A0A087XLL0_POEFO Loading...

AarF domain-containing protein kinase 1

Appears to be essential for maintaining mitochondrial cristae formation and mitochondrial function by acting via YME1L1 in a kinase-independent manner to regulate essential mitochondrial structural proteins OPA1 and IMMT. The action of this enzyme is not yet clear. It is not known if it has protein kinase activity and what type of substrate it would phosphorylate (Ser, Thr or Tyr).

AlphaFold DB , UniProt , Accession A0A087XLL0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 518 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	34.8	Very low	224 Å²	224	120.4 Å²	120.4	100%	1.103	66%	0.656	S	S	*	*				0	-23.9	0	-81.4	-170.8	-116.2	0	0	114.4
2	A	30.7	Very low	35.1	Very low	76 Å²	76	114 Å²	114	63%	0.628	63%	0.632	S	S	*	*	H	α-helix	trans	-69	-31.6	-177.9	0	0	0	0	0	115.8	R4	A2-R4 PolarHBondContact O-N 3.43Å
3	G	30	Very low	35.6	Very low	56 Å²	56	112.4 Å²	112.4	58%	0.577	63%	0.627	S	S	*	*	H	α-helix	trans	-75.3	-16.9	-176.9	0	0	0	0	0	116.4
4	R	33.5	Very low	36.2	Very low	220 Å²	220	111.2 Å²	111.2	83%	0.83	62%	0.624	S	S	*	*	H	α-helix	trans	-86.5	-30.9	175.3	-84.5	-174.7	178.5	176	-0.5	112.5	A2 K7 V8	A2-R4 PolarHBondContact O-N 3.43Å; R4-K7 PolarHBondContact O-N 3.16Å; R4-V8 WeakPolarHBondContact O-CG2 3.48Å; R4-V8 PolarHBondContact O-N 2.96Å
5	L	31.4	Very low	36.9	Very low	132 Å²	132	109 Å²	109	69%	0.691	61%	0.614	S	S	*	*	H	α-helix	trans	-67.7	-38.3	175.9	-94.4	151.1	0	0	0	112.2	K7 V8 S9	L5-K7 PolarHBondContact O-N 3.46Å; L5-V8 PolarHBondContact O-N 3.4Å; L5-S9 PolarHBondContact O-N 3.34Å; L5-S9 PolarHBondContact O-OG 3.32Å
6	L	31.8	Very low	37.4	Very low	122 Å²	122	112.2 Å²	112.2	64%	0.639	62%	0.619	S	S	*	*	H	α-helix	trans	-67.4	-30.8	177.1	-89	153	0	0	0	113.9	S9 S10	L6-S9 WeakPolarHBondContact CA-OG 3.33Å; L6-S9 PolarHBondContact O-OG 2.75Å; L6-S9 VanDerWaalsContact O-OG 3.04Å; L6-S10 WeakPolarHBondContact O-CB 3.45Å; L6-S10 PolarHBondContact O-N 2.86Å; L6-S10 VanDerWaalsContact O-N 3.1Å
7	K	34.3	Very low	37.7	Very low	154 Å²	154	109.1 Å²	109.1	67%	0.67	61%	0.612	S	S	*	*	H	α-helix	trans	-75.2	-34.1	174.6	-80.3	-172.9	174.9	-176.3	0	112.7	R4 L5 L11	R4-K7 PolarHBondContact O-N 3.16Å; L5-K7 PolarHBondContact O-N 3.46Å; K7-L11 WeakPolarHBondContact O-CB 3.48Å; K7-L11 PolarHBondContact O-N 3.49Å; K7-L11 VanDerWaalsContact O-N 3.16Å
8	V	40	Very low	38	Very low	103 Å²	103	106.7 Å²	106.7	62%	0.624	60%	0.603	S	S	*	*	H	α-helix	trans	-73.9	-37.6	176.2	176.6	0	0	0	0	110.8	R4 L5 A12	R4-V8 WeakPolarHBondContact O-CG2 3.48Å; R4-V8 PolarHBondContact O-N 2.96Å; L5-V8 PolarHBondContact O-N 3.4Å; V8-A12 WeakPolarHBondContact O-CB 3.5Å; V8-A12 PolarHBondContact O-N 3.1Å
9	S	35.8	Very low	38.3	Very low	57 Å²	57	103.8 Å²	103.8	40%	0.399	59%	0.591	S	S	.	*	H	α-helix	trans	-65.6	-44.6	174.2	67.8	0	0	0	0	111.2	L5 L6 L11 A12 T13	L5-S9 PolarHBondContact O-N 3.34Å; L5-S9 PolarHBondContact O-OG 3.32Å; L6-S9 WeakPolarHBondContact CA-OG 3.33Å; L6-S9 PolarHBondContact O-OG 2.75Å; L6-S9 VanDerWaalsContact O-OG 3.04Å; S9-L11 PolarHBondContact O-N 3.26Å; S9-A12 PolarHBondContact O-N 3.04Å; S9-T13 PolarHBondContact O-N 2.98Å; S9-T13 PolarHBondContact O-OG1 3.45Å
10	S	37.1	Very low	38.5	Very low	64 Å²	64	100.3 Å²	100.3	45%	0.448	58%	0.579	S	S	.	*	H	α-helix	trans	-67.1	-36.3	-179.8	89.9	0	0	0	0	112.9	L6 T13 V14	L6-S10 WeakPolarHBondContact O-CB 3.45Å; L6-S10 PolarHBondContact O-N 2.86Å; L6-S10 VanDerWaalsContact O-N 3.1Å; S10-T13 PolarHBondContact O-N 2.96Å; S10-V14 WeakPolarHBondContact O-CB 3.23Å; S10-V14 VanDerWaalsContact O-CG2 3.23Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 3.45Å
11	L	37.8	Very low	38.7	Very low	116 Å²	116	101.8 Å²	101.8	61%	0.607	58%	0.578	S	S	*	*	H	α-helix	trans	-66.8	-42	173.1	-105.8	127.5	0	0	0	111.7	K7 S9 V14 V15	K7-L11 WeakPolarHBondContact O-CB 3.48Å; K7-L11 PolarHBondContact O-N 3.49Å; K7-L11 VanDerWaalsContact O-N 3.16Å; S9-L11 PolarHBondContact O-N 3.26Å; L11-V14 PolarHBondContact O-N 3.38Å; L11-V15 WeakPolarHBondContact O-CB 3.4Å; L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.42Å; L11-V15 PolarHBondContact O-N 2.82Å
12	A	37.9	Very low	38.9	Very low	44 Å²	44	98.1 Å²	98.1	36%	0.364	55%	0.553	S	S	.	*	H	α-helix	trans	-62.5	-44.2	174.8	0	0	0	0	0	111	V8 S9 V14 V15 F16	V8-A12 WeakPolarHBondContact O-CB 3.5Å; V8-A12 PolarHBondContact O-N 3.1Å; S9-A12 PolarHBondContact O-N 3.04Å; A12-V14 PolarHBondContact O-N 3.48Å; A12-V15 PolarHBondContact O-N 3.28Å; A12-F16 WeakPolarHBondContact O-CB 3.25Å; A12-F16 WeakPolarHBondContact O-CD2 3.34Å; A12-F16 PolarHBondContact O-N 2.65Å
13	T	42.4	Very low	39.5	Very low	93 Å²	93	99 Å²	99	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-65.4	-37.3	178	-39.2	0	0	0	0	112	S9 S10 A17	S9-T13 PolarHBondContact O-N 2.98Å; S9-T13 PolarHBondContact O-OG1 3.45Å; S10-T13 PolarHBondContact O-N 2.96Å; T13-A17 WeakPolarHBondContact O-CB 3.18Å; T13-A17 PolarHBondContact O-N 2.82Å
14	V	44.3	Very low	40.2	Very low	96 Å²	96	105.5 Å²	105.5	58%	0.582	56%	0.555	S	S	*	*	H	α-helix	trans	-70.4	-37.1	175.2	171.7	0	0	0	0	111.6	S10 L11 A12 S18	S10-V14 WeakPolarHBondContact O-CB 3.23Å; S10-V14 VanDerWaalsContact O-CG2 3.23Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 3.45Å; L11-V14 PolarHBondContact O-N 3.38Å; A12-V14 PolarHBondContact O-N 3.48Å; V14-S18 WeakPolarHBondContact O-CB 3.13Å; V14-S18 PolarHBondContact O-N 2.77Å; V14-S18 PolarHBondContact O-OG 2.64Å
15	V	46.8	Very low	40.7	Very low	78 Å²	78	100.8 Å²	100.8	47%	0.473	55%	0.547	S	S	.	.	H	α-helix	trans	-67.9	-41.3	173.9	171.7	0	0	0	0	111	L11 A12 S18 S19	L11-V15 WeakPolarHBondContact O-CB 3.4Å; L11-V15 VanDerWaalsContact O-CG2 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.42Å; L11-V15 PolarHBondContact O-N 2.82Å; A12-V15 PolarHBondContact O-N 3.28Å; V15-S18 WeakPolarHBondContact CA-OG 3.45Å; V15-S18 PolarHBondContact O-OG 2.82Å; V15-S18 VanDerWaalsContact O-OG 3.14Å; V15-S19 WeakPolarHBondContact O-CB 3.05Å; V15-S19 PolarHBondContact O-N 2.89Å; V15-S19 PolarHBondContact O-OG 3.42Å
16	F	44	Very low	41.6	Very low	160 Å²	160	98.1 Å²	98.1	70%	0.702	53%	0.528	S	S	*	.	H	α-helix	trans	-71.1	-34.6	175.5	-84.6	-72.9	0	0	0	112.7	A12 G20	A12-F16 WeakPolarHBondContact O-CB 3.25Å; A12-F16 WeakPolarHBondContact O-CD2 3.34Å; A12-F16 PolarHBondContact O-N 2.65Å; F16-G20 WeakPolarHBondContact O-CA 3.21Å; F16-G20 PolarHBondContact O-N 3.14Å
17	A	43	Very low	42.4	Very low	60 Å²	60	102 Å²	102	50%	0.496	54%	0.542	S	S	.	.	H	α-helix	trans	-74.9	-38.6	176.2	0	0	0	0	0	111.8	T13 G20 F21	T13-A17 WeakPolarHBondContact O-CB 3.18Å; T13-A17 PolarHBondContact O-N 2.82Å; A17-G20 PolarHBondContact O-N 2.78Å; A17-F21 WeakPolarHBondContact O-CB 3.1Å; A17-F21 PolarHBondContact O-N 2.73Å
18	S	42.6	Very low	43.3	Very low	65 Å²	65	98.3 Å²	98.3	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-71.3	-38.3	173.4	55.6	0	0	0	0	112	V14 V15 Y22	V14-S18 WeakPolarHBondContact O-CB 3.13Å; V14-S18 PolarHBondContact O-N 2.77Å; V14-S18 PolarHBondContact O-OG 2.64Å; V15-S18 WeakPolarHBondContact CA-OG 3.45Å; V15-S18 PolarHBondContact O-OG 2.82Å; V15-S18 VanDerWaalsContact O-OG 3.14Å; S18-Y22 WeakPolarHBondContact O-CB 3.09Å; S18-Y22 PolarHBondContact O-N 3.47Å
19	S	44.1	Very low	44.4	Very low	52 Å²	52	96.2 Å²	96.2	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-41	171	-57.5	0	0	0	0	111	V15 Y22 L23	V15-S19 WeakPolarHBondContact O-CB 3.05Å; V15-S19 PolarHBondContact O-N 2.89Å; V15-S19 PolarHBondContact O-OG 3.42Å; S19-Y22 PolarHBondContact O-N 3.32Å; S19-L23 WeakPolarHBondContact O-CB 3.1Å; S19-L23 WeakPolarHBondContact O-CD1 3.37Å; S19-L23 WeakPolarHBondContact O-CG 3.17Å; S19-L23 PolarHBondContact O-N 2.81Å
