467 WeakPolarHBondContact O-CE 3.26Å
405	W	98.9	Very high	97.3	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.1	-41.5	174.6	179.4	92.3	0	0	0	112.3	G401 L402 V403 I407 A408 R409 R421 P423 Y425 P448 F449 W454 M467	G401-W405 PolarHBondContact O-N 3.05Å; L402-W405 WeakPolarHBondContact O-CB 3.3Å; L402-W405 PolarHBondContact O-N 3.19Å; V403-W405 PolarHBondContact O-N 3.24Å; W405-I407 PolarHBondContact O-N 3.48Å; W405-A408 PolarHBondContact O-N 2.86Å; W405-R409 HydrophobicContact CD2-CG 4.29Å; W405-R409 HydrophobicContact CE3-CG 4.48Å; W405-R409 VanDerWaalsContact CZ2-CD 3.4Å; W405-R409 HydrophobicContact CZ2-CG 4.36Å; W405-R409 WeakPolarHBondContact O-CG 3.45Å; W405-R409 PolarHBondContact O-N 3.4Å; W405-R409 VanDerWaalsContact O-N 3.12Å; W405-R421 HydrophobicContact CH2-CB 4.44Å; W405-R421 WeakPolarHBondContact CZ3-O 3.31Å; W405-P423 HydrophobicContact CE3-CG 4.41Å; W405-Y425 HydrophobicContact CH2-CD1 4.03Å; W405-Y425 HydrophobicContact CH2-CE1 4.13Å; W405-P448 HydrophobicContact CD2-CB 3.78Å; W405-P448 VanDerWaalsContact CE2-CB 3.48Å; W405-P448 HydrophobicContact CE3-CB 4.4Å; W405-P448 HydrophobicContact CG-CB 4Å; W405-P448 HydrophobicContact CH2-CB 4.46Å; W405-P448 HydrophobicContact CZ2-CB 3.84Å; W405-F449 PolarHBondContact NE1-O 3.42Å; W405-W454 AromaticContact CD1-CH2 3.77Å; W405-W454 AromaticContact CD1-CZ3 3.91Å; W405-W454 HydrophobicContact CG-CH2 4.36Å; W405-M467 HydrophobicContact CB-CE 4.47Å; W405-M467 HydrophobicContact CB-SD 3.75Å; W405-M467 HydrophobicContact CG-SD 4.4Å
406	E	98.8	Very high	97.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.7	-43.7	175	-67.7	177	-109.5	0	0	111.9	L288 S332 Y374 L402 V403 Y420 P423	L288-E406 HydrophobicContact CD1-CB 4.21Å; S332-E406 VanDerWaalsContact CB-OE2 3.26Å; S332-E406 WeakPolarHBondContact CB-OE2 3.49Å; S332-E406 PolarHBondContact OG-OE1 2.87Å; S332-E406 PolarHBondContact OG-OE2 3.47Å; Y374-E406 VanDerWaalsContact CE1-OE1 3.3Å; Y374-E406 WeakPolarHBondContact CE1-OE1 3.21Å; Y374-E406 VanDerWaalsContact OH-CD 3.29Å; Y374-E406 PolarHBondContact OH-OE1 2.73Å; Y374-E406 PolarHBondContact OH-OE2 2.89Å; L402-E406 PolarHBondContact O-N 3.09Å; L402-E406 VanDerWaalsContact O-N 3.12Å; V403-E406 WeakPolarHBondContact O-CB 3.28Å; V403-E406 PolarHBondContact O-N 3.43Å; V403-E406 VanDerWaalsContact O-N 3.13Å; E406-Y420 HydrophobicContact CB-CE2 4.42Å; E406-Y420 HydrophobicContact CG-CE2 4.45Å; E406-Y420 WeakPolarHBondContact OE2-CE2 3.32Å; E406-Y420 PolarHBondContact OE2-OH 2.97Å; E406-P423 HydrophobicContact CG-CG 3.98Å
407	I	98.7	Very high	97	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-52.6	176.5	-65.8	169.1	0	0	0	110	L284 L288 M301 A302 I305 V403 L404 W405 R409 R410 T411	L284-I407 HydrophobicContact CD2-CD1 4.09Å; L284-I407 HydrophobicContact CD2-CG1 4.05Å; L288-I407 HydrophobicContact CD1-CG1 4.12Å; M301-I407 HydrophobicContact CB-CD1 4.49Å; A302-I407 HydrophobicContact CB-CD1 4.26Å; I305-I407 HydrophobicContact CD1-CD1 3.77Å; V403-I407 HydrophobicContact CG1-CD1 4.21Å; V403-I407 WeakPolarHBondContact O-CG1 3.36Å; V403-I407 PolarHBondContact O-N 2.79Å; L404-I407 PolarHBondContact O-N 3.39Å; W405-I407 PolarHBondContact O-N 3.48Å; I407-R409 VanDerWaalsContact C-N 3.28Å; I407-R409 PolarHBondContact O-N 2.82Å; I407-R410 CarbonylContact O-C 3.51Å; I407-R410 WeakPolarHBondContact O-CA 3.33Å; I407-R410 PolarHBondContact O-N 2.85Å; I407-T411 PolarHBondContact O-N 3.4Å; I407-T411 PolarHBondContact O-OG1 2.86Å; I407-T411 VanDerWaalsContact O-OG1 3.09Å
408	A	98.3	Very high	96.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.5	-34	-175.5	0	0	0	0	0	113.5	L404 W405 R410 T411 W454 L460 L463 M467	L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.21Å; W405-A408 PolarHBondContact O-N 2.86Å; A408-R410 PolarHBondContact O-N 3.46Å; A408-T411 WeakPolarHBondContact O-CB 3.41Å; A408-T411 PolarHBondContact O-N 2.82Å; A408-W454 HydrophobicContact CB-CE3 4.41Å; A408-W454 HydrophobicContact CB-CH2 3.57Å; A408-W454 HydrophobicContact CB-CZ2 4.03Å; A408-W454 HydrophobicContact CB-CZ3 3.79Å; A408-L460 HydrophobicContact CB-CD2 4.19Å; A408-L463 HydrophobicContact CB-CD1 4.47Å; A408-M467 HydrophobicContact CB-CE 3.49Å; A408-M467 VanDerWaalsContact CB-CE 3.49Å
409	R	98	Very high	96.9	Very high	13 Å²	13	30.7 Å²	30.7	5%	0.049	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-33.4	173.1	-75.6	-179.5	70.5	79.9	5.5	113.8	W405 I407 V417 E418 E419 W454	W405-R409 HydrophobicContact CD2-CG 4.29Å; W405-R409 HydrophobicContact CE3-CG 4.48Å; W405-R409 VanDerWaalsContact CZ2-CD 3.4Å; W405-R409 HydrophobicContact CZ2-CG 4.36Å; W405-R409 WeakPolarHBondContact O-CG 3.45Å; W405-R409 PolarHBondContact O-N 3.4Å; W405-R409 VanDerWaalsContact O-N 3.12Å; I407-R409 VanDerWaalsContact C-N 3.28Å; I407-R409 PolarHBondContact O-N 2.82Å; R409-V417 VanDerWaalsContact O-CG2 3.25Å; R409-V417 WeakPolarHBondContact O-CG2 3.36Å; R409-E418 HydrophobicContact CB-CB 4.31Å; R409-E418 PolarHBondContact O-N 2.89Å; R409-E418 VanDerWaalsContact O-N 3.07Å; R409-E419 PolarHBondContact NE-O 3.32Å; R409-E419 PolarHBondContact NH2-O 3.48Å; R409-E419 VanDerWaalsContact NH2-O 3.1Å; R409-W454 HydrophobicContact CB-CZ2 4.2Å; R409-W454 HydrophobicContact CG-CH2 3.76Å; R409-W454 HydrophobicContact CG-CZ2 3.53Å
410	R	98.1	Very high	96.8	Very high	25 Å²	25	31.6 Å²	31.6	9%	0.094	17%	0.17	C	C	.	.	H	α-helix	trans	-96	1.6	-179.2	-62.6	-55.8	-65.6	137.5	0.8	112.8	L288 V291 A292 V293 I407 A408 V417 E418 Y420	L288-R410 HydrophobicContact CB-CG 4.04Å; L288-R410 HydrophobicContact CD2-CB 3.85Å; L288-R410 HydrophobicContact CD2-CG 4.28Å; L288-R410 WeakPolarHBondContact O-CD 3.29Å; L288-R410 PolarHBondContact O-NE 3.01Å; V291-R410 VanDerWaalsContact C-NH2 3.3Å; V291-R410 PolarHBondContact O-NH2 3.39Å; A292-R410 CarbonylContact C-O 3.22Å; A292-R410 WeakPolarHBondContact CA-O 3.39Å; A292-R410 VanDerWaalsContact N-NH2 3.11Å; V293-R410 PolarHBondContact N-O 3.38Å; I407-R410 CarbonylContact O-C 3.51Å; I407-R410 WeakPolarHBondContact O-CA 3.33Å; I407-R410 PolarHBondContact O-N 2.85Å; A408-R410 PolarHBondContact O-N 3.46Å; R410-V417 VanDerWaalsContact C-CG2 3.5Å; R410-V417 VanDerWaalsContact NH1-CG2 3.35Å; R410-E418 VanDerWaalsContact CD-O 3.27Å; R410-E418 WeakPolarHBondContact CD-O 3.32Å; R410-E418 PolarHBondContact NH1-O 3.08Å; R410-Y420 HydrophobicContact CG-CD2 4.35Å
411	T	97.7	Very high	96.8	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-83.5	128.2	170.5	-59.8	0	0	0	0	110.5	V293 T295 I407 A408 L460	V293-T411 VanDerWaalsContact O-CA 3.32Å; V293-T411 WeakPolarHBondContact O-CA 3.29Å; T295-T411 HydrophobicContact CG2-CG2 4.39Å; I407-T411 PolarHBondContact O-N 3.4Å; I407-T411 PolarHBondContact O-OG1 2.86Å; I407-T411 VanDerWaalsContact O-OG1 3.09Å; A408-T411 WeakPolarHBondContact O-CB 3.41Å; A408-T411 PolarHBondContact O-N 2.82Å; T411-L460 HydrophobicContact CG2-CD2 4.17Å
412	Y	96	Very high	96.8	Very high	82 Å²	82	37.8 Å²	37.8	32%	0.322	20%	0.197	S	C	.	.			trans	-61.8	138.5	170.6	-78.6	-72.8	0	0	0	110.9	A292 V293 T295 V417	A292-Y412 HydrophobicContact CB-CD2 4.04Å; A292-Y412 HydrophobicContact CB-CE1 4.43Å; A292-Y412 HydrophobicContact CB-CE2 3.35Å; V293-Y412 PolarHBondContact O-N 3.45Å; T295-Y412 PolarHBondContact OG1-O 3.4Å; T295-Y412 VanDerWaalsContact OG1-O 3.1Å; Y412-V417 HydrophobicContact CD1-CB 3.77Å; Y412-V417 HydrophobicContact CD1-CG1 4.01Å; Y412-V417 HydrophobicContact CE1-CB 3.86Å; Y412-V417 HydrophobicContact CE1-CG1 3.54Å; Y412-V417 HydrophobicContact CG-CB 4.38Å
413	S	92.6	Very high	96.7	Very high	5 Å²	5	37.8 Å²	37.8	4%	0.035	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-140.7	120.5	166	168.4	0	0	0	0	108.5	G415 I416 D457 L460	S413-G415 PolarHBondContact O-N 2.81Å; S413-I416 PolarHBondContact N-O 3.31Å; S413-I416 PolarHBondContact O-N 3.31Å; S413-D457 WeakPolarHBondContact CB-OD2 3.35Å; S413-D457 VanDerWaalsContact OG-CB 3.25Å; S413-D457 WeakPolarHBondContact OG-CB 3.29Å; S413-D457 VanDerWaalsContact OG-CG 3.3Å; S413-D457 PolarHBondContact OG-OD2 3.05Å; S413-L460 VanDerWaalsContact CB-CD1 3.48Å
414	N	87.5	Confident	96.7	Very high	137 Å²	137	37.8 Å²	37.8	73%	0.733	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	42.7	-174.5	-58.6	-35	0	0	0	113	I416	N414-I416 PolarHBondContact O-N 2.68Å