20	G	42.7	Very low	45.9	Very low	34 Å²	34	99.3 Å²	99.3	35%	0.351	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-41.1	176.2	0	0	0	0	0	112.3	F16 A17 L23 Y24	F16-G20 WeakPolarHBondContact O-CA 3.21Å; F16-G20 PolarHBondContact O-N 3.14Å; A17-G20 PolarHBondContact O-N 2.78Å; G20-L23 CarbonylContact O-C 3.58Å; G20-L23 PolarHBondContact O-N 3.43Å; G20-Y24 WeakPolarHBondContact O-CB 3.04Å; G20-Y24 PolarHBondContact O-N 2.78Å
21	F	42.1	Very low	47.3	Very low	131 Å²	131	99.7 Å²	99.7	58%	0.575	52%	0.523	S	S	*	.	H	α-helix	trans	-71.1	-38	174.7	-168	-97.3	0	0	0	111.7	A17 Y24 N25	A17-F21 WeakPolarHBondContact O-CB 3.1Å; A17-F21 PolarHBondContact O-N 2.73Å; F21-Y24 PolarHBondContact O-N 2.78Å; F21-N25 WeakPolarHBondContact O-CB 3.44Å; F21-N25 PolarHBondContact O-N 2.92Å
22	Y	44.4	Very low	48.8	Very low	147 Å²	147	95.4 Å²	95.4	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-65.1	-37.1	172	-177.3	-94	0	0	0	112.4	S18 S19	S18-Y22 WeakPolarHBondContact O-CB 3.09Å; S18-Y22 PolarHBondContact O-N 3.47Å; S19-Y22 PolarHBondContact O-N 3.32Å
23	L	44.4	Very low	50.8	Low	95 Å²	95	97.1 Å²	97.1	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-77	-27.6	174.3	-71.1	167.2	0	0	0	112.4	S19 G20 L28	S19-L23 WeakPolarHBondContact O-CB 3.1Å; S19-L23 WeakPolarHBondContact O-CD1 3.37Å; S19-L23 WeakPolarHBondContact O-CG 3.17Å; S19-L23 PolarHBondContact O-N 2.81Å; G20-L23 CarbonylContact O-C 3.58Å; G20-L23 PolarHBondContact O-N 3.43Å; L23-L28 HydrophobicContact CB-CD1 4.39Å; L23-L28 HydrophobicContact CD2-CD1 3.23Å; L23-L28 HydrophobicContact CG-CD1 4.38Å
24	Y	43.1	Very low	52.7	Low	192 Å²	192	95.1 Å²	95.1	75%	0.753	49%	0.494	S	S	*	.	H	α-helix	trans	-80.7	-37.1	178.8	-175.8	-98.3	0	0	0	112.2	G20 F21 R26	G20-Y24 WeakPolarHBondContact O-CB 3.04Å; G20-Y24 PolarHBondContact O-N 2.78Å; F21-Y24 PolarHBondContact O-N 2.78Å; Y24-R26 PolarHBondContact O-N 3.29Å
25	N	45.6	Very low	54.6	Low	122 Å²	122	96.2 Å²	96.2	65%	0.652	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-9	175.3	-109	9.3	0	0	0	113.7	F21	F21-N25 WeakPolarHBondContact O-CB 3.44Å; F21-N25 PolarHBondContact O-N 2.92Å
26	R	49.8	Very low	56.5	Low	75 Å²	75	95.5 Å²	95.5	28%	0.283	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	123.8	165.3	-77.8	-169.4	164.7	168	1.5	108	Y24 L28	Y24-R26 PolarHBondContact O-N 3.29Å; R26-L28 HydrophobicContact CB-CD1 4.29Å; R26-L28 HydrophobicContact CB-CG 3.89Å; R26-L28 PolarHBondContact O-N 2.67Å
27	Q	48.2	Very low	58.6	Low	203 Å²	203	88 Å²	88	95%	0.949	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	75.4	161.2	-80.2	161	-34.9	0	0	109.3	D29	Q27-D29 PolarHBondContact O-N 2.8Å; Q27-D29 VanDerWaalsContact O-N 3.15Å
28	L	53.5	Low	60.9	Low	78 Å²	78	89.7 Å²	89.7	41%	0.408	46%	0.457	S	S	.	.			trans	-76.8	101.6	174.1	-77.9	165.1	0	0	0	107	L23 R26 L30	L23-L28 HydrophobicContact CB-CD1 4.39Å; L23-L28 HydrophobicContact CD2-CD1 3.23Å; L23-L28 HydrophobicContact CG-CD1 4.38Å; R26-L28 HydrophobicContact CB-CD1 4.29Å; R26-L28 HydrophobicContact CB-CG 3.89Å; R26-L28 PolarHBondContact O-N 2.67Å; L28-L30 PolarHBondContact O-N 2.88Å; L28-L30 VanDerWaalsContact O-N 3.14Å
29	D	63.5	Low	63.2	Low	58 Å²	58	88 Å²	88	31%	0.31	45%	0.449	S	S	.	.			trans	-56.3	117.8	165.8	-172.6	-11.5	0	0	0	107.9	Q27 N31 D32	Q27-D29 PolarHBondContact O-N 2.8Å; Q27-D29 VanDerWaalsContact O-N 3.15Å; D29-N31 PolarHBondContact O-N 2.77Å; D29-N31 VanDerWaalsContact OD1-CB 3.25Å; D29-N31 WeakPolarHBondContact OD1-CB 3.41Å; D29-N31 VanDerWaalsContact OD1-CG 3.3Å; D29-N31 PolarHBondContact OD1-N 3.23Å; D29-N31 VanDerWaalsContact OD1-N 3.11Å; D29-N31 PolarHBondContact OD1-ND2 3.41Å; D29-D32 WeakPolarHBondContact O-CB 3.46Å; D29-D32 PolarHBondContact O-N 3.14Å
30	L	65.7	Low	65.6	Low	123 Å²	123	89.1 Å²	89.1	64%	0.644	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-56.3	-26.1	-179.7	-69.1	171.2	0	0	0	111.2	L28 D32 L33 I36	L28-L30 PolarHBondContact O-N 2.88Å; L28-L30 VanDerWaalsContact O-N 3.14Å; L30-D32 PolarHBondContact O-N 3.15Å; L30-L33 HydrophobicContact CD2-CD1 3.9Å; L30-L33 WeakPolarHBondContact O-CB 3.25Å; L30-L33 WeakPolarHBondContact O-CG 3.39Å; L30-L33 PolarHBondContact O-N 3.01Å; L30-I36 WeakPolarHBondContact O-CD1 3.46Å
31	N	67.7	Low	68	Low	71 Å²	71	87.5 Å²	87.5	38%	0.38	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-61.7	-21.1	174.7	-63.9	-51	0	0	0	113.9	D29 R40	D29-N31 PolarHBondContact O-N 2.77Å; D29-N31 VanDerWaalsContact OD1-CB 3.25Å; D29-N31 WeakPolarHBondContact OD1-CB 3.41Å; D29-N31 VanDerWaalsContact OD1-CG 3.3Å; D29-N31 PolarHBondContact OD1-N 3.23Å; D29-N31 VanDerWaalsContact OD1-N 3.11Å; D29-N31 PolarHBondContact OD1-ND2 3.41Å; N31-R40 PolarHBondContact OD1-NH2 2.67Å
32	D	69.6	Low	70.4	Confident	27 Å²	27	82.6 Å²	82.6	14%	0.144	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-89.8	-3.2	-178.2	-76.7	-43.2	0	0	0	114	D29 L30 S34 R37 K180 Q184	D29-D32 WeakPolarHBondContact O-CB 3.46Å; D29-D32 PolarHBondContact O-N 3.14Å; L30-D32 PolarHBondContact O-N 3.15Å; D32-S34 PolarHBondContact O-N 3.45Å; D32-R37 IonicContact OD1-NH1 3.42Å; D32-K180 WeakPolarHBondContact OD2-CD 3.21Å; D32-K180 WeakPolarHBondContact OD2-CE 3.46Å; D32-K180 IonicContact OD2-NZ 3.69Å; D32-K180 PolarHBondContact OD2-NZ 3.09Å; D32-Q184 VanDerWaalsContact CB-NE2 3.34Å; D32-Q184 PolarHBondContact O-NE2 2.86Å; D32-Q184 VanDerWaalsContact O-NE2 3.15Å; D32-Q184 PolarHBondContact OD1-NE2 3.14Å
33	L	80.4	Confident	72.9	Confident	80 Å²	80	79.2 Å²	79.2	42%	0.419	41%	0.41	S	S	.	.			trans	-64.4	130.3	175.2	-68	175.7	0	0	0	110.5	L30 V35 I36 R37	L30-L33 HydrophobicContact CD2-CD1 3.9Å; L30-L33 WeakPolarHBondContact O-CB 3.25Å; L30-L33 WeakPolarHBondContact O-CG 3.39Å; L30-L33 PolarHBondContact O-N 3.01Å; L33-V35 PolarHBondContact O-N 3.38Å; L33-V35 VanDerWaalsContact O-N 3.09Å; L33-I36 HydrophobicContact CB-CB 4.48Å; L33-I36 HydrophobicContact CB-CD1 4.27Å; L33-I36 HydrophobicContact CB-CG1 4.48Å; L33-I36 HydrophobicContact CD1-CD1 4.18Å; L33-I36 PolarHBondContact O-N 3.25Å; L33-R37 WeakPolarHBondContact O-CG 3.36Å; L33-R37 PolarHBondContact O-N 2.89Å
34	S	80.3	Confident	75.2	Confident	51 Å²	51	75.5 Å²	75.5	36%	0.357	39%	0.393	S	S	.	.	H	α-helix	trans	-55.3	-33.9	-176.7	-56.1	0	0	0	0	113.1	D32 F38	D32-S34 PolarHBondContact O-N 3.45Å; S34-F38 VanDerWaalsContact O-CB 3.28Å; S34-F38 WeakPolarHBondContact O-CB 3.28Å; S34-F38 PolarHBondContact O-N 2.92Å
35	V	84.8	Confident	77.6	Confident	119 Å²	119	67.8 Å²	67.8	72%	0.721	37%	0.366	S	S	*	.	H	α-helix	trans	-66.5	-42	177.2	179.9	0	0	0	0	111.7	L33 G39	L33-V35 PolarHBondContact O-N 3.38Å; L33-V35 VanDerWaalsContact O-N 3.09Å; V35-G39 PolarHBondContact O-N 3.48Å
36	I	86.6	Confident	79.9	Confident	62 Å²	62	64.8 Å²	64.8	32%	0.318	36%	0.358	S	S	.	.	H	α-helix	trans	-69.3	-44.2	179	-72.2	169.8	0	0	0	110.3	L30 L33 F38 G39 R40	L30-I36 WeakPolarHBondContact O-CD1 3.46Å; L33-I36 HydrophobicContact CB-CB 4.48Å; L33-I36 HydrophobicContact CB-CD1 4.27Å; L33-I36 HydrophobicContact CB-CG1 4.48Å; L33-I36 HydrophobicContact CD1-CD1 4.18Å; L33-I36 PolarHBondContact O-N 3.25Å; I36-F38 VanDerWaalsContact C-N 3.33Å; I36-F38 PolarHBondContact O-N 3.09Å; I36-G39 PolarHBondContact O-N 2.97Å; I36-R40 WeakPolarHBondContact O-CG 3.47Å; I36-R40 PolarHBondContact O-N 3.15Å