415	G	90.7	Very high	96.7	Very high	67 Å²	67	41.7 Å²	41.7	69%	0.691	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.1	3.8	-179.9	0	0	0	0	0	115.5	S413	S413-G415 PolarHBondContact O-N 2.81Å
416	I	95	Very high	96.6	Very high	103 Å²	103	45.5 Å²	45.5	53%	0.528	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-114	138.7	-178.9	-56	172	0	0	0	109.9	S413 N414 R453	S413-I416 PolarHBondContact N-O 3.31Å; S413-I416 PolarHBondContact O-N 3.31Å; N414-I416 PolarHBondContact O-N 2.68Å; I416-R453 PolarHBondContact O-NH1 3.48Å
417	V	96.6	Very high	96.6	Very high	39 Å²	39	48.2 Å²	48.2	24%	0.236	25%	0.246	C	C	.	.			trans	-141.1	145.6	178.3	68.1	0	0	0	0	110.4	A292 R409 R410 Y412	A292-V417 HydrophobicContact CB-CB 4.48Å; A292-V417 HydrophobicContact CB-CG1 4.11Å; A292-V417 HydrophobicContact CB-CG2 4.01Å; R409-V417 VanDerWaalsContact O-CG2 3.25Å; R409-V417 WeakPolarHBondContact O-CG2 3.36Å; R410-V417 VanDerWaalsContact C-CG2 3.5Å; R410-V417 VanDerWaalsContact NH1-CG2 3.35Å; Y412-V417 HydrophobicContact CD1-CB 3.77Å; Y412-V417 HydrophobicContact CD1-CG1 4.01Å; Y412-V417 HydrophobicContact CE1-CB 3.86Å; Y412-V417 HydrophobicContact CE1-CG1 3.54Å; Y412-V417 HydrophobicContact CG-CB 4.38Å
418	E	97	Very high	96.5	Very high	33 Å²	33	48.7 Å²	48.7	15%	0.154	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-83	156.1	171.7	-73.9	84.4	-160.8	0	0	111.9	R409 R410 P451 R453 W454	R409-E418 HydrophobicContact CB-CB 4.31Å; R409-E418 PolarHBondContact O-N 2.89Å; R409-E418 VanDerWaalsContact O-N 3.07Å; R410-E418 VanDerWaalsContact CD-O 3.27Å; R410-E418 WeakPolarHBondContact CD-O 3.32Å; R410-E418 PolarHBondContact NH1-O 3.08Å; E418-P451 HydrophobicContact CG-CG 4.45Å; E418-P451 WeakPolarHBondContact OE1-CG 3.28Å; E418-R453 IonicContact OE1-CZ 3.42Å; E418-R453 IonicContact OE1-NE 3.47Å; E418-R453 PolarHBondContact OE1-NE 2.92Å; E418-R453 IonicContact OE1-NH2 3.49Å; E418-R453 PolarHBondContact OE1-NH2 2.86Å; E418-R453 IonicContact OE2-CZ 2.72Å; E418-R453 IonicContact OE2-NE 3.38Å; E418-R453 IonicContact OE2-NH2 3.46Å; E418-R453 PolarHBondContact OE2-NH2 3.45Å; E418-W454 PolarHBondContact OE2-NE1 3.28Å
419	E	97.2	Very high	96.5	Very high	129 Å²	129	52.1 Å²	52.1	60%	0.603	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-61.6	150.5	163.5	-65	-176.1	165.5	0	0	112.1	R409 R421	R409-E419 PolarHBondContact NE-O 3.32Å; R409-E419 PolarHBondContact NH2-O 3.48Å; R409-E419 VanDerWaalsContact NH2-O 3.1Å; E419-R421 PolarHBondContact O-N 2.87Å; E419-R421 IonicContact OE2-CZ 2.9Å; E419-R421 IonicContact OE2-NE 2.74Å; E419-R421 IonicContact OE2-NH2 3.27Å; E419-R421 PolarHBondContact OE2-NH2 2.89Å
420	Y	98.1	Very high	96.3	Very high	23 Å²	23	58.7 Å²	58.7	9%	0.09	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.4	130.6	172.2	177.4	-91.2	0	0	0	109.9	Y285 L288 Q289 E406 R410	Y285-Y420 AromaticContact CD2-CE1 3.98Å; Y285-Y420 HydrophobicContact CD2-CE1 3.98Å; Y285-Y420 AromaticContact CD2-CZ 3.65Å; Y285-Y420 WeakPolarHBondContact CD2-OH 3.3Å; Y285-Y420 AromaticContact CE2-CE1 3.69Å; Y285-Y420 HydrophobicContact CE2-CE1 3.69Å; Y285-Y420 AromaticContact CE2-CZ 3.84Å; Y285-Y420 WeakPolarHBondContact CE2-OH 3.46Å; L288-Y420 HydrophobicContact CB-CD2 3.77Å; L288-Y420 HydrophobicContact CB-CE2 4.15Å; Q289-Y420 HydrophobicContact CG-CD1 3.33Å; Q289-Y420 HydrophobicContact CG-CD2 4.34Å; Q289-Y420 HydrophobicContact CG-CE1 3.87Å; Q289-Y420 HydrophobicContact CG-CG 3.62Å; Q289-Y420 VanDerWaalsContact NE2-CE1 3.35Å; E406-Y420 HydrophobicContact CB-CE2 4.42Å; E406-Y420 HydrophobicContact CG-CE2 4.45Å; E406-Y420 WeakPolarHBondContact OE2-CE2 3.32Å; E406-Y420 PolarHBondContact OE2-OH 2.97Å; R410-Y420 HydrophobicContact CG-CD2 4.35Å
421	R	98.1	Very high	96.1	Very high	100 Å²	100	64 Å²	64	38%	0.377	34%	0.337	S	S	.	.			trans	-141.4	142.9	170.5	-63.4	-65.2	171.7	-172.4	-5.1	108.3	W405 E419 Y425	W405-R421 HydrophobicContact CH2-CB 4.44Å; W405-R421 WeakPolarHBondContact CZ3-O 3.31Å; E419-R421 PolarHBondContact O-N 2.87Å; E419-R421 IonicContact OE2-CZ 2.9Å; E419-R421 IonicContact OE2-NE 2.74Å; E419-R421 IonicContact OE2-NH2 3.27Å; E419-R421 PolarHBondContact OE2-NH2 2.89Å; R421-Y425 HydrophobicContact CB-CD1 3.48Å; R421-Y425 VanDerWaalsContact CB-CD1 3.48Å; R421-Y425 HydrophobicContact CB-CD2 4.06Å; R421-Y425 HydrophobicContact CB-CE1 3.87Å; R421-Y425 HydrophobicContact CB-CE2 4.37Å; R421-Y425 HydrophobicContact CB-CG 3.59Å; R421-Y425 HydrophobicContact CG-CD1 4.01Å; R421-Y425 HydrophobicContact CG-CD2 3.84Å; R421-Y425 HydrophobicContact CG-CE1 4.01Å; R421-Y425 HydrophobicContact CG-CE2 3.81Å; R421-Y425 HydrophobicContact CG-CG 3.93Å
422	P	98	Very high	96.1	Very high	29 Å²	29	64 Å²	64	19%	0.188	34%	0.338	C	S	.	.			trans	-68.6	158.1	171.1	30.4	-34.6	0	0	0	110.6	F424 Y425	P422-F424 PolarHBondContact O-N 2.9Å; P422-Y425 WeakPolarHBondContact O-CB 3.49Å; P422-Y425 PolarHBondContact O-N 3.48Å
423	P	98.6	Very high	96.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	140	175.5	-23.4	33.2	0	0	0	111.2	R373 Y374 L402 W405 E406 Y425 P448	R373-P423 VanDerWaalsContact CD-O 3.23Å; R373-P423 WeakPolarHBondContact CD-O 3.48Å; R373-P423 WeakPolarHBondContact CG-O 3.49Å; R373-P423 PolarHBondContact NH1-O 3.02Å; Y374-P423 HydrophobicContact CE1-CG 3.9Å; Y374-P423 WeakPolarHBondContact OH-CD 3.32Å; L402-P423 HydrophobicContact CB-CB 4.18Å; L402-P423 HydrophobicContact CB-CG 3.84Å; L402-P423 HydrophobicContact CD1-CB 4.41Å; L402-P423 HydrophobicContact CD2-CB 4.23Å; W405-P423 HydrophobicContact CE3-CG 4.41Å; E406-P423 HydrophobicContact CG-CG 3.98Å; P423-Y425 PolarHBondContact O-N 3.22Å; P423-P448 HydrophobicContact CB-CG 4.16Å
424	F	98.5	Very high	96.3	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	20.1	-178.3	-48.5	-84.5	0	0	0	115.3	W398 L402 P422 D426 Q427 V428 M437 V440 V441 P448	W398-F424 HydrophobicContact CZ2-CZ 4.28Å; L402-F424 HydrophobicContact CD1-CE2 4.02Å; L402-F424 HydrophobicContact CD2-CE2 3.86Å; L402-F424 HydrophobicContact CD2-CZ 4.19Å; P422-F424 PolarHBondContact O-N 2.9Å; F424-D426 PolarHBondContact O-N 3.4Å; F424-D426 VanDerWaalsContact O-N 3.11Å; F424-Q427 HydrophobicContact CB-CB 4.46Å; F424-Q427 PolarHBondContact O-N 2.89Å; F424-V428 HydrophobicContact CB-CG2 4.01Å; F424-V428 WeakPolarHBondContact O-CG2 3.21Å; F424-V428 PolarHBondContact O-N 3.45Å; F424-V428 VanDerWaalsContact O-N 3.1Å; F424-M437 HydrophobicContact CD2-CE 3.85Å; F424-M437 HydrophobicContact CE2-CE 4.03Å; F424-M437 HydrophobicContact CG-CE 4.34Å; F424-V440 HydrophobicContact CD1-CG1 4Å; F424-V440 HydrophobicContact CE1-CG1 4.34Å; F424-V441 HydrophobicContact CE1-CG2 3.92Å; F424-V441 HydrophobicContact CE2-CG2 4.31Å; F424-V441 HydrophobicContact CZ-CG2 3.72Å; F424-P448 HydrophobicContact CD1-CG 4.49Å; F424-P448 HydrophobicContact CD2-CG 4.49Å; F424-P448 HydrophobicContact CE1-CG 4.31Å; F424-P448 HydrophobicContact CE2-CG 4.27Å; F424-P448 HydrophobicContact CZ-CG 4.19Å
425	Y	98.1	Very high	96.7	Very high	85 Å²	85	62.4 Å²	62.4	33%	0.333	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.6	-179.3	76.9	-75.5	0	0	0	114.7	W405 R421 P422 P423	W405-Y425 HydrophobicContact CH2-CD1 4.03Å; W405-Y425 HydrophobicContact CH2-CE1 4.13Å; R421-Y425 HydrophobicContact CB-CD1 3.48Å; R421-Y425 VanDerWaalsContact CB-CD1 3.48Å; R421-Y425 HydrophobicContact CB-CD2 4.06Å; R421-Y425 HydrophobicContact CB-CE1 3.87Å; R421-Y425 HydrophobicContact CB-CE2 4.37Å; R421-Y425 HydrophobicContact CB-CG 3.59Å; R421-Y425 HydrophobicContact CG-CD1 4.01Å; R421-Y425 HydrophobicContact CG-CD2 3.84Å; R421-Y425 HydrophobicContact CG-CE1 4.01Å; R421-Y425 HydrophobicContact CG-CE2 3.81Å; R421-Y425 HydrophobicContact CG-CG 3.93Å; P422-Y425 WeakPolarHBondContact O-CB 3.49Å; P422-Y425 PolarHBondContact O-N 3.48Å; P423-Y425 PolarHBondContact O-N 3.22Å
426	D	97.4	Very high	97.1	Very high	80 Å²	80	62 Å²	62	43%	0.428	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-7.5	-178.4	57	-31.2	0	0	0	113.1	F424	F424-D426 PolarHBondContact O-N 3.4Å; F424-D426 VanDerWaalsContact O-N 3.11Å
427	Q	97.6	Very high	97.3	Very high	57 Å²	57	57.1 Å²	57.1	27%	0.266	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-24.7	-171.4	-63.8	168.7	28.9	0	0	113	F424 V440 R447	F424-Q427 HydrophobicContact CB-CB 4.46Å; F424-Q427 PolarHBondContact O-N 2.89Å; Q427-V440 HydrophobicContact CB-CG1 4Å; Q427-V440 HydrophobicContact CB-CG2 4.34Å; Q427-R447 PolarHBondContact NE2-O 3.29Å