37	R	88.9	Confident	82	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.015	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-44.9	175.7	-62.9	172.6	69.2	75.7	2.8	111.8	D32 L33 A41 N88 D188	D32-R37 IonicContact OD1-NH1 3.42Å; L33-R37 WeakPolarHBondContact O-CG 3.36Å; L33-R37 PolarHBondContact O-N 2.89Å; R37-A41 WeakPolarHBondContact O-CB 3.47Å; R37-A41 PolarHBondContact O-N 2.99Å; R37-A41 VanDerWaalsContact O-N 3.09Å; R37-N88 PolarHBondContact NH1-O 3.47Å; R37-N88 PolarHBondContact NH2-O 2.9Å; R37-N88 PolarHBondContact O-ND2 3.34Å; R37-N88 VanDerWaalsContact O-ND2 3.12Å; R37-D188 IonicContact CZ-OD1 3.06Å; R37-D188 IonicContact CZ-OD2 2.71Å; R37-D188 IonicContact NE-OD1 2.78Å; R37-D188 PolarHBondContact NE-OD1 2.91Å; R37-D188 IonicContact NE-OD2 3.61Å; R37-D188 VanDerWaalsContact NH2-CG 3.29Å; R37-D188 IonicContact NH2-OD1 3.87Å; R37-D188 PolarHBondContact NH2-OD1 2.81Å; R37-D188 IonicContact NH2-OD2 3.9Å; R37-D188 PolarHBondContact NH2-OD2 2.86Å
38	F	90.8	Very high	84.2	Confident	95 Å²	95	56 Å²	56	42%	0.417	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-48	174	174.5	-99.5	0	0	0	111.6	S34 I36 R40 A41 A42 V191	S34-F38 VanDerWaalsContact O-CB 3.28Å; S34-F38 WeakPolarHBondContact O-CB 3.28Å; S34-F38 PolarHBondContact O-N 2.92Å; I36-F38 VanDerWaalsContact C-N 3.33Å; I36-F38 PolarHBondContact O-N 3.09Å; F38-R40 VanDerWaalsContact C-N 3.3Å; F38-R40 PolarHBondContact O-N 2.96Å; F38-A41 PolarHBondContact O-N 3.4Å; F38-A41 VanDerWaalsContact O-N 3.15Å; F38-A42 HydrophobicContact CE1-CB 4.33Å; F38-A42 HydrophobicContact CZ-CB 4.32Å; F38-A42 WeakPolarHBondContact O-CB 3.32Å; F38-A42 PolarHBondContact O-N 3.05Å; F38-V191 HydrophobicContact CB-CG2 4.43Å; F38-V191 HydrophobicContact CD2-CB 4.39Å; F38-V191 HydrophobicContact CD2-CG1 3.77Å; F38-V191 HydrophobicContact CD2-CG2 3.81Å; F38-V191 HydrophobicContact CE2-CG1 4.45Å
39	G	91.7	Very high	86	Confident	29 Å²	29	52.7 Å²	52.7	30%	0.299	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-41.1	179.6	0	0	0	0	0	112.6	V35 I36 S43	V35-G39 PolarHBondContact O-N 3.48Å; I36-G39 PolarHBondContact O-N 2.97Å; G39-S43 VanDerWaalsContact O-CB 3.26Å; G39-S43 WeakPolarHBondContact O-CB 3.25Å; G39-S43 PolarHBondContact O-N 3.24Å; G39-S43 PolarHBondContact O-OG 3.42Å
40	R	93.3	Very high	87.5	Confident	76 Å²	76	57.3 Å²	57.3	29%	0.287	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-48.4	174.1	-72.1	174.2	-176.8	164.6	3.3	111.9	N31 I36 F38 S43 A44 L84	N31-R40 PolarHBondContact OD1-NH2 2.67Å; I36-R40 WeakPolarHBondContact O-CG 3.47Å; I36-R40 PolarHBondContact O-N 3.15Å; F38-R40 VanDerWaalsContact C-N 3.3Å; F38-R40 PolarHBondContact O-N 2.96Å; R40-S43 PolarHBondContact O-N 3.06Å; R40-A44 WeakPolarHBondContact O-CB 3.15Å; R40-A44 PolarHBondContact O-N 3.36Å; R40-L84 HydrophobicContact CB-CD1 4.04Å
41	A	93	Very high	88.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.9	-48.4	-179.3	0	0	0	0	0	111.2	R37 F38 S43 A44 T45 L84 F92 V191 L195	R37-A41 WeakPolarHBondContact O-CB 3.47Å; R37-A41 PolarHBondContact O-N 2.99Å; R37-A41 VanDerWaalsContact O-N 3.09Å; F38-A41 PolarHBondContact O-N 3.4Å; F38-A41 VanDerWaalsContact O-N 3.15Å; A41-S43 PolarHBondContact O-N 3.13Å; A41-A44 PolarHBondContact O-N 2.9Å; A41-T45 WeakPolarHBondContact O-CB 3.34Å; A41-T45 PolarHBondContact O-N 2.86Å; A41-T45 PolarHBondContact O-OG1 3.1Å; A41-L84 HydrophobicContact CB-CD1 4.04Å; A41-L84 HydrophobicContact CB-CD2 4.23Å; A41-F92 HydrophobicContact CB-CE1 4.06Å; A41-F92 HydrophobicContact CB-CZ 4.02Å; A41-V191 HydrophobicContact CB-CG1 4.02Å; A41-L195 HydrophobicContact CB-CD1 3.5Å; A41-L195 VanDerWaalsContact CB-CD1 3.5Å
42	A	93.8	Very high	89.8	Confident	28 Å²	28	51.4 Å²	51.4	23%	0.231	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-44.5	176.6	0	0	0	0	0	112.3	F38 T45 A46 L195	F38-A42 HydrophobicContact CE1-CB 4.33Å; F38-A42 HydrophobicContact CZ-CB 4.32Å; F38-A42 WeakPolarHBondContact O-CB 3.32Å; F38-A42 PolarHBondContact O-N 3.05Å; A42-T45 PolarHBondContact O-N 3.5Å; A42-A46 VanDerWaalsContact O-CB 3.29Å; A42-A46 WeakPolarHBondContact O-CB 3.15Å; A42-A46 PolarHBondContact O-N 3.28Å; A42-L195 HydrophobicContact CB-CD2 4.2Å
43	S	95.4	Very high	90.7	Very high	75 Å²	75	54 Å²	54	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-47.3	177.4	-59.7	0	0	0	0	111.8	G39 R40 A41 A46 V47	G39-S43 VanDerWaalsContact O-CB 3.26Å; G39-S43 WeakPolarHBondContact O-CB 3.25Å; G39-S43 PolarHBondContact O-N 3.24Å; G39-S43 PolarHBondContact O-OG 3.42Å; R40-S43 PolarHBondContact O-N 3.06Å; A41-S43 PolarHBondContact O-N 3.13Å; S43-A46 PolarHBondContact O-N 3.27Å; S43-V47 VanDerWaalsContact O-CG2 3.3Å; S43-V47 WeakPolarHBondContact O-CG2 3.46Å; S43-V47 PolarHBondContact O-N 2.87Å
44	A	94.3	Very high	91.2	Very high	18 Å²	18	51.7 Å²	51.7	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-46	177.7	0	0	0	0	0	111.4	R40 A41 A46 V47 I48 L84	R40-A44 WeakPolarHBondContact O-CB 3.15Å; R40-A44 PolarHBondContact O-N 3.36Å; A41-A44 PolarHBondContact O-N 2.9Å; A44-A46 PolarHBondContact O-N 3.19Å; A44-V47 PolarHBondContact O-N 3.04Å; A44-I48 WeakPolarHBondContact O-CB 3.19Å; A44-I48 VanDerWaalsContact O-CG1 3.24Å; A44-I48 WeakPolarHBondContact O-CG1 3.25Å; A44-I48 PolarHBondContact O-N 3.11Å; A44-L84 HydrophobicContact CB-CB 4.24Å; A44-L84 HydrophobicContact CB-CD2 4.03Å; A44-L84 HydrophobicContact CB-CG 4.49Å
45	T	92.9	Very high	91.7	Very high	30 Å²	30	50.3 Å²	50.3	18%	0.184	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-63.2	0	0	0	0	112	A41 A42 I48 S49 L195 V199	A41-T45 WeakPolarHBondContact O-CB 3.34Å; A41-T45 PolarHBondContact O-N 2.86Å; A41-T45 PolarHBondContact O-OG1 3.1Å; A42-T45 PolarHBondContact O-N 3.5Å; T45-I48 PolarHBondContact O-N 2.71Å; T45-S49 VanDerWaalsContact O-CB 3.3Å; T45-S49 WeakPolarHBondContact O-CB 3.12Å; T45-S49 PolarHBondContact O-N 3.13Å; T45-S49 PolarHBondContact O-OG 2.67Å; T45-L195 HydrophobicContact CG2-CB 4.43Å; T45-L195 HydrophobicContact CG2-CD2 4.4Å; T45-V199 HydrophobicContact CG2-CG2 3.46Å; T45-V199 VanDerWaalsContact CG2-CG2 3.46Å
46	A	93.8	Very high	91.8	Very high	58 Å²	58	46.5 Å²	46.5	48%	0.479	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-45.1	178.7	0	0	0	0	0	111.9	A42 S43 A44 S49 Y50	A42-A46 VanDerWaalsContact O-CB 3.29Å; A42-A46 WeakPolarHBondContact O-CB 3.15Å; A42-A46 PolarHBondContact O-N 3.28Å; S43-A46 PolarHBondContact O-N 3.27Å; A44-A46 PolarHBondContact O-N 3.19Å; A46-S49 PolarHBondContact O-N 3.48Å; A46-Y50 VanDerWaalsContact O-CB 3.3Å; A46-Y50 WeakPolarHBondContact O-CB 3.33Å; A46-Y50 PolarHBondContact O-N 2.81Å
47	V	95	Very high	91.8	Very high	68 Å²	68	51.9 Å²	51.9	41%	0.412	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-45.9	177.4	171.2	0	0	0	0	110.9	S43 A44 Y50 D51	S43-V47 VanDerWaalsContact O-CG2 3.3Å; S43-V47 WeakPolarHBondContact O-CG2 3.46Å; S43-V47 PolarHBondContact O-N 2.87Å; A44-V47 PolarHBondContact O-N 3.04Å; V47-Y50 PolarHBondContact O-N 3.22Å; V47-D51 WeakPolarHBondContact O-CB 3.29Å; V47-D51 PolarHBondContact O-N 2.78Å
48	I	93.5	Very high	91.7	Very high	26 Å²	26	60.2 Å²	60.2	13%	0.133	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-48.6	176.8	-69	166.7	0	0	0	110.1	A44 T45 Y50 D51 Y52 R80 L81	A44-I48 WeakPolarHBondContact O-CB 3.19Å; A44-I48 VanDerWaalsContact O-CG1 3.24Å; A44-I48 WeakPolarHBondContact O-CG1 3.25Å; A44-I48 PolarHBondContact O-N 3.11Å; T45-I48 PolarHBondContact O-N 2.71Å; I48-Y50 PolarHBondContact O-N 3.28Å; I48-D51 WeakPolarHBondContact O-CB 3.43Å; I48-D51 PolarHBondContact O-N 3.41Å; I48-Y52 HydrophobicContact CG2-CD2 3.97Å; I48-Y52 HydrophobicContact CG2-CE2 3.96Å; I48-Y52 WeakPolarHBondContact O-CD2 3.36Å; I48-Y52 PolarHBondContact O-N 2.85Å; I48-Y52 VanDerWaalsContact O-N 3.12Å; I48-R80 HydrophobicContact CD1-CB 4.1Å; I48-R80 HydrophobicContact CG1-CB 4.17Å; I48-L81 HydrophobicContact CD1-CB 4.44Å