428	V	98.1	Very high	97.3	Very high	12 Å²	12	59 Å²	59	7%	0.073	29%	0.293	C	S	.	.	S	Bend	trans	-137.8	154.4	-178	-56.1	0	0	0	0	111.7	F424 P432 D436 M437 V440	F424-V428 HydrophobicContact CB-CG2 4.01Å; F424-V428 WeakPolarHBondContact O-CG2 3.21Å; F424-V428 PolarHBondContact O-N 3.45Å; F424-V428 VanDerWaalsContact O-N 3.1Å; V428-P432 HydrophobicContact CB-CB 3.97Å; V428-P432 HydrophobicContact CG2-CB 3.85Å; V428-P432 HydrophobicContact CG2-CG 4.09Å; V428-D436 HydrophobicContact CG1-CB 4.3Å; V428-M437 HydrophobicContact CB-SD 4.39Å; V428-M437 HydrophobicContact CG1-SD 4Å; V428-M437 HydrophobicContact CG2-SD 3.86Å; V428-V440 HydrophobicContact CG1-CB 4.2Å; V428-V440 HydrophobicContact CG1-CG2 3.66Å
429	P	97.4	Very high	97.4	Very high	73 Å²	73	62.9 Å²	62.9	47%	0.474	31%	0.309	S	S	.	.			trans	-63.9	168.4	177	27.9	-36.5	0	0	0	112.4	R373 D431 P432	R373-P429 PolarHBondContact NH2-O 3.49Å; P429-D431 PolarHBondContact O-N 2.93Å; P429-P432 WeakPolarHBondContact O-CD 3.48Å
430	N	93.9	Very high	97.5	Very high	151 Å²	151	57.1 Å²	57.1	81%	0.807	28%	0.283	S	S	*	.	S	Bend	trans	-56.3	-44.2	-175.2	-75.7	-26	0	0	0	114.1	R373 P432	R373-N430 PolarHBondContact NH2-O 3.34Å; N430-P432 VanDerWaalsContact O-CD 3.31Å; N430-P432 WeakPolarHBondContact O-CD 3.06Å
431	D	94.3	Very high	97.5	Very high	135 Å²	135	56 Å²	56	72%	0.722	28%	0.278	S	S	*	.	S	Bend	trans	-111.2	84.1	171.3	-176.5	27.7	0	0	0	109.4	P429	P429-D431 PolarHBondContact O-N 2.93Å
432	P	97.3	Very high	97.5	Very high	5 Å²	5	52 Å²	52	3%	0.032	27%	0.266	C	S	.	.			trans	-71.9	143.8	-173.8	31.3	-34.5	0	0	0	110.6	K372 R373 V428 P429 N430 D436 M437	K372-P432 WeakPolarHBondContact CD-O 3.19Å; R373-P432 HydrophobicContact CB-CG 4.15Å; V428-P432 HydrophobicContact CB-CB 3.97Å; V428-P432 HydrophobicContact CG2-CB 3.85Å; V428-P432 HydrophobicContact CG2-CG 4.09Å; P429-P432 WeakPolarHBondContact O-CD 3.48Å; N430-P432 VanDerWaalsContact O-CD 3.31Å; N430-P432 WeakPolarHBondContact O-CD 3.06Å; P432-D436 HydrophobicContact CB-CB 4.13Å; P432-M437 HydrophobicContact CB-CG 3.95Å; P432-M437 HydrophobicContact CB-SD 3.97Å; P432-M437 HydrophobicContact CG-CG 3.97Å; P432-M437 HydrophobicContact CG-SD 3.84Å
433	S	97.1	Very high	97.5	Very high	49 Å²	49	55.5 Å²	55.5	34%	0.343	29%	0.286	S	S	.	.			trans	-71.7	169.3	169	73.7	0	0	0	0	110.7	E435 D436 M437	S433-E435 PolarHBondContact O-N 3.37Å; S433-E435 PolarHBondContact OG-N 2.95Å; S433-D436 VanDerWaalsContact CB-OD2 3.31Å; S433-D436 WeakPolarHBondContact CB-OD2 3.47Å; S433-D436 PolarHBondContact N-OD2 2.88Å; S433-D436 PolarHBondContact O-N 3.43Å; S433-D436 PolarHBondContact OG-N 3.3Å; S433-D436 VanDerWaalsContact OG-N 3.14Å; S433-D436 PolarHBondContact OG-OD2 3.42Å; S433-M437 PolarHBondContact O-N 3.27Å
434	F	95.5	Very high	97.4	Very high	45 Å²	45	59.8 Å²	59.8	20%	0.197	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-37.3	173.6	-173.2	-93.8	0	0	0	111.1	K368 K372 M375 L380 E382 M437 R438	K368-F434 HydrophobicContact CD-CZ 4.49Å; K372-F434 HydrophobicContact CD-CB 4.18Å; M375-F434 HydrophobicContact SD-CD2 4.08Å; M375-F434 HydrophobicContact SD-CE2 4.04Å; L380-F434 VanDerWaalsContact CA-CZ 3.48Å; L380-F434 HydrophobicContact CD2-CD2 3.95Å; L380-F434 HydrophobicContact CD2-CE2 3.88Å; L380-F434 HydrophobicContact CD2-CZ 4.4Å; L380-F434 WeakPolarHBondContact O-CE1 3.13Å; L380-F434 WeakPolarHBondContact O-CZ 3.5Å; E382-F434 HydrophobicContact CG-CZ 4.48Å; F434-M437 PolarHBondContact O-N 3.02Å; F434-R438 WeakPolarHBondContact O-CB 3.33Å; F434-R438 PolarHBondContact O-N 3.01Å
435	E	97.1	Very high	97.4	Very high	96 Å²	96	65.4 Å²	65.4	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-43.8	178.6	-171.8	62.7	-144.1	0	0	112.1	S433 M437 R438 K439	S433-E435 PolarHBondContact O-N 3.37Å; S433-E435 PolarHBondContact OG-N 2.95Å; E435-M437 VanDerWaalsContact C-N 3.31Å; E435-M437 PolarHBondContact O-N 3.32Å; E435-R438 VanDerWaalsContact CD-NH1 3.34Å; E435-R438 PolarHBondContact O-N 3.48Å; E435-R438 IonicContact OE1-CZ 2.64Å; E435-R438 VanDerWaalsContact OE1-CZ 3.25Å; E435-R438 IonicContact OE1-NH1 2.72Å; E435-R438 PolarHBondContact OE1-NH1 3.3Å; E435-R438 IonicContact OE1-NH2 3.77Å; E435-R438 PolarHBondContact OE1-NH2 3.12Å; E435-R438 IonicContact OE2-CZ 3.6Å; E435-R438 VanDerWaalsContact OE2-CZ 3.31Å; E435-R438 IonicContact OE2-NH1 2.83Å; E435-R438 PolarHBondContact OE2-NH1 3.32Å; E435-R438 IonicContact OE2-NH2 3.82Å; E435-R438 PolarHBondContact OE2-NH2 3.49Å; E435-K439 WeakPolarHBondContact O-CB 3.45Å; E435-K439 PolarHBondContact O-N 2.94Å
436	D	98.2	Very high	97.4	Very high	58 Å²	58	65.6 Å²	65.6	31%	0.31	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-47.9	178.2	-60.8	-43.8	0	0	0	110.6	V428 P432 S433 K439 V440	V428-D436 HydrophobicContact CG1-CB 4.3Å; P432-D436 HydrophobicContact CB-CB 4.13Å; S433-D436 VanDerWaalsContact CB-OD2 3.31Å; S433-D436 WeakPolarHBondContact CB-OD2 3.47Å; S433-D436 PolarHBondContact N-OD2 2.88Å; S433-D436 PolarHBondContact O-N 3.43Å; S433-D436 PolarHBondContact OG-N 3.3Å; S433-D436 VanDerWaalsContact OG-N 3.14Å; S433-D436 PolarHBondContact OG-OD2 3.42Å; D436-K439 PolarHBondContact O-N 2.88Å; D436-V440 WeakPolarHBondContact O-CG2 3.47Å; D436-V440 PolarHBondContact O-N 3.32Å; D436-V440 VanDerWaalsContact O-N 3.12Å
437	M	98.4	Very high	97.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.8	-42.8	179.2	-67.6	-56.4	-52	0	0	111.9	K372 R373 L380 F424 V428 P432 S433 F434 E435 K439 V440 V441	K372-M437 HydrophobicContact CB-CG 4.27Å; R373-M437 WeakPolarHBondContact O-CE 3.28Å; L380-M437 HydrophobicContact CD1-CB 3.96Å; L380-M437 HydrophobicContact CD2-CB 3.69Å; F424-M437 HydrophobicContact CD2-CE 3.85Å; F424-M437 HydrophobicContact CE2-CE 4.03Å; F424-M437 HydrophobicContact CG-CE 4.34Å; V428-M437 HydrophobicContact CB-SD 4.39Å; V428-M437 HydrophobicContact CG1-SD 4Å; V428-M437 HydrophobicContact CG2-SD 3.86Å; P432-M437 HydrophobicContact CB-CG 3.95Å; P432-M437 HydrophobicContact CB-SD 3.97Å; P432-M437 HydrophobicContact CG-CG 3.97Å; P432-M437 HydrophobicContact CG-SD 3.84Å; S433-M437 PolarHBondContact O-N 3.27Å; F434-M437 PolarHBondContact O-N 3.02Å; E435-M437 VanDerWaalsContact C-N 3.31Å; E435-M437 PolarHBondContact O-N 3.32Å; M437-K439 VanDerWaalsContact C-N 3.33Å; M437-K439 PolarHBondContact O-N 3.46Å; M437-V440 PolarHBondContact O-N 3.04Å; M437-V441 HydrophobicContact CE-CG2 3.69Å; M437-V441 VanDerWaalsContact O-CB 3.24Å; M437-V441 WeakPolarHBondContact O-CB 3.45Å; M437-V441 WeakPolarHBondContact O-CG2 3.31Å; M437-V441 PolarHBondContact O-N 3.05Å
438	R	98.1	Very high	97.5	Very high	79 Å²	79	61.1 Å²	61.1	30%	0.298	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-43	177.3	-166.8	-173.2	85.2	-118.9	-8.4	111.3	L380 F434 E435 C442 V443	L380-R438 HydrophobicContact CB-CB 4.3Å; L380-R438 HydrophobicContact CB-CG 4.33Å; L380-R438 VanDerWaalsContact O-CD 3.27Å; L380-R438 WeakPolarHBondContact O-CD 3.25Å; L380-R438 WeakPolarHBondContact O-CG 3.49Å; F434-R438 WeakPolarHBondContact O-CB 3.33Å; F434-R438 PolarHBondContact O-N 3.01Å; E435-R438 VanDerWaalsContact CD-NH1 3.34Å; E435-R438 PolarHBondContact O-N 3.48Å; E435-R438 IonicContact OE1-CZ 2.64Å; E435-R438 VanDerWaalsContact OE1-CZ 3.25Å; E435-R438 IonicContact OE1-NH1 2.72Å; E435-R438 PolarHBondContact OE1-NH1 3.3Å; E435-R438 IonicContact OE1-NH2 3.77Å; E435-R438 PolarHBondContact OE1-NH2 3.12Å; E435-R438 IonicContact OE2-CZ 3.6Å; E435-R438 VanDerWaalsContact OE2-CZ 3.31Å; E435-R438 IonicContact OE2-NH1 2.83Å; E435-R438 PolarHBondContact OE2-NH1 3.32Å; E435-R438 IonicContact OE2-NH2 3.82Å; E435-R438 PolarHBondContact OE2-NH2 3.49Å; R438-C442 HydrophobicContact CG-CB 4.1Å; R438-C442 WeakPolarHBondContact O-CA 3.41Å; R438-C442 WeakPolarHBondContact O-CB 3.46Å; R438-C442 PolarHBondContact O-N 3.45Å; R438-V443 PolarHBondContact O-N 3.01Å
439	K	98.4	Very high	97.4	Very high	114 Å²	114	65.7 Å²	65.7	50%	0.496	33%	0.33	S	S	.	.	I	π-helix	trans	-59.2	-54.1	177.2	-179	-179.8	170.5	-173.9	0	110.9	E435 D436 M437 V443 E444	E435-K439 WeakPolarHBondContact O-CB 3.45Å; E435-K439 PolarHBondContact O-N 2.94Å; D436-K439 PolarHBondContact O-N 2.88Å; M437-K439 VanDerWaalsContact C-N 3.33Å; M437-K439 PolarHBondContact O-N 3.46Å; K439-V443 VanDerWaalsContact O-CB 3.32Å; K439-V443 WeakPolarHBondContact O-CB 3.45Å; K439-V443 PolarHBondContact O-N 3.38Å; K439-E444 WeakPolarHBondContact CE-OE1 3.39Å; K439-E444 IonicContact NZ-OE1 3.26Å; K439-E444 PolarHBondContact O-N 2.96Å
440	V	98.5	Very high	97.4	Very high	8 Å²	8	63.2 Å²	63.2	5%	0.048	31%	0.313	C	S	.	.	I	π-helix	trans	-67.9	-45.7	-176	171.1	0	0	0	0	112.1	F424 Q427 V428 D436 M437 Q445 Q446	F424-V440 HydrophobicContact CD1-CG1 4Å; F424-V440 HydrophobicContact CE1-CG1 4.34Å; Q427-V440 HydrophobicContact CB-CG1 4Å; Q427-V440 HydrophobicContact CB-CG2 4.34Å; V428-V440 HydrophobicContact CG1-CB 4.2Å; V428-V440 HydrophobicContact CG1-CG2 3.66Å; D436-V440 WeakPolarHBondContact O-CG2 3.47Å; D436-V440 PolarHBondContact O-N 3.32Å; D436-V440 VanDerWaalsContact O-N 3.12Å; M437-V440 PolarHBondContact O-N 3.04Å; V440-Q445 PolarHBondContact O-N 3.37Å; V440-Q446 HydrophobicContact CG1-CB 3.8Å; V440-Q446 HydrophobicContact CG1-CG 4.38Å; V440-Q446 PolarHBondContact O-N 3.45Å
441	V	98.4	Very high	97.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.278	C	S	.	.	I	π-helix	trans	-85.8	-38.5	-171	175.2	0	0	0	0	113	P377 L380 W398 F424 M437 Q445 R447	P377-V441 HydrophobicContact CB-CG1 4.05Å; P377-V441 HydrophobicContact CG-CG1 3.67Å; L380-V441 HydrophobicContact CD1-CB 3.79Å; L380-V441 HydrophobicContact CD1-CG1 3.95Å; L380-V441 HydrophobicContact CD1-CG2 4.17Å; W398-V441 HydrophobicContact CH2-CG1 3.65Å; W398-V441 HydrophobicContact CZ2-CG1 3.6Å; W398-V441 HydrophobicContact CZ2-CG2 4.49Å; F424-V441 HydrophobicContact CE1-CG2 3.92Å; F424-V441 HydrophobicContact CE2-CG2 4.31Å; F424-V441 HydrophobicContact CZ-CG2 3.72Å; M437-V441 HydrophobicContact CE-CG2 3.69Å; M437-V441 VanDerWaalsContact O-CB 3.24Å; M437-V441 WeakPolarHBondContact O-CB 3.45Å; M437-V441 WeakPolarHBondContact O-CG2 3.31Å; M437-V441 PolarHBondContact O-N 3.05Å; V441-Q445 WeakPolarHBondContact O-CA 3Å; V441-R447 PolarHBondContact O-NH1 3.45Å
442	C	98	Very high	97.6	Very high	17 Å²	17	56.2 Å²	56.2	12%	0.115	28%	0.276	C	S	.	.	I	π-helix	trans	-99.2	-44.6	-174.3	-51.1	0	0	0	0	112.5	P377 R438 Q445	P377-C442 PolarHBondContact O-SG 3.37Å; P377-C442 VanDerWaalsContact O-SG 3.4Å; R438-C442 HydrophobicContact CG-CB 4.1Å; R438-C442 WeakPolarHBondContact O-CA 3.41Å; R438-C442 WeakPolarHBondContact O-CB 3.46Å; R438-C442 PolarHBondContact O-N 3.45Å; C442-Q445 WeakPolarHBondContact O-CG 3.45Å
443	V	97.9	Very high	97.4	Very high	101 Å²	101	58.7 Å²	58.7	61%	0.612	29%	0.285	S	S	*	.	I	π-helix	trans	-81.7	-54	-176.1	-176.8	0	0	0	0	110.9	R438 K439 Q445	R438-V443 PolarHBondContact O-N 3.01Å; K439-V443 VanDerWaalsContact O-CB 3.32Å; K439-V443 WeakPolarHBondContact O-CB 3.45Å; K439-V443 PolarHBondContact O-N 3.38Å; V443-Q445 VanDerWaalsContact C-N 3.32Å
444	E	98.1	Very high	97.4	Very high	90 Å²	90	56.4 Å²	56.4	42%	0.421	27%	0.269	S	S	.	.	S	Bend	trans	-84.4	-10.8	-179.1	-61.8	176.4	179.5	0	0	112.6	K439 Q446	K439-E444 WeakPolarHBondContact CE-OE1 3.39Å; K439-E444 IonicContact NZ-OE1 3.26Å; K439-E444 PolarHBondContact O-N 2.96Å; E444-Q446 HydrophobicContact CB-CG 3.86Å; E444-Q446 PolarHBondContact O-N 3.46Å; E444-Q446 VanDerWaalsContact O-N 3.12Å
445	Q	98	Very high	97.4	Very high	119 Å²	119	58.8 Å²	58.8	56%	0.556	28%	0.279	S	S	*	.			trans	50.8	33.2	-179.9	-59.6	-173.2	22.2	0	0	114.1	V440 V441 C442 V443 R447	V440-Q445 PolarHBondContact O-N 3.37Å; V441-Q445 WeakPolarHBondContact O-CA 3Å; C442-Q445 WeakPolarHBondContact O-CG 3.45Å; V443-Q445 VanDerWaalsContact C-N 3.32Å; Q445-R447 PolarHBondContact O-NH1 3.24Å
446	Q	98.1	Very high	97.2	Very high	88 Å²	88	59 Å²	59	41%	0.411	29%	0.291	S	S	.	.			trans	-73	158.2	179	-63.3	-64	-28.9	0	0	111.5	V440 E444	V440-Q446 HydrophobicContact CG1-CB 3.8Å; V440-Q446 HydrophobicContact CG1-CG 4.38Å; V440-Q446 PolarHBondContact O-N 3.45Å; E444-Q446 HydrophobicContact CB-CG 3.86Å; E444-Q446 PolarHBondContact O-N 3.46Å; E444-Q446 VanDerWaalsContact O-N 3.12Å
447	R	98.3	Very high	97.1	Very high	40 Å²	40	56.9 Å²	56.9	15%	0.151	28%	0.28	C	S	.	.			trans	-134.4	161	173.7	-60.9	-62.9	-178.8	-91.4	3.5	108.7	W398 Q427 V441 Q445 F449 W471	W398-R447 VanDerWaalsContact CH2-CZ 3.43Å; Q427-R447 PolarHBondContact NE2-O 3.29Å; V441-R447 PolarHBondContact O-NH1 3.45Å; Q445-R447 PolarHBondContact O-NH1 3.24Å; R447-F449 PolarHBondContact O-N 3.28Å; R447-W471 HydrophobicContact CB-CD2 3.94Å; R447-W471 HydrophobicContact CB-CE3 3.96Å; R447-W471 HydrophobicContact CB-CH2 3.78Å; R447-W471 HydrophobicContact CB-CZ2 3.73Å; R447-W471 HydrophobicContact CB-CZ3 3.91Å; R447-W471 HydrophobicContact CG-CD2 3.85Å; R447-W471 HydrophobicContact CG-CE3 4.31Å; R447-W471 HydrophobicContact CG-CG 4.16Å; R447-W471 HydrophobicContact CG-CZ2 4.2Å; R447-W471 PolarHBondContact NE-O 2.04Å; R447-W471 PolarHBondContact NH2-O 3.25Å
448	P	98.3	Very high	96.9	Very high	4 Å²	4	62.1 Å²	62.1	3%	0.026	31%	0.314	C	S	.	.			trans	-51.3	134.4	171.9	-27.5	30.4	0	0	0	112.5	L402 W405 P423 F424 I450 W471	L402-P448 HydrophobicContact CD2-CG 3.68Å; W405-P448 HydrophobicContact CD2-CB 3.78Å; W405-P448 VanDerWaalsContact CE2-CB 3.48Å; W405-P448 HydrophobicContact CE3-CB 4.4Å; W405-P448 HydrophobicContact CG-CB 4Å; W405-P448 HydrophobicContact CH2-CB 4.46Å; W405-P448 HydrophobicContact CZ2-CB 3.84Å; P423-P448 HydrophobicContact CB-CG 4.16Å; F424-P448 HydrophobicContact CD1-CG 4.49Å; F424-P448 HydrophobicContact CD2-CG 4.49Å; F424-P448 HydrophobicContact CE1-CG 4.31Å; F424-P448 HydrophobicContact CE2-CG 4.27Å; F424-P448 HydrophobicContact CZ-CG 4.19Å; P448-I450 PolarHBondContact O-N 3.48Å; P448-W471 HydrophobicContact CB-CH2 4.42Å; P448-W471 HydrophobicContact CB-CZ3 3.88Å; P448-W471 HydrophobicContact CG-CE3 4.25Å; P448-W471 HydrophobicContact CG-CZ3 3.68Å; P448-W471 WeakPolarHBondContact O-CH2 3.4Å
449	F	97	Very high	96.8	Very high	107 Å²	107	59 Å²	59	47%	0.469	30%	0.304	S	S	.	.			trans	-60.3	132.5	179.2	173.1	-102.1	0	0	0	111.7	W405 R447 P451	W405-F449 PolarHBondContact NE1-O 3.42Å; R447-F449 PolarHBondContact O-N 3.28Å; F449-P451 HydrophobicContact CD1-CG 4.49Å; F449-P451 HydrophobicContact CE1-CB 4.41Å; F449-P451 HydrophobicContact CE1-CG 4.27Å
450	I	97.5	Very high	96.7	Very high	22 Å²	22	53.6 Å²	53.6	11%	0.113	28%	0.28	C	S	.	.			trans	-101.9	115.8	175.7	-66.3	159.8	0	0	0	108.7	P448 N452 W454 F455 V464 W471	P448-I450 PolarHBondContact O-N 3.48Å; I450-N452 PolarHBondContact O-N 3.19Å; I450-W454 HydrophobicContact CG2-CB 4.48Å; I450-W454 HydrophobicContact CG2-CD2 4.41Å; I450-W454 HydrophobicContact CG2-CE3 3.85Å; I450-W454 HydrophobicContact CG2-CZ3 4.47Å; I450-F455 HydrophobicContact CG2-CE2 3.86Å; I450-F455 HydrophobicContact CG2-CZ 3.88Å; I450-V464 HydrophobicContact CD1-CG1 3.77Å; I450-V464 HydrophobicContact CG2-CG1 4.25Å; I450-V464 HydrophobicContact CG2-CG2 3.61Å; I450-W471 HydrophobicContact CD1-CH2 3.89Å; I450-W471 HydrophobicContact CD1-CZ2 3.83Å; I450-W471 HydrophobicContact CG1-CH2 4.15Å
451	P	95.9	Very high	96.6	Very high	11 Å²	11	54.4 Å²	54.4	7%	0.071	29%	0.286	C	S	.	.			trans	-58.2	131.7	175.4	-24.8	34.6	0	0	0	112.4	E418 F449 R453 W454	E418-P451 HydrophobicContact CG-CG 4.45Å; E418-P451 WeakPolarHBondContact OE1-CG 3.28Å; F449-P451 HydrophobicContact CD1-CG 4.49Å; F449-P451 HydrophobicContact CE1-CB 4.41Å; F449-P451 HydrophobicContact CE1-CG 4.27Å; P451-R453 HydrophobicContact CB-CG 4.2Å; P451-R453 PolarHBondContact O-N 3.31Å; P451-W454 HydrophobicContact CB-CG 4.36Å; P451-W454 HydrophobicContact CG-CD2 4.34Å; P451-W454 HydrophobicContact CG-CZ2 4.06Å; P451-W454 WeakPolarHBondContact O-CB 2.99Å; P451-W454 PolarHBondContact O-N 2.8Å
452	N	94.8	Very high	96.6	Very high	128 Å²	128	55.7 Å²	55.7	68%	0.684	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-55.1	-32.1	-178.8	-72.1	-24.7	0	0	0	113.3	I450 W454 F455	I450-N452 PolarHBondContact O-N 3.19Å; N452-W454 PolarHBondContact O-N 3.23Å; N452-F455 WeakPolarHBondContact O-CD2 2.83Å; N452-F455 PolarHBondContact O-N 3.07Å