49	S	91.7	Very high	91.5	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-44.7	-179.5	-57.7	0	0	0	0	111.9	T45 A46 D51 Y52 L53	T45-S49 VanDerWaalsContact O-CB 3.3Å; T45-S49 WeakPolarHBondContact O-CB 3.12Å; T45-S49 PolarHBondContact O-N 3.13Å; T45-S49 PolarHBondContact O-OG 2.67Å; A46-S49 PolarHBondContact O-N 3.48Å; S49-D51 VanDerWaalsContact C-N 3.29Å; S49-D51 PolarHBondContact O-N 2.73Å; S49-Y52 PolarHBondContact O-N 3.28Å; S49-L53 WeakPolarHBondContact O-CG 3.49Å; S49-L53 PolarHBondContact O-N 3.24Å
50	Y	93.9	Very high	91.1	Very high	155 Å²	155	63.5 Å²	63.5	61%	0.608	32%	0.323	S	S	*	.	H	α-helix	trans	-60.5	-40.1	176.7	178.3	-97.6	0	0	0	112.2	A46 V47 I48 L53 T54	A46-Y50 VanDerWaalsContact O-CB 3.3Å; A46-Y50 WeakPolarHBondContact O-CB 3.33Å; A46-Y50 PolarHBondContact O-N 2.81Å; V47-Y50 PolarHBondContact O-N 3.22Å; I48-Y50 PolarHBondContact O-N 3.28Å; Y50-L53 PolarHBondContact O-N 3.46Å; Y50-T54 HydrophobicContact CD1-CG2 4.43Å; Y50-T54 HydrophobicContact CD2-CG2 4.11Å; Y50-T54 HydrophobicContact CE1-CG2 4.02Å; Y50-T54 HydrophobicContact CE2-CG2 3.67Å; Y50-T54 HydrophobicContact CG-CG2 4.47Å; Y50-T54 WeakPolarHBondContact O-CB 3.5Å; Y50-T54 WeakPolarHBondContact O-CG2 3.4Å; Y50-T54 PolarHBondContact O-N 2.99Å; Y50-T54 VanDerWaalsContact O-N 3.08Å; Y50-T54 PolarHBondContact O-OG1 3.29Å
51	D	92.6	Very high	90.5	Very high	18 Å²	18	67.7 Å²	67.7	10%	0.096	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-46.2	178.7	-155.9	-4	0	0	0	111.4	V47 I48 S49 L53 T54 A55 R76 R80	V47-D51 WeakPolarHBondContact O-CB 3.29Å; V47-D51 PolarHBondContact O-N 2.78Å; I48-D51 WeakPolarHBondContact O-CB 3.43Å; I48-D51 PolarHBondContact O-N 3.41Å; S49-D51 VanDerWaalsContact C-N 3.29Å; S49-D51 PolarHBondContact O-N 2.73Å; D51-L53 PolarHBondContact O-N 2.9Å; D51-T54 PolarHBondContact O-N 3.26Å; D51-T54 PolarHBondContact O-OG1 2.99Å; D51-A55 WeakPolarHBondContact O-CB 3.44Å; D51-A55 PolarHBondContact O-N 3.33Å; D51-R76 VanDerWaalsContact CG-NE 3.3Å; D51-R76 IonicContact OD1-CZ 3.12Å; D51-R76 IonicContact OD1-NE 2.68Å; D51-R76 PolarHBondContact OD1-NE 2.77Å; D51-R76 IonicContact OD1-NH2 2.82Å; D51-R76 PolarHBondContact OD1-NH2 3.11Å; D51-R76 WeakPolarHBondContact OD2-CD 3.41Å; D51-R76 IonicContact OD2-CZ 3.66Å; D51-R76 IonicContact OD2-NE 3.26Å; D51-R76 PolarHBondContact OD2-NE 3.22Å; D51-R76 IonicContact OD2-NH2 2.84Å; D51-R80 IonicContact OD2-CZ 2.68Å; D51-R80 IonicContact OD2-NH1 3.65Å; D51-R80 PolarHBondContact OD2-NH1 2.77Å; D51-R80 IonicContact OD2-NH2 3.08Å; D51-R80 PolarHBondContact OD2-NH2 3.24Å
52	Y	89.4	Confident	89.7	Confident	52 Å²	52	69.6 Å²	69.6	20%	0.204	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-35.8	174.6	-84.4	-87	0	0	0	113	I48 S49 T54 F56 V73 H74 S77 Y110	I48-Y52 HydrophobicContact CG2-CD2 3.97Å; I48-Y52 HydrophobicContact CG2-CE2 3.96Å; I48-Y52 WeakPolarHBondContact O-CD2 3.36Å; I48-Y52 PolarHBondContact O-N 2.85Å; I48-Y52 VanDerWaalsContact O-N 3.12Å; S49-Y52 PolarHBondContact O-N 3.28Å; Y52-T54 VanDerWaalsContact C-N 3.32Å; Y52-T54 PolarHBondContact O-N 2.92Å; Y52-F56 AromaticContact CD1-CE2 3.86Å; Y52-F56 HydrophobicContact CD1-CE2 3.86Å; Y52-F56 HydrophobicContact CE1-CE2 4.45Å; Y52-F56 WeakPolarHBondContact O-CD2 3.38Å; Y52-V73 HydrophobicContact CD1-CG1 3.98Å; Y52-V73 HydrophobicContact CD2-CG1 3.99Å; Y52-V73 HydrophobicContact CE1-CG1 3.86Å; Y52-V73 HydrophobicContact CE2-CG1 3.88Å; Y52-V73 HydrophobicContact CG-CG1 4.05Å; Y52-H74 AromaticContact CE1-CD2 3.79Å; Y52-H74 AromaticContact CE1-NE2 3.86Å; Y52-H74 AromaticContact CZ-CD2 3.75Å; Y52-H74 PolarHBondContact OH-CD2 3.13Å; Y52-H74 PolarHBondContact OH-NE2 3.05Å; Y52-S77 WeakPolarHBondContact CE2-OG 3.36Å; Y52-Y110 PolarHBondContact OH-OH 3.16Å
53	L	88.4	Confident	89.2	Confident	81 Å²	81	70.5 Å²	70.5	42%	0.424	36%	0.363	S	S	.	.	H	α-helix	trans	-73.3	-20.4	178.8	-73	171.5	0	0	0	114.3	S49 Y50 D51 R57 F203	S49-L53 WeakPolarHBondContact O-CG 3.49Å; S49-L53 PolarHBondContact O-N 3.24Å; Y50-L53 PolarHBondContact O-N 3.46Å; D51-L53 PolarHBondContact O-N 2.9Å; L53-R57 PolarHBondContact O-NE 3.49Å; L53-R57 VanDerWaalsContact O-NE 3.11Å; L53-F203 HydrophobicContact CD1-CZ 4.46Å; L53-F203 HydrophobicContact CD2-CE1 3.79Å; L53-F203 HydrophobicContact CD2-CZ 4.05Å; L53-F203 HydrophobicContact CG-CE1 4Å; L53-F203 HydrophobicContact CG-CZ 3.78Å
54	T	91.8	Very high	88.5	Confident	31 Å²	31	74.7 Å²	74.7	19%	0.19	37%	0.374	C	S	.	.	H	α-helix	trans	-111.2	-35.8	-172.8	54.6	0	0	0	0	113.4	Y50 D51 Y52 F56 R57	Y50-T54 HydrophobicContact CD1-CG2 4.43Å; Y50-T54 HydrophobicContact CD2-CG2 4.11Å; Y50-T54 HydrophobicContact CE1-CG2 4.02Å; Y50-T54 HydrophobicContact CE2-CG2 3.67Å; Y50-T54 HydrophobicContact CG-CG2 4.47Å; Y50-T54 WeakPolarHBondContact O-CB 3.5Å; Y50-T54 WeakPolarHBondContact O-CG2 3.4Å; Y50-T54 PolarHBondContact O-N 2.99Å; Y50-T54 VanDerWaalsContact O-N 3.08Å; Y50-T54 PolarHBondContact O-OG1 3.29Å; D51-T54 PolarHBondContact O-N 3.26Å; D51-T54 PolarHBondContact O-OG1 2.99Å; Y52-T54 VanDerWaalsContact C-N 3.32Å; Y52-T54 PolarHBondContact O-N 2.92Å; T54-F56 VanDerWaalsContact C-N 3.27Å; T54-F56 PolarHBondContact O-N 3.43Å; T54-R57 PolarHBondContact O-N 3.32Å
55	A	89.8	Confident	88.1	Confident	22 Å²	22	79.6 Å²	79.6	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-59.5	-35.7	-174.1	0	0	0	0	0	113.2	D51 L69 V73	D51-A55 WeakPolarHBondContact O-CB 3.44Å; D51-A55 PolarHBondContact O-N 3.33Å; A55-L69 VanDerWaalsContact O-CD2 3.24Å; A55-L69 WeakPolarHBondContact O-CD2 3.49Å; A55-V73 HydrophobicContact CB-CG2 3.63Å
56	F	87.8	Confident	87.7	Confident	39 Å²	39	79.4 Å²	79.4	17%	0.171	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.7	-174	-54.7	-71.5	0	0	0	114.6	Y52 T54 H58 V59 Y66 L69 K70 V73	Y52-F56 AromaticContact CD1-CE2 3.86Å; Y52-F56 HydrophobicContact CD1-CE2 3.86Å; Y52-F56 HydrophobicContact CE1-CE2 4.45Å; Y52-F56 WeakPolarHBondContact O-CD2 3.38Å; T54-F56 VanDerWaalsContact C-N 3.27Å; T54-F56 PolarHBondContact O-N 3.43Å; F56-H58 VanDerWaalsContact C-N 3.26Å; F56-H58 PolarHBondContact O-N 3.13Å; F56-V59 PolarHBondContact O-N 3.43Å; F56-Y66 HydrophobicContact CB-CE2 4.21Å; F56-Y66 AromaticContact CD1-CD2 3.81Å; F56-Y66 HydrophobicContact CD1-CD2 3.81Å; F56-Y66 AromaticContact CD1-CE2 3.43Å; F56-Y66 HydrophobicContact CD1-CE2 3.43Å; F56-Y66 VanDerWaalsContact CD1-CE2 3.43Å; F56-Y66 HydrophobicContact CE1-CD2 4.42Å; F56-Y66 HydrophobicContact CE1-CE2 4.02Å; F56-Y66 AromaticContact CG-CE2 3.97Å; F56-Y66 HydrophobicContact CG-CE2 3.97Å; F56-L69 HydrophobicContact CD1-CD2 4.5Å; F56-L69 HydrophobicContact CE1-CG 4.42Å; F56-K70 HydrophobicContact CE1-CB 3.74Å; F56-K70 HydrophobicContact CE1-CG 4.26Å; F56-K70 HydrophobicContact CZ-CB 3.96Å; F56-K70 HydrophobicContact CZ-CG 4.03Å; F56-V73 HydrophobicContact CE1-CG2 4.28Å; F56-V73 HydrophobicContact CE2-CG1 4.43Å; F56-V73 HydrophobicContact CE2-CG2 4.27Å; F56-V73 HydrophobicContact CZ-CB 4.13Å; F56-V73 HydrophobicContact CZ-CG1 4.4Å; F56-V73 HydrophobicContact CZ-CG2 3.74Å
57	R	86.9	Confident	87	Confident	176 Å²	176	82.5 Å²	82.5	66%	0.664	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.3	-173.5	-73.3	-177.4	-177.8	-175.1	-2.5	114.9	L53 T54	L53-R57 PolarHBondContact O-NE 3.49Å; L53-R57 VanDerWaalsContact O-NE 3.11Å; T54-R57 PolarHBondContact O-N 3.32Å
58	H	86.4	Confident	86.6	Confident	178 Å²	178	82.3 Å²	82.3	82%	0.824	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	17.5	-173.2	-54.2	93.8	0	0	0	112.6	F56	F56-H58 VanDerWaalsContact C-N 3.26Å; F56-H58 PolarHBondContact O-N 3.13Å
59	V	85.9	Confident	86.4	Confident	40 Å²	40	83.1 Å²	83.1	24%	0.242	40%	0.397	C	S	.	.	S	Bend	trans	-128.7	126.4	-178.5	-172.8	0	0	0	0	109	F56 D65 Y66 L69	F56-V59 PolarHBondContact O-N 3.43Å; V59-D65 HydrophobicContact CG1-CB 4.22Å; V59-Y66 HydrophobicContact CG1-CD2 4.43Å; V59-L69 HydrophobicContact CG2-CD2 3.71Å
60	E	84.3	Confident	86.1	Confident	154 Å²	154	85.4 Å²	85.4	72%	0.72	41%	0.405	S	S	*	.			trans	-70.5	133.5	-179.2	-172	174.8	-167.5	0	0	111.1	G62 T63 Y66	E60-G62 PolarHBondContact O-N 3.32Å; E60-T63 HydrophobicContact CB-CG2 3.99Å; E60-T63 HydrophobicContact CG-CG2 4.48Å; E60-T63 PolarHBondContact O-N 2.81Å; E60-T63 PolarHBondContact O-OG1 3.43Å; E60-Y66 WeakPolarHBondContact O-CB 3.3Å
61	Y	80.4	Confident	85.7	Confident	163 Å²	163	80.2 Å²	80.2	64%	0.639	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	134.5	-179.1	-178.5	-94.2	0	0	0	111.7	Y66	Y61-Y66 HydrophobicContact CD2-CD1 4.37Å; Y61-Y66 AromaticContact CD2-CE1 3.72Å; Y61-Y66 HydrophobicContact CD2-CE1 3.72Å; Y61-Y66 AromaticContact CD2-CE2 3.92Å; Y61-Y66 HydrophobicContact CD2-CE2 3.92Å; Y61-Y66 AromaticContact CD2-CZ 3.48Å; Y61-Y66 VanDerWaalsContact CD2-CZ 3.48Å; Y61-Y66 AromaticContact CE2-CE1 3.8Å; Y61-Y66 HydrophobicContact CE2-CE1 3.8Å; Y61-Y66 AromaticContact CE2-CZ 3.81Å
62	G	74.8	Confident	85.7	Confident	41 Å²	41	85.5 Å²	85.5	42%	0.423	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-7.2	175.6	0	0	0	0	0	115.4	E60 W67	E60-G62 PolarHBondContact O-N 3.32Å; G62-W67 PolarHBondContact O-NE1 3.21Å
63	T	83.7	Confident	85.9	Confident	46 Å²	46	83 Å²	83	28%	0.282	40%	0.404	S	S	.	.	S	Bend	trans	-71.8	157	172.9	59.5	0	0	0	0	112.3	E60 D65 Y66 W67	E60-T63 HydrophobicContact CB-CG2 3.99Å; E60-T63 HydrophobicContact CG-CG2 4.48Å; E60-T63 PolarHBondContact O-N 2.81Å; E60-T63 PolarHBondContact O-OG1 3.43Å; T63-D65 PolarHBondContact O-N 3.15Å; T63-Y66 WeakPolarHBondContact O-CB 3.36Å; T63-Y66 PolarHBondContact O-N 3.12Å; T63-Y66 VanDerWaalsContact O-N 3.11Å; T63-Y66 WeakPolarHBondContact OG1-CB 3.47Å; T63-Y66 PolarHBondContact OG1-N 3.09Å; T63-Y66 VanDerWaalsContact OG1-N 3.16Å; T63-W67 PolarHBondContact O-N 3.34Å
64	E	81.3	Confident	85.9	Confident	164 Å²	164	80.1 Å²	80.1	77%	0.766	39%	0.389	S	S	*	.	H	α-helix	trans	-58.9	-37.5	174.4	-171.7	176.6	-179.4	0	0	111.7	Y66 W67 T68	E64-Y66 VanDerWaalsContact C-N 3.35Å; E64-Y66 PolarHBondContact O-N 3.2Å; E64-W67 PolarHBondContact O-N 3.28Å; E64-T68 WeakPolarHBondContact O-CB 3.4Å; E64-T68 PolarHBondContact O-N 2.75Å; E64-T68 PolarHBondContact O-OG1 3.03Å
65	D	85.3	Confident	86	Confident	120 Å²	120	83.6 Å²	83.6	64%	0.642	40%	0.398	S	S	*	.	H	α-helix	trans	-62.2	-40	174.3	-72.3	-27.4	0	0	0	112.2	V59 T63 T68 L69	V59-D65 HydrophobicContact CG1-CB 4.22Å; T63-D65 PolarHBondContact O-N 3.15Å; D65-T68 PolarHBondContact O-N 2.68Å; D65-L69 VanDerWaalsContact O-CB 3.24Å; D65-L69 WeakPolarHBondContact O-CB 3.43Å; D65-L69 PolarHBondContact O-N 3.01Å
66	Y	84.6	Confident	86.2	Confident	27 Å²	27	85.6 Å²	85.6	11%	0.106	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-48.9	174.8	177.6	-91.5	0	0	0	111.7	F56 V59 E60 Y61 T63 E64 L69 K70	F56-Y66 HydrophobicContact CB-CE2 4.21Å; F56-Y66 AromaticContact CD1-CD2 3.81Å; F56-Y66 HydrophobicContact CD1-CD2 3.81Å; F56-Y66 AromaticContact CD1-CE2 3.43Å; F56-Y66 HydrophobicContact CD1-CE2 3.43Å; F56-Y66 VanDerWaalsContact CD1-CE2 3.43Å; F56-Y66 HydrophobicContact CE1-CD2 4.42Å; F56-Y66 HydrophobicContact CE1-CE2 4.02Å; F56-Y66 AromaticContact CG-CE2 3.97Å; F56-Y66 HydrophobicContact CG-CE2 3.97Å; V59-Y66 HydrophobicContact CG1-CD2 4.43Å; E60-Y66 WeakPolarHBondContact O-CB 3.3Å; Y61-Y66 HydrophobicContact CD2-CD1 4.37Å; Y61-Y66 AromaticContact CD2-CE1 3.72Å; Y61-Y66 HydrophobicContact CD2-CE1 3.72Å; Y61-Y66 AromaticContact CD2-CE2 3.92Å; Y61-Y66 HydrophobicContact CD2-CE2 3.92Å; Y61-Y66 AromaticContact CD2-CZ 3.48Å; Y61-Y66 VanDerWaalsContact CD2-CZ 3.48Å; Y61-Y66 AromaticContact CE2-CE1 3.8Å; Y61-Y66 HydrophobicContact CE2-CE1 3.8Å; Y61-Y66 AromaticContact CE2-CZ 3.81Å; T63-Y66 WeakPolarHBondContact O-CB 3.36Å; T63-Y66 PolarHBondContact O-N 3.12Å; T63-Y66 VanDerWaalsContact O-N 3.11Å; T63-Y66 WeakPolarHBondContact OG1-CB 3.47Å; T63-Y66 PolarHBondContact OG1-N 3.09Å; T63-Y66 VanDerWaalsContact OG1-N 3.16Å; E64-Y66 VanDerWaalsContact C-N 3.35Å; E64-Y66 PolarHBondContact O-N 3.2Å; Y66-L69 PolarHBondContact O-N 2.96Å; Y66-K70 HydrophobicContact CE1-CD 3.92Å; Y66-K70 VanDerWaalsContact O-CB 3.23Å; Y66-K70 WeakPolarHBondContact O-CB 3.48Å; Y66-K70 PolarHBondContact O-N 2.74Å
67	W	80.3	Confident	86.5	Confident	122 Å²	122	83.8 Å²	83.8	46%	0.462	39%	0.393	S	S	.	.	H	α-helix	trans	-65.7	-40.9	-179.3	-64.6	116	0	0	0	112.1	G62 T63 E64 K70 S71	G62-W67 PolarHBondContact O-NE1 3.21Å; T63-W67 PolarHBondContact O-N 3.34Å; E64-W67 PolarHBondContact O-N 3.28Å; W67-K70 HydrophobicContact CE3-CD 4.05Å; W67-K70 HydrophobicContact CZ3-CD 3.97Å; W67-K70 PolarHBondContact O-N 2.94Å; W67-S71 PolarHBondContact O-N 2.73Å
68	T	86.1	Confident	86.8	Confident	64 Å²	64	75.4 Å²	75.4	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-45.2	175.7	-59.3	0	0	0	0	111.4	E64 D65 K70 S71 K72	E64-T68 WeakPolarHBondContact O-CB 3.4Å; E64-T68 PolarHBondContact O-N 2.75Å; E64-T68 PolarHBondContact O-OG1 3.03Å; D65-T68 PolarHBondContact O-N 2.68Å; T68-K70 VanDerWaalsContact C-N 3.35Å; T68-S71 PolarHBondContact O-N 2.75Å; T68-K72 WeakPolarHBondContact O-CG 3.43Å; T68-K72 PolarHBondContact O-N 3.12Å; T68-K72 VanDerWaalsContact O-N 3.17Å
69	L	89.6	Confident	87.1	Confident	44 Å²	44	70.5 Å²	70.5	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-39.7	176.8	-176.6	57.6	0	0	0	111.5	A55 F56 V59 D65 Y66 K72 V73	A55-L69 VanDerWaalsContact O-CD2 3.24Å; A55-L69 WeakPolarHBondContact O-CD2 3.49Å; F56-L69 HydrophobicContact CD1-CD2 4.5Å; F56-L69 HydrophobicContact CE1-CG 4.42Å; V59-L69 HydrophobicContact CG2-CD2 3.71Å; D65-L69 VanDerWaalsContact O-CB 3.24Å; D65-L69 WeakPolarHBondContact O-CB 3.43Å; D65-L69 PolarHBondContact O-N 3.01Å; Y66-L69 PolarHBondContact O-N 2.96Å; L69-K72 WeakPolarHBondContact O-CB 3.44Å; L69-K72 PolarHBondContact O-N 2.88Å; L69-V73 HydrophobicContact CD1-CG2 4.46Å; L69-V73 HydrophobicContact CG-CG2 4.37Å; L69-V73 WeakPolarHBondContact O-CG2 3.48Å; L69-V73 PolarHBondContact O-N 2.77Å
70	K	85.6	Confident	87.5	Confident	56 Å²	56	72.3 Å²	72.3	24%	0.243	34%	0.341	C	S	.	.	H	α-helix	trans	-60	-47	177	-174.1	172.2	-179.8	174.7	0	111.8	F56 Y66 W67 T68 K72 V73 H74	F56-K70 HydrophobicContact CE1-CB 3.74Å; F56-K70 HydrophobicContact CE1-CG 4.26Å; F56-K70 HydrophobicContact CZ-CB 3.96Å; F56-K70 HydrophobicContact CZ-CG 4.03Å; Y66-K70 HydrophobicContact CE1-CD 3.92Å; Y66-K70 VanDerWaalsContact O-CB 3.23Å; Y66-K70 WeakPolarHBondContact O-CB 3.48Å; Y66-K70 PolarHBondContact O-N 2.74Å; W67-K70 HydrophobicContact CE3-CD 4.05Å; W67-K70 HydrophobicContact CZ3-CD 3.97Å; W67-K70 PolarHBondContact O-N 2.94Å; T68-K70 VanDerWaalsContact C-N 3.35Å; K70-K72 VanDerWaalsContact C-N 3.33Å; K70-K72 PolarHBondContact O-N 2.93Å; K70-V73 WeakPolarHBondContact O-CB 3.29Å; K70-V73 PolarHBondContact O-N 3.44Å; K70-V73 VanDerWaalsContact O-N 3.15Å; K70-H74 WeakPolarHBondContact CG-NE2 3.38Å; K70-H74 WeakPolarHBondContact O-CB 3.44Å; K70-H74 PolarHBondContact O-CD2 3.37Å; K70-H74 PolarHBondContact O-N 2.77Å