453	R	93.9	Very high	96.6	Very high	57 Å²	57	55.1 Å²	55.1	22%	0.215	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-60.8	-28.2	179.2	77.4	-179.1	-175.2	92.9	4	113.3	I416 E418 P451 F455 S456	I416-R453 PolarHBondContact O-NH1 3.48Å; E418-R453 IonicContact OE1-CZ 3.42Å; E418-R453 IonicContact OE1-NE 3.47Å; E418-R453 PolarHBondContact OE1-NE 2.92Å; E418-R453 IonicContact OE1-NH2 3.49Å; E418-R453 PolarHBondContact OE1-NH2 2.86Å; E418-R453 IonicContact OE2-CZ 2.72Å; E418-R453 IonicContact OE2-NE 3.38Å; E418-R453 IonicContact OE2-NH2 3.46Å; E418-R453 PolarHBondContact OE2-NH2 3.45Å; P451-R453 HydrophobicContact CB-CG 4.2Å; P451-R453 PolarHBondContact O-N 3.31Å; R453-F455 PolarHBondContact O-N 3.04Å; R453-S456 WeakPolarHBondContact O-CB 2.97Å; R453-S456 PolarHBondContact O-N 3.43Å
454	W	96.5	Very high	96.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.6	-179.5	-68.7	7.4	0	0	0	111.9	W405 A408 R409 E418 I450 P451 N452 S456 D457 L460 S461 V464 M467	W405-W454 AromaticContact CD1-CH2 3.77Å; W405-W454 AromaticContact CD1-CZ3 3.91Å; W405-W454 HydrophobicContact CG-CH2 4.36Å; A408-W454 HydrophobicContact CB-CE3 4.41Å; A408-W454 HydrophobicContact CB-CH2 3.57Å; A408-W454 HydrophobicContact CB-CZ2 4.03Å; A408-W454 HydrophobicContact CB-CZ3 3.79Å; R409-W454 HydrophobicContact CB-CZ2 4.2Å; R409-W454 HydrophobicContact CG-CH2 3.76Å; R409-W454 HydrophobicContact CG-CZ2 3.53Å; E418-W454 PolarHBondContact OE2-NE1 3.28Å; I450-W454 HydrophobicContact CG2-CB 4.48Å; I450-W454 HydrophobicContact CG2-CD2 4.41Å; I450-W454 HydrophobicContact CG2-CE3 3.85Å; I450-W454 HydrophobicContact CG2-CZ3 4.47Å; P451-W454 HydrophobicContact CB-CG 4.36Å; P451-W454 HydrophobicContact CG-CD2 4.34Å; P451-W454 HydrophobicContact CG-CZ2 4.06Å; P451-W454 WeakPolarHBondContact O-CB 2.99Å; P451-W454 PolarHBondContact O-N 2.8Å; N452-W454 PolarHBondContact O-N 3.23Å; W454-S456 VanDerWaalsContact C-N 3.29Å; W454-S456 PolarHBondContact O-N 2.71Å; W454-D457 PolarHBondContact O-N 3.34Å; W454-D457 VanDerWaalsContact O-O 3.06Å; W454-L460 HydrophobicContact CB-CB 3.89Å; W454-L460 HydrophobicContact CB-CD1 4.39Å; W454-L460 HydrophobicContact CD2-CD1 4.48Å; W454-L460 HydrophobicContact CG-CB 4.12Å; W454-L460 HydrophobicContact CG-CD1 3.93Å; W454-S461 PolarHBondContact O-N 3.07Å; W454-S461 VanDerWaalsContact O-N 3.09Å; W454-V464 HydrophobicContact CB-CG2 4.23Å; W454-V464 HydrophobicContact CE3-CG2 3.56Å; W454-V464 HydrophobicContact CZ3-CG2 4.32Å; W454-M467 HydrophobicContact CZ3-CE 4.04Å; W454-M467 HydrophobicContact CZ3-SD 4.14Å
455	F	96.2	Very high	96.6	Very high	96 Å²	96	52.3 Å²	52.3	42%	0.421	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-74.2	-20.4	176.8	-63.3	-72.6	0	0	0	113.4	I450 N452 R453 D457 V464	I450-F455 HydrophobicContact CG2-CE2 3.86Å; I450-F455 HydrophobicContact CG2-CZ 3.88Å; N452-F455 WeakPolarHBondContact O-CD2 2.83Å; N452-F455 PolarHBondContact O-N 3.07Å; R453-F455 PolarHBondContact O-N 3.04Å; F455-D457 VanDerWaalsContact C-N 3.33Å; F455-V464 HydrophobicContact CE1-CB 4.43Å; F455-V464 HydrophobicContact CE1-CG1 3.67Å; F455-V464 HydrophobicContact CZ-CG1 3.95Å
456	S	93.8	Very high	96.6	Very high	99 Å²	99	46.8 Å²	46.8	69%	0.692	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-81	-15.3	175.2	-55.6	0	0	0	0	112.8	R453 W454	R453-S456 WeakPolarHBondContact O-CB 2.97Å; R453-S456 PolarHBondContact O-N 3.43Å; W454-S456 VanDerWaalsContact C-N 3.29Å; W454-S456 PolarHBondContact O-N 2.71Å
457	D	95.1	Very high	96.6	Very high	15 Å²	15	42.6 Å²	42.6	8%	0.08	23%	0.226	C	C	.	.	S	Bend	trans	-100.6	120.4	176.6	-176.4	-69.7	0	0	0	109.9	S413 W454 F455 T459 L460 S461	S413-D457 WeakPolarHBondContact CB-OD2 3.35Å; S413-D457 VanDerWaalsContact OG-CB 3.25Å; S413-D457 WeakPolarHBondContact OG-CB 3.29Å; S413-D457 VanDerWaalsContact OG-CG 3.3Å; S413-D457 PolarHBondContact OG-OD2 3.05Å; W454-D457 PolarHBondContact O-N 3.34Å; W454-D457 VanDerWaalsContact O-O 3.06Å; F455-D457 VanDerWaalsContact C-N 3.33Å; D457-T459 PolarHBondContact O-N 2.96Å; D457-T459 WeakPolarHBondContact OD1-CA 3.31Å; D457-T459 WeakPolarHBondContact OD1-CB 3.23Å; D457-T459 PolarHBondContact OD1-N 2.85Å; D457-L460 HydrophobicContact CB-CB 4.07Å; D457-L460 HydrophobicContact CB-CD1 4.33Å; D457-L460 HydrophobicContact CB-CG 4.19Å; D457-L460 PolarHBondContact O-N 2.98Å; D457-L460 PolarHBondContact OD1-N 2.84Å; D457-S461 WeakPolarHBondContact O-CB 3.26Å; D457-S461 PolarHBondContact O-N 3.35Å
458	P	94.7	Very high	96.6	Very high	110 Å²	110	45.2 Å²	45.2	71%	0.714	24%	0.238	S	C	*	.	H	α-helix	trans	-58.6	-35	-176.9	-26.7	35.1	0	0	0	113.9	A462	P458-A462 WeakPolarHBondContact O-CB 3.33Å; P458-A462 PolarHBondContact O-N 2.04Å; P458-A462 VanDerWaalsContact O-N 3.09Å
459	T	95.3	Very high	96.6	Very high	14 Å²	14	48.6 Å²	48.6	9%	0.086	25%	0.254	C	S	.	.	H	α-helix	trans	-75.7	-50.9	-177.6	-61.2	0	0	0	0	110.7	T295 L299 D457 S461 A462 L463 I491	T295-T459 HydrophobicContact CG2-CG2 3.5Å; L299-T459 HydrophobicContact CD1-CG2 3.79Å; L299-T459 HydrophobicContact CD2-CG2 4.07Å; L299-T459 HydrophobicContact CG-CG2 4.11Å; D457-T459 PolarHBondContact O-N 2.96Å; D457-T459 WeakPolarHBondContact OD1-CA 3.31Å; D457-T459 WeakPolarHBondContact OD1-CB 3.23Å; D457-T459 PolarHBondContact OD1-N 2.85Å; T459-S461 VanDerWaalsContact C-N 3.29Å; T459-S461 PolarHBondContact O-N 3.06Å; T459-A462 WeakPolarHBondContact O-CB 3.47Å; T459-A462 PolarHBondContact O-N 2.99Å; T459-L463 PolarHBondContact O-N 2.79Å; T459-I491 HydrophobicContact CG2-CG2 3.8Å
460	L	96.3	Very high	96.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-36.5	177.2	-60.6	-175.5	0	0	0	111.1	A408 T411 S413 W454 D457 A462 L463 V464	A408-L460 HydrophobicContact CB-CD2 4.19Å; T411-L460 HydrophobicContact CG2-CD2 4.17Å; S413-L460 VanDerWaalsContact CB-CD1 3.48Å; W454-L460 HydrophobicContact CB-CB 3.89Å; W454-L460 HydrophobicContact CB-CD1 4.39Å; W454-L460 HydrophobicContact CD2-CD1 4.48Å; W454-L460 HydrophobicContact CG-CB 4.12Å; W454-L460 HydrophobicContact CG-CD1 3.93Å; D457-L460 HydrophobicContact CB-CB 4.07Å; D457-L460 HydrophobicContact CB-CD1 4.33Å; D457-L460 HydrophobicContact CB-CG 4.19Å; D457-L460 PolarHBondContact O-N 2.98Å; D457-L460 PolarHBondContact OD1-N 2.84Å; L460-A462 VanDerWaalsContact C-N 3.31Å; L460-A462 PolarHBondContact O-N 3.28Å; L460-L463 HydrophobicContact CD2-CD1 4.17Å; L460-L463 CarbonylContact O-C 3.53Å; L460-L463 PolarHBondContact O-N 3.17Å; L460-V464 VanDerWaalsContact O-CG2 3.31Å; L460-V464 WeakPolarHBondContact O-CG2 3.15Å; L460-V464 PolarHBondContact O-N 2.01Å
461	S	97.3	Very high	96.7	Very high	24 Å²	24	43.3 Å²	43.3	17%	0.168	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-38.8	173.8	-174.6	0	0	0	0	112.1	W454 D457 T459 V464 K465	W454-S461 PolarHBondContact O-N 3.07Å; W454-S461 VanDerWaalsContact O-N 3.09Å; D457-S461 WeakPolarHBondContact O-CB 3.26Å; D457-S461 PolarHBondContact O-N 3.35Å; T459-S461 VanDerWaalsContact C-N 3.29Å; T459-S461 PolarHBondContact O-N 3.06Å; S461-V464 PolarHBondContact O-N 3.49Å; S461-K465 PolarHBondContact O-N 2.89Å
462	A	97.4	Very high	96.8	Very high	27 Å²	27	48 Å²	48	22%	0.223	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-41.1	173.1	0	0	0	0	0	112.3	P458 T459 L460 V464 K465 L466 I491	P458-A462 WeakPolarHBondContact O-CB 3.33Å; P458-A462 PolarHBondContact O-N 2.04Å; P458-A462 VanDerWaalsContact O-N 3.09Å; T459-A462 WeakPolarHBondContact O-CB 3.47Å; T459-A462 PolarHBondContact O-N 2.99Å; L460-A462 VanDerWaalsContact C-N 3.31Å; L460-A462 PolarHBondContact O-N 3.28Å; A462-V464 VanDerWaalsContact C-N 3.32Å; A462-V464 PolarHBondContact O-N 3.32Å; A462-K465 PolarHBondContact O-N 3.02Å; A462-L466 PolarHBondContact O-N 3.45Å; A462-L466 VanDerWaalsContact O-N 3.11Å; A462-I491 HydrophobicContact CB-CD1 3.67Å; A462-I491 HydrophobicContact CB-CG1 3.78Å; A462-I491 HydrophobicContact CB-CG2 4.44Å
463	L	97.8	Very high	96.9	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-36.5	173.5	-71.2	177.7	0	0	0	112.1	L299 A408 T459 L460 K465 L466 M467 L488 I491	L299-L463 HydrophobicContact CD2-CD1 4.13Å; L299-L463 HydrophobicContact CD2-CD2 4.02Å; L299-L463 HydrophobicContact CD2-CG 4.28Å; A408-L463 HydrophobicContact CB-CD1 4.47Å; T459-L463 PolarHBondContact O-N 2.79Å; L460-L463 HydrophobicContact CD2-CD1 4.17Å; L460-L463 CarbonylContact O-C 3.53Å; L460-L463 PolarHBondContact O-N 3.17Å; L463-K465 VanDerWaalsContact C-N 3.34Å; L463-K465 PolarHBondContact O-N 3.06Å; L463-L466 HydrophobicContact CD2-CD2 4.16Å; L463-L466 WeakPolarHBondContact O-CB 3.49Å; L463-L466 PolarHBondContact O-N 3.24Å; L463-M467 HydrophobicContact CB-CE 3.91Å; L463-M467 VanDerWaalsContact O-CG 3.28Å; L463-M467 WeakPolarHBondContact O-CG 3.35Å; L463-M467 PolarHBondContact O-N 3.43Å; L463-L488 HydrophobicContact CD2-CD2 3.55Å; L463-I491 HydrophobicContact CD2-CD1 4.36Å