71	S	85.6	Confident	87.9	Confident	47 Å²	47	66.9 Å²	66.9	33%	0.329	32%	0.317	S	S	.	.	H	α-helix	trans	-57.6	-44.2	174.2	178.7	0	0	0	0	111.8	W67 T68 V73 H74 R75 E109	W67-S71 PolarHBondContact O-N 2.73Å; T68-S71 PolarHBondContact O-N 2.75Å; S71-V73 PolarHBondContact O-N 3.31Å; S71-H74 WeakPolarHBondContact O-CB 3.42Å; S71-H74 PolarHBondContact O-N 3.35Å; S71-R75 PolarHBondContact O-N 3.33Å; S71-E109 WeakPolarHBondContact CA-OE1 3.29Å; S71-E109 VanDerWaalsContact CB-OE1 3.29Å; S71-E109 WeakPolarHBondContact CB-OE1 3.26Å; S71-E109 PolarHBondContact OG-OE1 2.96Å
72	K	92.3	Very high	88.5	Confident	129 Å²	129	62.5 Å²	62.5	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-61.9	-39.7	175	-69.8	174.8	-177.6	173.9	0	112.9	T68 L69 K70 R76	T68-K72 WeakPolarHBondContact O-CG 3.43Å; T68-K72 PolarHBondContact O-N 3.12Å; T68-K72 VanDerWaalsContact O-N 3.17Å; L69-K72 WeakPolarHBondContact O-CB 3.44Å; L69-K72 PolarHBondContact O-N 2.88Å; K70-K72 VanDerWaalsContact C-N 3.33Å; K70-K72 PolarHBondContact O-N 2.93Å; K72-R76 WeakPolarHBondContact O-CG 3.23Å; K72-R76 PolarHBondContact O-N 3.09Å
73	V	92.3	Very high	89.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-44.2	176.1	179.1	0	0	0	0	110.5	Y52 A55 F56 L69 K70 S71 R76 S77	Y52-V73 HydrophobicContact CD1-CG1 3.98Å; Y52-V73 HydrophobicContact CD2-CG1 3.99Å; Y52-V73 HydrophobicContact CE1-CG1 3.86Å; Y52-V73 HydrophobicContact CE2-CG1 3.88Å; Y52-V73 HydrophobicContact CG-CG1 4.05Å; A55-V73 HydrophobicContact CB-CG2 3.63Å; F56-V73 HydrophobicContact CE1-CG2 4.28Å; F56-V73 HydrophobicContact CE2-CG1 4.43Å; F56-V73 HydrophobicContact CE2-CG2 4.27Å; F56-V73 HydrophobicContact CZ-CB 4.13Å; F56-V73 HydrophobicContact CZ-CG1 4.4Å; F56-V73 HydrophobicContact CZ-CG2 3.74Å; L69-V73 HydrophobicContact CD1-CG2 4.46Å; L69-V73 HydrophobicContact CG-CG2 4.37Å; L69-V73 WeakPolarHBondContact O-CG2 3.48Å; L69-V73 PolarHBondContact O-N 2.77Å; K70-V73 WeakPolarHBondContact O-CB 3.29Å; K70-V73 PolarHBondContact O-N 3.44Å; K70-V73 VanDerWaalsContact O-N 3.15Å; S71-V73 PolarHBondContact O-N 3.31Å; V73-R76 WeakPolarHBondContact O-CG 3.06Å; V73-S77 VanDerWaalsContact O-CB 3.24Å; V73-S77 WeakPolarHBondContact O-CB 3.42Å; V73-S77 PolarHBondContact O-N 2.68Å; V73-S77 PolarHBondContact O-OG 3.44Å
74	H	89.7	Confident	89.6	Confident	20 Å²	20	63 Å²	63	9%	0.093	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-47.2	177.3	-74.7	-153.7	0	0	0	111	Y52 K70 S71 S77 A78 P107 E109 Y110	Y52-H74 AromaticContact CE1-CD2 3.79Å; Y52-H74 AromaticContact CE1-NE2 3.86Å; Y52-H74 AromaticContact CZ-CD2 3.75Å; Y52-H74 PolarHBondContact OH-CD2 3.13Å; Y52-H74 PolarHBondContact OH-NE2 3.05Å; K70-H74 WeakPolarHBondContact CG-NE2 3.38Å; K70-H74 WeakPolarHBondContact O-CB 3.44Å; K70-H74 PolarHBondContact O-CD2 3.37Å; K70-H74 PolarHBondContact O-N 2.77Å; S71-H74 WeakPolarHBondContact O-CB 3.42Å; S71-H74 PolarHBondContact O-N 3.35Å; H74-S77 PolarHBondContact O-N 2.98Å; H74-A78 VanDerWaalsContact O-CB 3.29Å; H74-A78 WeakPolarHBondContact O-CB 3.49Å; H74-A78 PolarHBondContact O-N 3.18Å; H74-P107 WeakPolarHBondContact CE1-CG 3.38Å; H74-P107 WeakPolarHBondContact ND1-CB 3.36Å; H74-P107 WeakPolarHBondContact ND1-CG 3.37Å; H74-E109 HydrophobicContact CB-CB 3.93Å; H74-E109 HydrophobicContact CB-CG 4.09Å; H74-E109 IonicContact ND1-OE2 3.09Å; H74-Y110 HydrophobicContact CB-CD2 4.38Å; H74-Y110 HydrophobicContact CB-CE2 4.09Å
75	R	92.9	Very high	90	Very high	104 Å²	104	55.3 Å²	55.3	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-54.8	179.6	-173.9	60.3	59.2	97.1	1.4	113	S71 S77 A78 E79 E109	S71-R75 PolarHBondContact O-N 3.33Å; R75-S77 VanDerWaalsContact C-N 3.27Å; R75-S77 PolarHBondContact O-N 3.31Å; R75-A78 WeakPolarHBondContact O-CB 3.3Å; R75-A78 PolarHBondContact O-N 2.85Å; R75-E79 WeakPolarHBondContact O-CG 3.26Å; R75-E79 PolarHBondContact O-N 3.34Å; R75-E109 HydrophobicContact CB-CB 4.2Å; R75-E109 HydrophobicContact CB-CG 4.17Å
76	R	95.5	Very high	90	Very high	64 Å²	64	52.5 Å²	52.5	24%	0.242	24%	0.244	C	C	.	.	H	α-helix	trans	-65.3	-31.5	-179.3	66.7	-170.5	179.8	-116.6	10.9	112.7	D51 K72 V73 R80	D51-R76 VanDerWaalsContact CG-NE 3.3Å; D51-R76 IonicContact OD1-CZ 3.12Å; D51-R76 IonicContact OD1-NE 2.68Å; D51-R76 PolarHBondContact OD1-NE 2.77Å; D51-R76 IonicContact OD1-NH2 2.82Å; D51-R76 PolarHBondContact OD1-NH2 3.11Å; D51-R76 WeakPolarHBondContact OD2-CD 3.41Å; D51-R76 IonicContact OD2-CZ 3.66Å; D51-R76 IonicContact OD2-NE 3.26Å; D51-R76 PolarHBondContact OD2-NE 3.22Å; D51-R76 IonicContact OD2-NH2 2.84Å; K72-R76 WeakPolarHBondContact O-CG 3.23Å; K72-R76 PolarHBondContact O-N 3.09Å; V73-R76 WeakPolarHBondContact O-CG 3.06Å; R76-R80 WeakPolarHBondContact O-CG 3.47Å; R76-R80 PolarHBondContact O-N 3.38Å; R76-R80 VanDerWaalsContact O-N 3.11Å
77	S	93.7	Very high	90	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-70.9	-40.2	175	-59.6	0	0	0	0	111.9	Y52 V73 H74 R75 E79 R80 L81 Y110	Y52-S77 WeakPolarHBondContact CE2-OG 3.36Å; V73-S77 VanDerWaalsContact O-CB 3.24Å; V73-S77 WeakPolarHBondContact O-CB 3.42Å; V73-S77 PolarHBondContact O-N 2.68Å; V73-S77 PolarHBondContact O-OG 3.44Å; H74-S77 PolarHBondContact O-N 2.98Å; R75-S77 VanDerWaalsContact C-N 3.27Å; R75-S77 PolarHBondContact O-N 3.31Å; S77-E79 VanDerWaalsContact C-N 3.34Å; S77-E79 PolarHBondContact O-N 3.46Å; S77-R80 PolarHBondContact O-N 3.13Å; S77-L81 WeakPolarHBondContact O-CB 3.27Å; S77-L81 PolarHBondContact O-N 3.04Å; S77-Y110 WeakPolarHBondContact CB-OH 3.27Å
78	A	91.9	Very high	90.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-39.8	173.7	0	0	0	0	0	112.3	H74 R75 L81 R82 E109 Y110 T113	H74-A78 VanDerWaalsContact O-CB 3.29Å; H74-A78 WeakPolarHBondContact O-CB 3.49Å; H74-A78 PolarHBondContact O-N 3.18Å; R75-A78 WeakPolarHBondContact O-CB 3.3Å; R75-A78 PolarHBondContact O-N 2.85Å; A78-L81 PolarHBondContact O-N 2.77Å; A78-R82 WeakPolarHBondContact O-CB 3.42Å; A78-R82 PolarHBondContact O-N 2.99Å; A78-E109 WeakPolarHBondContact CB-O 3.29Å; A78-Y110 HydrophobicContact CB-CD1 3.69Å; A78-Y110 HydrophobicContact CB-CD2 4.38Å; A78-Y110 HydrophobicContact CB-CE1 4.03Å; A78-Y110 HydrophobicContact CB-CG 3.89Å; A78-T113 HydrophobicContact CB-CG2 4.1Å
79	E	93.9	Very high	90.1	Very high	75 Å²	75	50.2 Å²	50.2	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-46.6	175.3	-71.8	167.7	170.7	0	0	111.6	R75 S77 L81 R82 D83 T113	R75-E79 WeakPolarHBondContact O-CG 3.26Å; R75-E79 PolarHBondContact O-N 3.34Å; S77-E79 VanDerWaalsContact C-N 3.34Å; S77-E79 PolarHBondContact O-N 3.46Å; E79-L81 VanDerWaalsContact C-N 3.3Å; E79-L81 PolarHBondContact O-N 3.38Å; E79-R82 WeakPolarHBondContact O-CB 3.26Å; E79-R82 PolarHBondContact O-N 3.36Å; E79-D83 WeakPolarHBondContact O-CB 3.38Å; E79-D83 PolarHBondContact O-N 3.34Å; E79-T113 HydrophobicContact CG-CG2 3.96Å
80	R	94.7	Very high	89.7	Confident	79 Å²	79	48.4 Å²	48.4	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-60.4	-40.1	174.9	-70.2	176.8	-167.1	126.1	-6.1	112.3	I48 D51 R76 S77 D83 L84	I48-R80 HydrophobicContact CD1-CB 4.1Å; I48-R80 HydrophobicContact CG1-CB 4.17Å; D51-R80 IonicContact OD2-CZ 2.68Å; D51-R80 IonicContact OD2-NH1 3.65Å; D51-R80 PolarHBondContact OD2-NH1 2.77Å; D51-R80 IonicContact OD2-NH2 3.08Å; D51-R80 PolarHBondContact OD2-NH2 3.24Å; R76-R80 WeakPolarHBondContact O-CG 3.47Å; R76-R80 PolarHBondContact O-N 3.38Å; R76-R80 VanDerWaalsContact O-N 3.11Å; S77-R80 PolarHBondContact O-N 3.13Å; R80-D83 PolarHBondContact O-N 3.31Å; R80-L84 WeakPolarHBondContact O-CB 3.35Å; R80-L84 PolarHBondContact O-N 2.99Å
81	L	92.4	Very high	89.6	Confident	39 Å²	39	45.7 Å²	45.7	20%	0.204	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-42.9	176.3	-178.5	58.7	0	0	0	111.5	I48 S77 A78 E79 D83 L84 C85 L99 Y110 L114	I48-L81 HydrophobicContact CD1-CB 4.44Å; S77-L81 WeakPolarHBondContact O-CB 3.27Å; S77-L81 PolarHBondContact O-N 3.04Å; A78-L81 PolarHBondContact O-N 2.77Å; E79-L81 VanDerWaalsContact C-N 3.3Å; E79-L81 PolarHBondContact O-N 3.38Å; L81-D83 VanDerWaalsContact C-N 3.32Å; L81-D83 PolarHBondContact O-N 2.72Å; L81-L84 HydrophobicContact CD1-CD2 4.33Å; L81-L84 WeakPolarHBondContact O-CB 3.38Å; L81-L84 PolarHBondContact O-N 3.12Å; L81-C85 PolarHBondContact O-N 2.92Å; L81-C85 PolarHBondContact O-SG 3.43Å; L81-L99 HydrophobicContact CD2-CD1 4.01Å; L81-Y110 HydrophobicContact CD2-CD1 4.25Å; L81-Y110 HydrophobicContact CD2-CE1 4.13Å; L81-L114 HydrophobicContact CD2-CD1 4.14Å; L81-L114 HydrophobicContact CG-CD2 4.38Å
82	R	91.6	Very high	89.7	Confident	71 Å²	71	43.9 Å²	43.9	27%	0.268	20%	0.204	S	C	.	.	H	α-helix	trans	-58	-46.6	173.4	179.7	-158.5	65.8	-154.6	-4.9	110.9	A78 E79 L84 C85 C86 T113 L114 L117	A78-R82 WeakPolarHBondContact O-CB 3.42Å; A78-R82 PolarHBondContact O-N 2.99Å; E79-R82 WeakPolarHBondContact O-CB 3.26Å; E79-R82 PolarHBondContact O-N 3.36Å; R82-L84 VanDerWaalsContact C-N 3.34Å; R82-L84 PolarHBondContact O-N 3.46Å; R82-C85 WeakPolarHBondContact O-CA 3.45Å; R82-C85 WeakPolarHBondContact O-CB 3.48Å; R82-C85 PolarHBondContact O-N 3.09Å; R82-C85 VanDerWaalsContact O-N 3.1Å; R82-C86 PolarHBondContact O-N 2.9Å; R82-C86 PolarHBondContact O-SG 2.99Å; R82-C86 VanDerWaalsContact O-SG 3.38Å; R82-T113 HydrophobicContact CB-CG2 4.08Å; R82-L114 HydrophobicContact CB-CD2 3.91Å; R82-L117 HydrophobicContact CG-CD2 4.17Å; R82-L117 HydrophobicContact CG-CG 4.46Å
83	D	91.2	Very high	89.3	Confident	84 Å²	84	37.9 Å²	37.9	45%	0.449	18%	0.178	S	C	.	.	H	α-helix	trans	-65.9	-38.8	-178	-64.1	-11.7	0	0	0	111.2	E79 R80 L81 C86 A87	E79-D83 WeakPolarHBondContact O-CB 3.38Å; E79-D83 PolarHBondContact O-N 3.34Å; R80-D83 PolarHBondContact O-N 3.31Å; L81-D83 VanDerWaalsContact C-N 3.32Å; L81-D83 PolarHBondContact O-N 2.72Å; D83-C86 PolarHBondContact O-N 2.86Å; D83-A87 VanDerWaalsContact O-CB 3.27Å; D83-A87 WeakPolarHBondContact O-CB 3.44Å; D83-A87 PolarHBondContact O-N 3.32Å
84	L	91.2	Very high	88.8	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.073	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-47.2	168.8	172.9	64.6	0	0	0	111.4	R40 A41 A44 R80 L81 R82 C86 A87 N88 F92	R40-L84 HydrophobicContact CB-CD1 4.04Å; A41-L84 HydrophobicContact CB-CD1 4.04Å; A41-L84 HydrophobicContact CB-CD2 4.23Å; A44-L84 HydrophobicContact CB-CB 4.24Å; A44-L84 HydrophobicContact CB-CD2 4.03Å; A44-L84 HydrophobicContact CB-CG 4.49Å; R80-L84 WeakPolarHBondContact O-CB 3.35Å; R80-L84 PolarHBondContact O-N 2.99Å; L81-L84 HydrophobicContact CD1-CD2 4.33Å; L81-L84 WeakPolarHBondContact O-CB 3.38Å; L81-L84 PolarHBondContact O-N 3.12Å; R82-L84 VanDerWaalsContact C-N 3.34Å; R82-L84 PolarHBondContact O-N 3.46Å; L84-C86 VanDerWaalsContact C-N 3.34Å; L84-C86 PolarHBondContact O-N 3.42Å; L84-A87 PolarHBondContact O-N 2.88Å; L84-N88 PolarHBondContact O-N 3.23Å; L84-F92 HydrophobicContact CD1-CE1 4.49Å; L84-F92 HydrophobicContact CD2-CD1 4.19Å; L84-F92 HydrophobicContact CD2-CE1 4.03Å; L84-F92 HydrophobicContact CG-CD1 4.12Å; L84-F92 HydrophobicContact CG-CE1 4.24Å
85	C	88.9	Confident	88.4	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.02	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-44.4	178.7	-68.2	0	0	0	0	111.9	L81 R82 R89 F92 I93 L117	L81-C85 PolarHBondContact O-N 2.92Å; L81-C85 PolarHBondContact O-SG 3.43Å; R82-C85 WeakPolarHBondContact O-CA 3.45Å; R82-C85 WeakPolarHBondContact O-CB 3.48Å; R82-C85 PolarHBondContact O-N 3.09Å; R82-C85 VanDerWaalsContact O-N 3.1Å; C85-R89 WeakPolarHBondContact O-CA 3.4Å; C85-R89 PolarHBondContact O-N 2.89Å; C85-F92 HydrophobicContact CB-CB 4.33Å; C85-F92 PolarHBondContact SG-O 3.29Å; C85-I93 VanDerWaalsContact O-CG1 3.27Å; C85-I93 WeakPolarHBondContact O-CG1 3.34Å; C85-L117 HydrophobicContact CB-CD1 3.76Å; C85-L117 HydrophobicContact CB-CD2 4.22Å
86	C	85.6	Confident	88	Confident	61 Å²	61	33.4 Å²	33.4	41%	0.412	16%	0.162	S	C	.	.	H	α-helix	trans	-64.3	-41.1	175.6	-69.5	0	0	0	0	112.5	R82 D83 L84 R89 L117	R82-C86 PolarHBondContact O-N 2.9Å; R82-C86 PolarHBondContact O-SG 2.99Å; R82-C86 VanDerWaalsContact O-SG 3.38Å; D83-C86 PolarHBondContact O-N 2.86Å; L84-C86 VanDerWaalsContact C-N 3.34Å; L84-C86 PolarHBondContact O-N 3.42Å; C86-R89 WeakPolarHBondContact O-CG 3.38Å; C86-L117 VanDerWaalsContact SG-CD2 3.58Å
87	A	85.2	Confident	87.3	Confident	45 Å²	45	31.1 Å²	31.1	37%	0.372	16%	0.155	S	C	.	.	H	α-helix	trans	-69.6	-39.6	-178.4	0	0	0	0	0	112.7	D83 L84	D83-A87 VanDerWaalsContact O-CB 3.27Å; D83-A87 WeakPolarHBondContact O-CB 3.44Å; D83-A87 PolarHBondContact O-N 3.32Å; L84-A87 PolarHBondContact O-N 2.88Å
88	N	85.8	Confident	86.5	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-89.3	-20	179.3	-77.2	2.8	0	0	0	112.8	R37 L84 F92	R37-N88 PolarHBondContact NH1-O 3.47Å; R37-N88 PolarHBondContact NH2-O 2.9Å; R37-N88 PolarHBondContact O-ND2 3.34Å; R37-N88 VanDerWaalsContact O-ND2 3.12Å; L84-N88 PolarHBondContact O-N 3.23Å; N88-F92 HydrophobicContact CB-CB 4.13Å; N88-F92 HydrophobicContact CB-CD1 4.4Å; N88-F92 HydrophobicContact CB-CD2 3.45Å; N88-F92 VanDerWaalsContact CB-CD2 3.45Å; N88-F92 HydrophobicContact CB-CE2 3.88Å; N88-F92 HydrophobicContact CB-CG 3.75Å; N88-F92 WeakPolarHBondContact ND2-CE2 3.25Å; N88-F92 WeakPolarHBondContact ND2-CZ 3.38Å
89	R	82.3	Confident	85.8	Confident	119 Å²	119	33.4 Å²	33.4	45%	0.449	17%	0.166	S	C	.	.			trans	56.8	-171.3	177.6	-53.3	179.9	177	175.9	2.9	113.2	C85 C86 T91 F92 I93 P122	C85-R89 WeakPolarHBondContact O-CA 3.4Å; C85-R89 PolarHBondContact O-N 2.89Å; C86-R89 WeakPolarHBondContact O-CG 3.38Å; R89-T91 PolarHBondContact O-N 3.2Å; R89-F92 PolarHBondContact O-N 3.15Å; R89-F92 VanDerWaalsContact O-N 3.09Å; R89-I93 HydrophobicContact CB-CD1 4.22Å; R89-I93 HydrophobicContact CG-CD1 4.47Å; R89-P122 HydrophobicContact CB-CG 4.15Å; R89-P122 HydrophobicContact CG-CG 3.94Å
90	G	81.5	Confident	84.9	Confident	5 Å²	5	29.9 Å²	29.9	5%	0.052	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-120.1	171	0	0	0	0	0	113.3	F92 I93 K94	G90-F92 PolarHBondContact O-N 3.48Å; G90-I93 PolarHBondContact O-N 2.94Å; G90-I93 VanDerWaalsContact O-N 3.1Å; G90-K94 PolarHBondContact O-N 2.8Å
91	T	83.5	Confident	83.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-51.7	-41	179.8	-49.2	0	0	0	0	112.9	R89 K94 V95 S185 D188 I189 I192 M219	R89-T91 PolarHBondContact O-N 3.2Å; T91-K94 PolarHBondContact O-N 2.89Å; T91-V95 HydrophobicContact CG2-CG2 4.48Å; T91-V95 WeakPolarHBondContact O-CG2 3.39Å; T91-V95 PolarHBondContact O-N 2.86Å; T91-S185 VanDerWaalsContact OG1-CA 3.27Å; T91-S185 WeakPolarHBondContact OG1-CA 3.2Å; T91-S185 WeakPolarHBondContact OG1-CB 3.35Å; T91-S185 PolarHBondContact OG1-OG 3.18Å; T91-S185 VanDerWaalsContact OG1-OG 3.09Å; T91-D188 HydrophobicContact CG2-CB 3.98Å; T91-D188 PolarHBondContact OG1-OD2 3.09Å; T91-I189 HydrophobicContact CG2-CG1 3.77Å; T91-I192 HydrophobicContact CG2-CD1 4.29Å; T91-M219 HydrophobicContact CG2-CE 4.15Å