464	V	98.3	Very high	97.1	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-44.1	174.3	165.8	0	0	0	0	111.4	I450 W454 F455 L460 S461 A462 L466 M467 K468	I450-V464 HydrophobicContact CD1-CG1 3.77Å; I450-V464 HydrophobicContact CG2-CG1 4.25Å; I450-V464 HydrophobicContact CG2-CG2 3.61Å; W454-V464 HydrophobicContact CB-CG2 4.23Å; W454-V464 HydrophobicContact CE3-CG2 3.56Å; W454-V464 HydrophobicContact CZ3-CG2 4.32Å; F455-V464 HydrophobicContact CE1-CB 4.43Å; F455-V464 HydrophobicContact CE1-CG1 3.67Å; F455-V464 HydrophobicContact CZ-CG1 3.95Å; L460-V464 VanDerWaalsContact O-CG2 3.31Å; L460-V464 WeakPolarHBondContact O-CG2 3.15Å; L460-V464 PolarHBondContact O-N 2.01Å; S461-V464 PolarHBondContact O-N 3.49Å; A462-V464 VanDerWaalsContact C-N 3.32Å; A462-V464 PolarHBondContact O-N 3.32Å; V464-L466 VanDerWaalsContact C-N 3.31Å; V464-L466 PolarHBondContact O-N 2.84Å; V464-M467 PolarHBondContact O-N 2.83Å; V464-K468 HydrophobicContact CG1-CD 4.21Å; V464-K468 WeakPolarHBondContact O-CB 3.06Å; V464-K468 WeakPolarHBondContact O-CG 3.33Å; V464-K468 PolarHBondContact O-N 3.22Å
465	K	98.1	Very high	97.2	Very high	131 Å²	131	47.8 Å²	47.8	57%	0.57	25%	0.249	S	C	*	.	H	α-helix	trans	-60.9	-45.1	176.2	-67.1	173.2	-175	176	0	110.5	S461 A462 L463 K468 E469	S461-K465 PolarHBondContact O-N 2.89Å; A462-K465 PolarHBondContact O-N 3.02Å; L463-K465 VanDerWaalsContact C-N 3.34Å; L463-K465 PolarHBondContact O-N 3.06Å; K465-K468 WeakPolarHBondContact O-CB 3.44Å; K465-K468 PolarHBondContact O-N 3.34Å; K465-E469 WeakPolarHBondContact O-CG 3.32Å; K465-E469 PolarHBondContact O-N 2.88Å
466	L	98.1	Very high	97.2	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-47.6	177.8	-173.5	68	0	0	0	112.3	L404 A462 L463 V464 K468 E469 C470 L479 I484 T487 L488	L404-L466 HydrophobicContact CD1-CD2 3.83Å; L404-L466 HydrophobicContact CD1-CG 4.09Å; A462-L466 PolarHBondContact O-N 3.45Å; A462-L466 VanDerWaalsContact O-N 3.11Å; L463-L466 HydrophobicContact CD2-CD2 4.16Å; L463-L466 WeakPolarHBondContact O-CB 3.49Å; L463-L466 PolarHBondContact O-N 3.24Å; V464-L466 VanDerWaalsContact C-N 3.31Å; V464-L466 PolarHBondContact O-N 2.84Å; L466-K468 VanDerWaalsContact C-N 3.29Å; L466-K468 PolarHBondContact O-N 2.78Å; L466-E469 PolarHBondContact O-N 2.92Å; L466-C470 PolarHBondContact O-N 2.76Å; L466-C470 VanDerWaalsContact O-N 3.08Å; L466-C470 PolarHBondContact O-SG 2.9Å; L466-L479 HydrophobicContact CD1-CD1 3.51Å; L466-I484 HydrophobicContact CD1-CB 4.3Å; L466-I484 HydrophobicContact CD1-CG1 4.04Å; L466-I484 HydrophobicContact CD1-CG2 4.07Å; L466-I484 HydrophobicContact CD2-CG2 3.96Å; L466-I484 HydrophobicContact CG-CG2 4.31Å; L466-T487 HydrophobicContact CD1-CG2 4.08Å; L466-L488 HydrophobicContact CD2-CD2 3.66Å; L466-L488 HydrophobicContact CD2-CG 3.89Å
467	M	98.6	Very high	97.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-43	175.1	-68.1	171.7	-151.7	0	0	111.2	L404 W405 A408 W454 L463 V464 E469 C470 W471	L404-M467 HydrophobicContact CB-CE 4.13Å; L404-M467 HydrophobicContact CB-CG 3.9Å; L404-M467 VanDerWaalsContact O-CE 3.27Å; L404-M467 WeakPolarHBondContact O-CE 3.26Å; W405-M467 HydrophobicContact CB-CE 4.47Å; W405-M467 HydrophobicContact CB-SD 3.75Å; W405-M467 HydrophobicContact CG-SD 4.4Å; A408-M467 HydrophobicContact CB-CE 3.49Å; A408-M467 VanDerWaalsContact CB-CE 3.49Å; W454-M467 HydrophobicContact CZ3-CE 4.04Å; W454-M467 HydrophobicContact CZ3-SD 4.14Å; L463-M467 HydrophobicContact CB-CE 3.91Å; L463-M467 VanDerWaalsContact O-CG 3.28Å; L463-M467 WeakPolarHBondContact O-CG 3.35Å; L463-M467 PolarHBondContact O-N 3.43Å; V464-M467 PolarHBondContact O-N 2.83Å; M467-E469 VanDerWaalsContact C-N 3.26Å; M467-E469 PolarHBondContact O-N 3.12Å; M467-C470 WeakPolarHBondContact O-CB 3.18Å; M467-C470 PolarHBondContact O-N 2.98Å; M467-W471 PolarHBondContact O-N 3.14Å; M467-W471 VanDerWaalsContact O-N 3.09Å
468	K	98.3	Very high	97.6	Very high	94 Å²	94	44.4 Å²	44.4	41%	0.409	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-37.6	178.4	-76.7	-179.2	177	-174.6	0	113.3	V464 K465 L466 C470 W471	V464-K468 HydrophobicContact CG1-CD 4.21Å; V464-K468 WeakPolarHBondContact O-CB 3.06Å; V464-K468 WeakPolarHBondContact O-CG 3.33Å; V464-K468 PolarHBondContact O-N 3.22Å; K465-K468 WeakPolarHBondContact O-CB 3.44Å; K465-K468 PolarHBondContact O-N 3.34Å; L466-K468 VanDerWaalsContact C-N 3.29Å; L466-K468 PolarHBondContact O-N 2.78Å; K468-C470 VanDerWaalsContact C-N 3.33Å; K468-W471 VanDerWaalsContact CA-NE1 3.32Å; K468-W471 HydrophobicContact CG-CZ2 4.04Å
469	E	98.5	Very high	97.8	Very high	76 Å²	76	40.4 Å²	40.4	36%	0.355	21%	0.211	S	C	.	.	H	α-helix	trans	-79.5	-14.3	176.5	-63.2	172.5	-164.1	0	0	113.2	K465 L466 M467 Y472 R478 L479	K465-E469 WeakPolarHBondContact O-CG 3.32Å; K465-E469 PolarHBondContact O-N 2.88Å; L466-E469 PolarHBondContact O-N 2.92Å; M467-E469 VanDerWaalsContact C-N 3.26Å; M467-E469 PolarHBondContact O-N 3.12Å; E469-Y472 HydrophobicContact CB-CE2 4.09Å; E469-Y472 HydrophobicContact CG-CE2 4.09Å; E469-R478 WeakPolarHBondContact O-CA 3.46Å; E469-L479 HydrophobicContact CB-CD1 3.72Å; E469-L479 HydrophobicContact CB-CD2 4.24Å; E469-L479 HydrophobicContact CB-CG 3.7Å; E469-L479 PolarHBondContact O-N 2.82Å; E469-L479 WeakPolarHBondContact OE2-CD1 3.35Å; E469-L479 WeakPolarHBondContact OE2-CD2 3.27Å
470	C	98.7	Very high	97.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-84.5	-34.6	173.4	-64.7	0	0	0	0	112.7	I397 L466 M467 K468 R478 I484	I397-C470 HydrophobicContact CG2-CB 4.04Å; L466-C470 PolarHBondContact O-N 2.76Å; L466-C470 VanDerWaalsContact O-N 3.08Å; L466-C470 PolarHBondContact O-SG 2.9Å; M467-C470 WeakPolarHBondContact O-CB 3.18Å; M467-C470 PolarHBondContact O-N 2.98Å; K468-C470 VanDerWaalsContact C-N 3.33Å; C470-R478 WeakPolarHBondContact O-CD 3.42Å; C470-R478 WeakPolarHBondContact O-CG 3.08Å; C470-I484 VanDerWaalsContact SG-CD1 3.55Å
471	W	96.8	Very high	98	Very high	17 Å²	17	44 Å²	44	6%	0.064	23%	0.234	C	C	.	.	S	Bend	trans	-102.6	29.8	-173.3	67.7	17.2	0	0	0	114.4	W398 L402 R447 P448 I450 M467 K468	W398-W471 HydrophobicContact CD2-CB 4.39Å; W398-W471 VanDerWaalsContact CE3-CA 3.46Å; W398-W471 HydrophobicContact CE3-CB 3.76Å; W398-W471 HydrophobicContact CH2-CB 4.2Å; W398-W471 HydrophobicContact CZ3-CB 3.67Å; W398-W471 WeakPolarHBondContact CZ3-O 3.03Å; L402-W471 HydrophobicContact CD2-CE3 4.23Å; R447-W471 HydrophobicContact CB-CD2 3.94Å; R447-W471 HydrophobicContact CB-CE3 3.96Å; R447-W471 HydrophobicContact CB-CH2 3.78Å; R447-W471 HydrophobicContact CB-CZ2 3.73Å; R447-W471 HydrophobicContact CB-CZ3 3.91Å; R447-W471 HydrophobicContact CG-CD2 3.85Å; R447-W471 HydrophobicContact CG-CE3 4.31Å; R447-W471 HydrophobicContact CG-CG 4.16Å; R447-W471 HydrophobicContact CG-CZ2 4.2Å; R447-W471 PolarHBondContact NE-O 2.04Å; R447-W471 PolarHBondContact NH2-O 3.25Å; P448-W471 HydrophobicContact CB-CH2 4.42Å; P448-W471 HydrophobicContact CB-CZ3 3.88Å; P448-W471 HydrophobicContact CG-CE3 4.25Å; P448-W471 HydrophobicContact CG-CZ3 3.68Å; P448-W471 WeakPolarHBondContact O-CH2 3.4Å; I450-W471 HydrophobicContact CD1-CH2 3.89Å; I450-W471 HydrophobicContact CD1-CZ2 3.83Å; I450-W471 HydrophobicContact CG1-CH2 4.15Å; M467-W471 PolarHBondContact O-N 3.14Å; M467-W471 VanDerWaalsContact O-N 3.09Å; K468-W471 VanDerWaalsContact CA-NE1 3.32Å; K468-W471 HydrophobicContact CG-CZ2 4.04Å
472	Y	98.4	Very high	98.1	Very high	111 Å²	111	46.9 Å²	46.9	44%	0.435	25%	0.247	S	C	.	.			trans	-60.4	143.5	171.9	-81.7	-59.5	0	0	0	111.2	E469 A477 R478	E469-Y472 HydrophobicContact CB-CE2 4.09Å; E469-Y472 HydrophobicContact CG-CE2 4.09Å; Y472-A477 HydrophobicContact CD2-CB 3.88Å; Y472-A477 WeakPolarHBondContact CD2-O 3.45Å; Y472-A477 HydrophobicContact CE2-CB 4.5Å; Y472-A477 HydrophobicContact CG-CB 4.04Å; Y472-R478 PolarHBondContact O-NE 3.39Å; Y472-R478 PolarHBondContact O-NH2 2.91Å
473	Q	97.5	Very high	98.1	Very high	55 Å²	55	52.6 Å²	52.6	26%	0.257	26%	0.263	S	S	.	.	S	Bend	trans	-61.6	-48.2	174.3	-167.8	68.6	17.1	0	0	110.7	P475 R478	Q473-P475 VanDerWaalsContact O-CD 3.27Å; Q473-P475 WeakPolarHBondContact O-CD 3.49Å; Q473-R478 PolarHBondContact O-NH2 2.9Å
474	N	97.9	Very high	98.2	Very high	94 Å²	94	52.4 Å²	52.4	50%	0.503	26%	0.262	S	S	.	.	S	Bend	trans	-71.7	116.5	173.6	-178.6	-8.2	0	0	0	110	S476 A477	N474-S476 VanDerWaalsContact C-N 3.28Å; N474-S476 PolarHBondContact O-N 2.84Å; N474-S476 WeakPolarHBondContact OD1-CB 3.25Å; N474-S476 PolarHBondContact OD1-N 2.87Å; N474-A477 HydrophobicContact CB-CB 4.3Å; N474-A477 PolarHBondContact O-N 3.32Å
475	P	97.9	Very high	98.2	Very high	30 Å²	30	55.3 Å²	55.3	20%	0.195	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-62.1	-33.7	-178.4	-22.8	35	0	0	0	113.1	E378 R394 Q473 A477 R478	E378-P475 HydrophobicContact CB-CG 4.21Å; E378-P475 VanDerWaalsContact CD-CG 3.45Å; E378-P475 HydrophobicContact CG-CG 3.97Å; E378-P475 WeakPolarHBondContact OE1-CG 3.4Å; R394-P475 HydrophobicContact CB-CB 4.02Å; R394-P475 WeakPolarHBondContact CD-O 3.48Å; R394-P475 HydrophobicContact CG-CB 4.48Å; Q473-P475 VanDerWaalsContact O-CD 3.27Å; Q473-P475 WeakPolarHBondContact O-CD 3.49Å; P475-A477 PolarHBondContact O-N 3.05Å; P475-R478 WeakPolarHBondContact O-CB 3.34Å; P475-R478 PolarHBondContact O-N 2.99Å
476	S	96.9	Very high	98.1	Very high	76 Å²	76	55.2 Å²	55.2	53%	0.531	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-67.5	-19.5	-179.5	-58.8	0	0	0	0	113.5	R394 N474 R478	R394-S476 VanDerWaalsContact NH1-CA 3.35Å; R394-S476 PolarHBondContact NH1-OG 3.08Å; N474-S476 VanDerWaalsContact C-N 3.28Å; N474-S476 PolarHBondContact O-N 2.84Å; N474-S476 WeakPolarHBondContact OD1-CB 3.25Å; N474-S476 PolarHBondContact OD1-N 2.87Å; S476-R478 VanDerWaalsContact C-N 3.34Å
477	A	97.9	Very high	98.2	Very high	48 Å²	48	57 Å²	57	40%	0.397	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-85.3	-9.7	177.9	0	0	0	0	0	112.9	Y472 N474 P475	Y472-A477 HydrophobicContact CD2-CB 3.88Å; Y472-A477 WeakPolarHBondContact CD2-O 3.45Å; Y472-A477 HydrophobicContact CE2-CB 4.5Å; Y472-A477 HydrophobicContact CG-CB 4.04Å; N474-A477 HydrophobicContact CB-CB 4.3Å; N474-A477 PolarHBondContact O-N 3.32Å; P475-A477 PolarHBondContact O-N 3.05Å
478	R	98.6	Very high	98.1	Very high	15 Å²	15	57 Å²	57	6%	0.057	29%	0.285	C	S	.	.	S	Bend	trans	-73.6	149.2	-178.7	-61.2	177.5	-169	146.5	14.2	111.1	E378 R394 I397 E469 C470 Y472 Q473 P475 S476	E378-R478 IonicContact OE1-CZ 2.68Å; E378-R478 IonicContact OE1-NH1 2.65Å; E378-R478 PolarHBondContact OE1-NH1 3.46Å; E378-R478 IonicContact OE1-NH2 2.71Å; E378-R478 PolarHBondContact OE1-NH2 2.95Å; E378-R478 IonicContact OE2-CZ 2.87Å; E378-R478 IonicContact OE2-NH1 2.83Å; E378-R478 PolarHBondContact OE2-NH1 2.91Å; E378-R478 IonicContact OE2-NH2 3.44Å; E378-R478 PolarHBondContact OE2-NH2 2.93Å; R394-R478 PolarHBondContact O-NH1 2.96Å; I397-R478 HydrophobicContact CG2-CB 4.04Å; E469-R478 WeakPolarHBondContact O-CA 3.46Å; C470-R478 WeakPolarHBondContact O-CD 3.42Å; C470-R478 WeakPolarHBondContact O-CG 3.08Å; Y472-R478 PolarHBondContact O-NE 3.39Å; Y472-R478 PolarHBondContact O-NH2 2.91Å; Q473-R478 PolarHBondContact O-NH2 2.9Å; P475-R478 WeakPolarHBondContact O-CB 3.34Å; P475-R478 PolarHBondContact O-N 2.99Å; S476-R478 VanDerWaalsContact C-N 3.34Å
479	L	98.3	Very high	98	Very high	26 Å²	26	55.6 Å²	55.6	14%	0.136	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-63.3	157.9	174.5	-60.8	177.7	0	0	0	111.9	I397 L466 E469 R483 I484	I397-L479 WeakPolarHBondContact CG1-O 3.39Å; I397-L479 WeakPolarHBondContact CG2-O 3.01Å; L466-L479 HydrophobicContact CD1-CD1 3.51Å; E469-L479 HydrophobicContact CB-CD1 3.72Å; E469-L479 HydrophobicContact CB-CD2 4.24Å; E469-L479 HydrophobicContact CB-CG 3.7Å; E469-L479 PolarHBondContact O-N 2.82Å; E469-L479 WeakPolarHBondContact OE2-CD1 3.35Å; E469-L479 WeakPolarHBondContact OE2-CD2 3.27Å; L479-R483 HydrophobicContact CD2-CG 3.83Å; L479-I484 HydrophobicContact CB-CD1 4.19Å; L479-I484 HydrophobicContact CB-CG1 3.75Å; L479-I484 HydrophobicContact CD1-CG1 3.87Å
480	T	98.6	Very high	97.9	Very high	87 Å²	87	59.3 Å²	59.3	53%	0.534	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-85.6	156.5	165.5	64.8	0	0	0	0	110.3	L482 R483 I484	T480-L482 PolarHBondContact O-N 2.98Å; T480-R483 PolarHBondContact O-N 2.02Å; T480-R483 WeakPolarHBondContact OG1-CB 2.99Å; T480-R483 PolarHBondContact OG1-N 3.03Å; T480-I484 WeakPolarHBondContact O-CG1 3.01Å; T480-I484 PolarHBondContact O-N 2.99Å
481	A	98.6	Very high	97.7	Very high	3 Å²	3	60 Å²	60	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-54.6	-38.5	175.9	0	0	0	0	0	111.5	L309 V310 I397 R483 I484 K485	L309-A481 HydrophobicContact CB-CB 4.19Å; L309-A481 HydrophobicContact CD2-CB 4.13Å; L309-A481 HydrophobicContact CG-CB 4.01Å; V310-A481 HydrophobicContact CG2-CB 3.69Å; V310-A481 WeakPolarHBondContact CG2-O 3.04Å; I397-A481 HydrophobicContact CD1-CB 3.98Å; I397-A481 VanDerWaalsContact CD1-N 3.31Å; A481-R483 PolarHBondContact O-N 2.01Å; A481-I484 PolarHBondContact O-N 3.1Å; A481-K485 PolarHBondContact O-N 3.23Å
482	L	98.4	Very high	97.6	Very high	85 Å²	85	62.5 Å²	62.5	45%	0.445	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-39	178.5	-179.4	61.4	0	0	0	112.2	V310 T480 K486	V310-L482 HydrophobicContact CG1-CD1 4.37Å; V310-L482 VanDerWaalsContact CG2-CA 3.49Å; V310-L482 HydrophobicContact CG2-CB 4.16Å; V310-L482 VanDerWaalsContact CG2-N 3.33Å; T480-L482 PolarHBondContact O-N 2.98Å; L482-K486 WeakPolarHBondContact O-CG 3.47Å; L482-K486 PolarHBondContact O-N 2.93Å; L482-K486 VanDerWaalsContact O-N 3.12Å
483	R	98.4	Very high	97.2	Very high	147 Å²	147	60.4 Å²	60.4	56%	0.555	31%	0.314	S	S	*	.	H	α-helix	trans	-68.6	-38.7	176.4	-178.3	56.1	177.7	-165.3	-1	111.3	L479 T480 A481 T487	L479-R483 HydrophobicContact CD2-CG 3.83Å; T480-R483 PolarHBondContact O-N 2.02Å; T480-R483 WeakPolarHBondContact OG1-CB 2.99Å; T480-R483 PolarHBondContact OG1-N 3.03Å; A481-R483 PolarHBondContact O-N 2.01Å; R483-T487 WeakPolarHBondContact O-CB 3.48Å; R483-T487 PolarHBondContact O-N 3.45Å; R483-T487 VanDerWaalsContact O-N 3.07Å; R483-T487 PolarHBondContact O-OG1 3.21Å
484	I	98.6	Very high	96.9	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.6	-50.7	175.2	-64.7	168.6	0	0	0	110.3	A306 I397 F400 L466 C470 L479 T480 A481 K486 T487 L488	A306-I484 HydrophobicContact CB-CG2 4.35Å; I397-I484 HydrophobicContact CD1-CD1 3.72Å; I397-I484 HydrophobicContact CG2-CD1 4Å; F400-I484 HydrophobicContact CD1-CD1 3.93Å; F400-I484 HydrophobicContact CD1-CG2 4.26Å; F400-I484 HydrophobicContact CE1-CB 4.44Å; F400-I484 HydrophobicContact CE1-CD1 4.29Å; F400-I484 HydrophobicContact CE1-CG2 3.55Å; F400-I484 HydrophobicContact CZ-CG2 4.41Å; L466-I484 HydrophobicContact CD1-CB 4.3Å; L466-I484 HydrophobicContact CD1-CG1 4.04Å; L466-I484 HydrophobicContact CD1-CG2 4.07Å; L466-I484 HydrophobicContact CD2-CG2 3.96Å; L466-I484 HydrophobicContact CG-CG2 4.31Å; C470-I484 VanDerWaalsContact SG-CD1 3.55Å; L479-I484 HydrophobicContact CB-CD1 4.19Å; L479-I484 HydrophobicContact CB-CG1 3.75Å; L479-I484 HydrophobicContact CD1-CG1 3.87Å; T480-I484 WeakPolarHBondContact O-CG1 3.01Å; T480-I484 PolarHBondContact O-N 2.99Å; A481-I484 PolarHBondContact O-N 3.1Å; I484-K486 PolarHBondContact O-N 2.79Å; I484-T487 WeakPolarHBondContact O-CA 3.03Å; I484-T487 WeakPolarHBondContact O-CB 3.43Å; I484-T487 PolarHBondContact O-N 3.15Å; I484-L488 HydrophobicContact CG2-CD1 3.81Å; I484-L488 HydrophobicContact CG2-CG 4.29Å; I484-L488 WeakPolarHBondContact O-CG 3.49Å; I484-L488 PolarHBondContact O-N 3.16Å
485	K	98.2	Very high	96.5	Very high	64 Å²	64	58.1 Å²	58.1	28%	0.278	31%	0.309	S	S	.	.	H	α-helix	trans	-49.9	-56.7	175.4	-178.9	-156	167.7	159.6	0	111.5	A306 N307 V310 A481 T487 L488 D489	A306-K485 HydrophobicContact CB-CB 4.12Å; N307-K485 WeakPolarHBondContact OD1-CD 3.5Å; N307-K485 WeakPolarHBondContact OD1-CE 3.38Å; N307-K485 VanDerWaalsContact OD1-CG 3.32Å; N307-K485 WeakPolarHBondContact OD1-CG 3.5Å; N307-K485 PolarHBondContact OD1-NZ 3.36Å; V310-K485 HydrophobicContact CG2-CB 4.31Å; A481-K485 PolarHBondContact O-N 3.23Å; K485-T487 PolarHBondContact O-N 2.9Å; K485-T487 VanDerWaalsContact O-N 3.15Å; K485-L488 PolarHBondContact O-N 3.03Å; K485-L488 VanDerWaalsContact O-N 3.08Å; K485-D489 WeakPolarHBondContact CE-OD2 3.32Å; K485-D489 PolarHBondContact O-N 2.9Å
486	K	98.1	Very high	96	Very high	128 Å²	128	60 Å²	60	56%	0.557	32%	0.315	S	S	*	.	H	α-helix	trans	-58	-32.8	-179.3	-73.1	-176.6	176.5	-175.6	0	112.8	L482 I484 K490	L482-K486 WeakPolarHBondContact O-CG 3.47Å; L482-K486 PolarHBondContact O-N 2.93Å; L482-K486 VanDerWaalsContact O-N 3.12Å; I484-K486 PolarHBondContact O-N 2.79Å; K486-K490 PolarHBondContact O-N 3.47Å
487	T	98.1	Very high	95.4	Very high	40 Å²	40	63.4 Å²	63.4	25%	0.245	32%	0.32	C	S	.	.	H	α-helix	trans	-73.1	-43	178.2	-54.5	0	0	0	0	110.9	L466 R483 I484 K485 K490 I491	L466-T487 HydrophobicContact CD1-CG2 4.08Å; R483-T487 WeakPolarHBondContact O-CB 3.48Å; R483-T487 PolarHBondContact O-N 3.45Å; R483-T487 VanDerWaalsContact O-N 3.07Å; R483-T487 PolarHBondContact O-OG1 3.21Å; I484-T487 WeakPolarHBondContact O-CA 3.03Å; I484-T487 WeakPolarHBondContact O-CB 3.43Å; I484-T487 PolarHBondContact O-N 3.15Å; K485-T487 PolarHBondContact O-N 2.9Å; K485-T487 VanDerWaalsContact O-N 3.15Å; T487-K490 WeakPolarHBondContact O-CB 3.5Å; T487-K490 PolarHBondContact O-N 3.19Å; T487-I491 HydrophobicContact CG2-CD1 4.12Å; T487-I491 VanDerWaalsContact O-CG1 3.28Å; T487-I491 WeakPolarHBondContact O-CG1 3.28Å; T487-I491 PolarHBondContact O-N 3.48Å
488	L	98	Very high	94.3	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-61.4	-43.8	174.4	-70	168.7	0	0	0	111.8	L299 A302 A303 A306 L463 L466 I484 K485 K490 I491 H492	L299-L488 HydrophobicContact CD2-CD2 4.29Å; A302-L488 HydrophobicContact CB-CD1 4.06Å; A302-L488 HydrophobicContact CB-CD2 4.09Å; A303-L488 HydrophobicContact CB-CB 4.4Å; A306-L488 HydrophobicContact CB-CD1 3.94Å; L463-L488 HydrophobicContact CD2-CD2 3.55Å; L466-L488 HydrophobicContact CD2-CD2 3.66Å; L466-L488 HydrophobicContact CD2-CG 3.89Å; I484-L488 HydrophobicContact CG2-CD1 3.81Å; I484-L488 HydrophobicContact CG2-CG 4.29Å; I484-L488 WeakPolarHBondContact O-CG 3.49Å; I484-L488 PolarHBondContact O-N 3.16Å; K485-L488 PolarHBondContact O-N 3.03Å; K485-L488 VanDerWaalsContact O-N 3.08Å; L488-K490 VanDerWaalsContact C-N 3.27Å; L488-K490 PolarHBondContact O-N 2.92Å; L488-I491 PolarHBondContact O-N 3.28Å; L488-I491 VanDerWaalsContact O-N 3.15Å; L488-H492 WeakPolarHBondContact O-CB 3.35Å; L488-H492 PolarHBondContact O-N 3.16Å
489	D	95.4	Very high	93.1	Very high	65 Å²	65	68.3 Å²	68.3	35%	0.348	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-40.2	176	-65.9	-22.8	0	0	0	111.6	K485 S493	K485-D489 WeakPolarHBondContact CE-OD2 3.32Å; K485-D489 PolarHBondContact O-N 2.9Å; D489-S493 WeakPolarHBondContact O-CB 3.41Å; D489-S493 PolarHBondContact O-N 3.31Å; D489-S493 PolarHBondContact O-OG 3.09Å
490	K	96.4	Very high	91.3	Very high	153 Å²	153	75.3 Å²	75.3	67%	0.665	38%	0.379	S	S	*	.	H	α-helix	trans	-68.2	-41.5	176.3	-175.6	179	178.5	-178.8	0	112.2	K486 T487 L488 S493 S494	K486-K490 PolarHBondContact O-N 3.47Å; T487-K490 WeakPolarHBondContact O-CB 3.5Å; T487-K490 PolarHBondContact O-N 3.19Å; L488-K490 VanDerWaalsContact C-N 3.27Å; L488-K490 PolarHBondContact O-N 2.92Å; K490-S493 PolarHBondContact O-N 3.39Å; K490-S494 PolarHBondContact O-N 3.06Å; K490-S494 PolarHBondContact O-OG 3.2Å
491	I	95.6	Very high	88.9	Confident	15 Å²	15	78 Å²	78	8%	0.077	40%	0.401	C	S	.	.	H	α-helix	trans	-62.8	-47.5	176.4	-66.4	164.7	0	0	0	109.5	L299 T459 A462 L463 T487 L488 S493 S494 L495	L299-I491 HydrophobicContact CD1-CG2 4Å; L299-I491 HydrophobicContact CD2-CG2 3.85Å; T459-I491 HydrophobicContact CG2-CG2 3.8Å; A462-I491 HydrophobicContact CB-CD1 3.67Å; A462-I491 HydrophobicContact CB-CG1 3.78Å; A462-I491 HydrophobicContact CB-CG2 4.44Å; L463-I491 HydrophobicContact CD2-CD1 4.36Å; T487-I491 HydrophobicContact CG2-CD1 4.12Å; T487-I491 VanDerWaalsContact O-CG1 3.28Å; T487-I491 WeakPolarHBondContact O-CG1 3.28Å; T487-I491 PolarHBondContact O-N 3.48Å; L488-I491 PolarHBondContact O-N 3.28Å; L488-I491 VanDerWaalsContact O-N 3.15Å; I491-S493 PolarHBondContact O-N 3.16Å; I491-S494 WeakPolarHBondContact O-CB 3.34Å; I491-S494 PolarHBondContact O-N 3.5Å; I491-S494 VanDerWaalsContact O-N 3.08Å; I491-L495 PolarHBondContact O-N 2.86Å
492	H	92.8	Very high	88.4	Confident	70 Å²	70	81.8 Å²	81.8	32%	0.324	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-45.6	178.2	-169.5	69.1	0	0	0	112	L299 L488 S494 L495 E496	L299-H492 HydrophobicContact CD1-CB 4.29Å; L488-H492 WeakPolarHBondContact O-CB 3.35Å; L488-H492 PolarHBondContact O-N 3.16Å; H492-S494 PolarHBondContact O-N 3.16Å; H492-L495 WeakPolarHBondContact O-CB 3.35Å; H492-L495 PolarHBondContact O-N 2.81Å; H492-L495 VanDerWaalsContact O-N 3.17Å; H492-E496 PolarHBondContact O-N 3.38Å; H492-E496 VanDerWaalsContact O-N 3.13Å
493	S	91.8	Very high	87.8	Confident	66 Å²	66	81.6 Å²	81.6	46%	0.462	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-30.2	176	-60.5	0	0	0	0	113.3	D489 K490 I491 K497	D489-S493 WeakPolarHBondContact O-CB 3.41Å; D489-S493 PolarHBondContact O-N 3.31Å; D489-S493 PolarHBondContact O-OG 3.09Å; K490-S493 PolarHBondContact O-N 3.39Å; I491-S493 PolarHBondContact O-N 3.16Å; S493-K497 WeakPolarHBondContact O-CG 3.47Å; S493-K497 PolarHBondContact O-N 3.17Å
494	S	91.5	Very high	87.3	Confident	69 Å²	69	78 Å²	78	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-75.5	-34.4	176.8	-54.4	0	0	0	0	111.6	K490 I491 H492 G498	K490-S494 PolarHBondContact O-N 3.06Å; K490-S494 PolarHBondContact O-OG 3.2Å; I491-S494 WeakPolarHBondContact O-CB 3.34Å; I491-S494 PolarHBondContact O-N 3.5Å; I491-S494 VanDerWaalsContact O-N 3.08Å; H492-S494 PolarHBondContact O-N 3.16Å; S494-G498 PolarHBondContact O-N 2.64Å
495	L	89.4	Confident	86.6	Confident	33 Å²	33	82.6 Å²	82.6	17%	0.173	44%	0.435	C	S	.	.	H	α-helix	trans	-63.3	-47.2	174.5	178.8	68.4	0	0	0	111.3	T295 L299 I491 H492 G498 K499	T295-L495 HydrophobicContact CG2-CD1 4.28Å; T295-L495 HydrophobicContact CG2-CD2 3.91Å; L299-L495 HydrophobicContact CD1-CD2 3.92Å; I491-L495 PolarHBondContact O-N 2.86Å; H492-L495 WeakPolarHBondContact O-CB 3.35Å; H492-L495 PolarHBondContact O-N 2.81Å; H492-L495 VanDerWaalsContact O-N 3.17Å; L495-G498 PolarHBondContact O-N 3.3Å; L495-K499 PolarHBondContact O-N 3.41Å
496	E	86.9	Confident	85.9	Confident	68 Å²	68	83.8 Å²	83.8	32%	0.318	45%	0.445	S	S	.	.	H	α-helix	trans	-65.2	-41.1	-178.3	-65.4	-55.3	123.5	0	0	111.9	H492 G498 K499 E500	H492-E496 PolarHBondContact O-N 3.38Å; H492-E496 VanDerWaalsContact O-N 3.13Å; E496-G498 VanDerWaalsContact C-N 3.26Å; E496-G498 PolarHBondContact O-N 3.14Å; E496-K499 PolarHBondContact O-N 3.36Å; E496-K499 VanDerWaalsContact O-N 3.08Å; E496-K499 IonicContact OE1-NZ 2.73Å; E496-K499 PolarHBondContact OE1-NZ 3.2Å; E496-K499 IonicContact OE2-NZ 3.64Å; E496-E500 PolarHBondContact O-N 3.25Å
497	K	83.4	Confident	85	Confident	148 Å²	148	80.8 Å²	80.8	64%	0.643	44%	0.438	S	S	*	.	H	α-helix	trans	-60	-34.6	173.7	-73.6	178.8	-179.2	-173.2	0	113.5	S493 K499 E500 S501	S493-K497 WeakPolarHBondContact O-CG 3.47Å; S493-K497 PolarHBondContact O-N 3.17Å; K497-K499 VanDerWaalsContact C-N 3.27Å; K497-K499 PolarHBondContact O-N 3.13Å; K497-E500 PolarHBondContact O-N 3.47Å; K497-S501 PolarHBondContact O-N 3.24Å
498	G	75.3	Confident	84.1	Confident	47 Å²	47	83.7 Å²	83.7	49%	0.485	45%	0.451	S	S	.	.	H	α-helix	trans	-74.5	-13.5	178.3	0	0	0	0	0	114.3	S494 L495 E496 S501	S494-G498 PolarHBondContact O-N 2.64Å; L495-G498 PolarHBondContact O-N 3.3Å; E496-G498 VanDerWaalsContact C-N 3.26Å; E496-G498 PolarHBondContact O-N 3.14Å; G498-S501 PolarHBondContact O-OG 3.1Å
499	K	73.2	Confident	83	Confident	120 Å²	120	90.1 Å²	90.1	52%	0.522	49%	0.486	S	S	.	.	H	α-helix	trans	-87.4	-24.6	172.4	-67.6	174.8	-178.2	164.3	0	112.6	L495 E496 K497	L495-K499 PolarHBondContact O-N 3.41Å; E496-K499 PolarHBondContact O-N 3.36Å; E496-K499 VanDerWaalsContact O-N 3.08Å; E496-K499 IonicContact OE1-NZ 2.73Å; E496-K499 PolarHBondContact OE1-NZ 3.2Å; E496-K499 IonicContact OE2-NZ 3.64Å; K497-K499 VanDerWaalsContact C-N 3.27Å; K497-K499 PolarHBondContact O-N 3.13Å
500	E	59.9	Low	82	Confident	173 Å²	173	92.2 Å²	92.2	81%	0.808	50%	0.497	S	S	*	.	H	α-helix	trans	-85.1	-17.3	179.7	-67.2	179.6	167.4	0	0	113.2	E496 K497	E496-E500 PolarHBondContact O-N 3.25Å; K497-E500 PolarHBondContact O-N 3.47Å
501	S	48.2	Very low	80.7	Confident	144 Å²	144	86.6 Å²	86.6	100%	1.007	48%	0.482	S	S	*	.			trans	-95.4	0	174.8	64.2	0	0	0	0	112	K497 G498	K497-S501 PolarHBondContact O-N 3.24Å; G498-S501 PolarHBondContact O-OG 3.1Å

Retrieved 501 of 501 residues in 207.4 ms (Link to these results)

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