92	F	87	Confident	82.6	Confident	9 Å²	9	26.2 Å²	26.2	4%	0.039	14%	0.138	C	C	.	.	H	α-helix	trans	-68.7	-40.5	-179.1	-75.1	-100.2	0	0	0	111.9	A41 L84 C85 N88 R89 G90 K94 V95 G96 D188 V191 I192	A41-F92 HydrophobicContact CB-CE1 4.06Å; A41-F92 HydrophobicContact CB-CZ 4.02Å; L84-F92 HydrophobicContact CD1-CE1 4.49Å; L84-F92 HydrophobicContact CD2-CD1 4.19Å; L84-F92 HydrophobicContact CD2-CE1 4.03Å; L84-F92 HydrophobicContact CG-CD1 4.12Å; L84-F92 HydrophobicContact CG-CE1 4.24Å; C85-F92 HydrophobicContact CB-CB 4.33Å; C85-F92 PolarHBondContact SG-O 3.29Å; N88-F92 HydrophobicContact CB-CB 4.13Å; N88-F92 HydrophobicContact CB-CD1 4.4Å; N88-F92 HydrophobicContact CB-CD2 3.45Å; N88-F92 VanDerWaalsContact CB-CD2 3.45Å; N88-F92 HydrophobicContact CB-CE2 3.88Å; N88-F92 HydrophobicContact CB-CG 3.75Å; N88-F92 WeakPolarHBondContact ND2-CE2 3.25Å; N88-F92 WeakPolarHBondContact ND2-CZ 3.38Å; R89-F92 PolarHBondContact O-N 3.15Å; R89-F92 VanDerWaalsContact O-N 3.09Å; G90-F92 PolarHBondContact O-N 3.48Å; F92-K94 VanDerWaalsContact C-N 3.31Å; F92-K94 PolarHBondContact O-N 2.88Å; F92-V95 PolarHBondContact O-N 2.9Å; F92-G96 PolarHBondContact O-N 2.96Å; F92-D188 HydrophobicContact CD2-CB 4.24Å; F92-D188 HydrophobicContact CE2-CB 3.8Å; F92-V191 HydrophobicContact CZ-CG1 4.47Å; F92-I192 HydrophobicContact CD1-CD1 4.23Å; F92-I192 HydrophobicContact CD1-CG1 4.39Å; F92-I192 HydrophobicContact CE1-CD1 4.12Å; F92-I192 HydrophobicContact CE1-CG1 3.83Å; F92-I192 HydrophobicContact CE2-CD1 4.46Å; F92-I192 HydrophobicContact CG-CD1 4.44Å; F92-I192 HydrophobicContact CZ-CD1 4.24Å; F92-I192 HydrophobicContact CZ-CG1 3.93Å
93	I	84.4	Confident	81.2	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-44.8	172.8	-69	178.8	0	0	0	109.7	C85 R89 G90 V95 G96 Q97 L117 P122	C85-I93 VanDerWaalsContact O-CG1 3.27Å; C85-I93 WeakPolarHBondContact O-CG1 3.34Å; R89-I93 HydrophobicContact CB-CD1 4.22Å; R89-I93 HydrophobicContact CG-CD1 4.47Å; G90-I93 PolarHBondContact O-N 2.94Å; G90-I93 VanDerWaalsContact O-N 3.1Å; I93-V95 PolarHBondContact O-N 2.94Å; I93-G96 CarbonylContact O-C 3.49Å; I93-G96 PolarHBondContact O-N 3.32Å; I93-Q97 HydrophobicContact CG2-CG 4.22Å; I93-Q97 WeakPolarHBondContact O-CB 3.4Å; I93-Q97 VanDerWaalsContact O-CG 3.28Å; I93-Q97 WeakPolarHBondContact O-CG 3.45Å; I93-Q97 PolarHBondContact O-N 3.43Å; I93-L117 HydrophobicContact CG2-CB 4.33Å; I93-P122 HydrophobicContact CD1-CG 4.05Å
94	K	81.5	Confident	79.4	Confident	11 Å²	11	26.8 Å²	26.8	5%	0.048	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-43.4	-179.8	-171.5	68.4	-178.1	-164.5	0	112.5	G90 T91 F92 Q97 H98 S157 L158 M219 E222 D307	G90-K94 PolarHBondContact O-N 2.8Å; T91-K94 PolarHBondContact O-N 2.89Å; F92-K94 VanDerWaalsContact C-N 3.31Å; F92-K94 PolarHBondContact O-N 2.88Å; K94-Q97 WeakPolarHBondContact O-CB 3.45Å; K94-Q97 PolarHBondContact O-N 2.91Å; K94-H98 PolarHBondContact O-CD2 3.25Å; K94-H98 PolarHBondContact O-N 3.42Å; K94-S157 WeakPolarHBondContact CD-OG 3.24Å; K94-L158 HydrophobicContact CB-CD2 4.38Å; K94-M219 HydrophobicContact CB-SD 4.09Å; K94-M219 HydrophobicContact CG-SD 3.65Å; K94-E222 VanDerWaalsContact CE-CD 3.47Å; K94-E222 VanDerWaalsContact CE-OE1 3.29Å; K94-E222 WeakPolarHBondContact CE-OE1 3.14Å; K94-E222 WeakPolarHBondContact CE-OE2 3.13Å; K94-E222 IonicContact NZ-OE1 2.58Å; K94-E222 IonicContact NZ-OE2 2.84Å; K94-E222 PolarHBondContact NZ-OE2 3.33Å; K94-D307 IonicContact NZ-OD2 3.35Å
95	V	82.7	Confident	77.9	Confident	19 Å²	19	27.1 Å²	27.1	12%	0.115	14%	0.141	C	C	.	.	H	α-helix	trans	-63.6	-42.4	173.7	172.3	0	0	0	0	110.9	T91 F92 I93 Q97 H98 L99 I192 A215	T91-V95 HydrophobicContact CG2-CG2 4.48Å; T91-V95 WeakPolarHBondContact O-CG2 3.39Å; T91-V95 PolarHBondContact O-N 2.86Å; F92-V95 PolarHBondContact O-N 2.9Å; I93-V95 PolarHBondContact O-N 2.94Å; V95-Q97 VanDerWaalsContact C-N 3.34Å; V95-Q97 PolarHBondContact O-N 3.37Å; V95-H98 WeakPolarHBondContact O-CB 3.29Å; V95-H98 PolarHBondContact O-N 3.46Å; V95-L99 HydrophobicContact CG1-CD1 4.3Å; V95-L99 WeakPolarHBondContact O-CG 3.3Å; V95-L99 PolarHBondContact O-N 3.4Å; V95-I192 HydrophobicContact CG2-CD1 4.14Å; V95-A215 HydrophobicContact CG2-CB 4.21Å
96	G	83.8	Confident	77.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.6	-38.2	174.3	0	0	0	0	0	113.4	F92 I93 L99 G100	F92-G96 PolarHBondContact O-N 2.96Å; I93-G96 CarbonylContact O-C 3.49Å; I93-G96 PolarHBondContact O-N 3.32Å; G96-L99 PolarHBondContact O-N 2.87Å; G96-G100 PolarHBondContact O-N 3.47Å
97	Q	80.2	Confident	76.6	Confident	17 Å²	17	26.4 Å²	26.4	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-63	-43.4	173.3	-78.3	173.3	-14.6	0	0	111.3	I93 K94 V95 G100 A101 L117 H118 S157	I93-Q97 HydrophobicContact CG2-CG 4.22Å; I93-Q97 WeakPolarHBondContact O-CB 3.4Å; I93-Q97 VanDerWaalsContact O-CG 3.28Å; I93-Q97 WeakPolarHBondContact O-CG 3.45Å; I93-Q97 PolarHBondContact O-N 3.43Å; K94-Q97 WeakPolarHBondContact O-CB 3.45Å; K94-Q97 PolarHBondContact O-N 2.91Å; V95-Q97 VanDerWaalsContact C-N 3.34Å; V95-Q97 PolarHBondContact O-N 3.37Å; Q97-G100 PolarHBondContact O-N 3.45Å; Q97-A101 PolarHBondContact O-N 3.4Å; Q97-A101 VanDerWaalsContact O-N 3.15Å; Q97-L117 HydrophobicContact CG-CB 4.02Å; Q97-L117 PolarHBondContact NE2-O 3.25Å; Q97-H118 WeakPolarHBondContact CA-NE2 3.21Å; Q97-H118 VanDerWaalsContact CB-CE1 3.42Å; Q97-H118 WeakPolarHBondContact CB-CE1 3.47Å; Q97-H118 PolarHBondContact O-CE1 2.93Å; Q97-H118 PolarHBondContact O-NE2 3.46Å; Q97-S157 PolarHBondContact OE1-OG 3.2Å
98	H	77.2	Confident	76.2	Confident	26 Å²	26	31.1 Å²	31.1	12%	0.12	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-46.3	173.6	-73.2	-43.5	0	0	0	111.8	K94 V95 G100 A101 L102 E222	K94-H98 PolarHBondContact O-CD2 3.25Å; K94-H98 PolarHBondContact O-N 3.42Å; V95-H98 WeakPolarHBondContact O-CB 3.29Å; V95-H98 PolarHBondContact O-N 3.46Å; H98-G100 PolarHBondContact O-N 3.4Å; H98-A101 PolarHBondContact O-N 3.17Å; H98-L102 WeakPolarHBondContact O-CG 3.36Å; H98-E222 IonicContact NE2-OE1 2.77Å
99	L	78.1	Confident	76.3	Confident	22 Å²	22	32.2 Å²	32.2	12%	0.115	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-45.2	174.7	-69.9	169.9	0	0	0	111.9	L81 V95 G96 A101 L102 L106 L114 L211	L81-L99 HydrophobicContact CD2-CD1 4.01Å; V95-L99 HydrophobicContact CG1-CD1 4.3Å; V95-L99 WeakPolarHBondContact O-CG 3.3Å; V95-L99 PolarHBondContact O-N 3.4Å; G96-L99 PolarHBondContact O-N 2.87Å; L99-A101 PolarHBondContact O-N 2.91Å; L99-L102 PolarHBondContact O-N 2.82Å; L99-L102 VanDerWaalsContact O-N 3.12Å; L99-L106 HydrophobicContact CB-CD1 3.9Å; L99-L106 HydrophobicContact CD2-CD1 3.49Å; L99-L106 VanDerWaalsContact CD2-CD1 3.49Å; L99-L106 HydrophobicContact CG-CD1 4.32Å; L99-L106 WeakPolarHBondContact O-CD1 3.47Å; L99-L114 HydrophobicContact CB-CD1 3.6Å; L99-L114 HydrophobicContact CD1-CD1 4.08Å; L99-L114 HydrophobicContact CG-CD1 4.5Å; L99-L211 HydrophobicContact CD2-CD2 3.2Å; L99-L211 HydrophobicContact CG-CD2 3.85Å
100	G	74.8	Confident	76.4	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63	-20.7	178.9	0	0	0	0	0	114.6	G96 Q97 H98	G96-G100 PolarHBondContact O-N 3.47Å; Q97-G100 PolarHBondContact O-N 3.45Å; H98-G100 PolarHBondContact O-N 3.4Å
101	A	69.8	Low	76.4	Confident	15 Å²	15	28.1 Å²	28.1	12%	0.124	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.8	177.9	0	0	0	0	0	113.8	Q97 H98 L99 D103	Q97-A101 PolarHBondContact O-N 3.4Å; Q97-A101 VanDerWaalsContact O-N 3.15Å; H98-A101 PolarHBondContact O-N 3.17Å; L99-A101 PolarHBondContact O-N 2.91Å; A101-D103 VanDerWaalsContact C-N 3.34Å; A101-D103 PolarHBondContact O-N 3.49Å
102	L	69.3	Low	76.4	Confident	27 Å²	27	30.1 Å²	30.1	14%	0.141	15%	0.152	C	C	.	.			trans	-95	50.6	-175.5	-67.7	169.8	0	0	0	112.1	H98 L99 Y104 L105 L106 W210 L211	H98-L102 WeakPolarHBondContact O-CG 3.36Å; L99-L102 PolarHBondContact O-N 2.82Å; L99-L102 VanDerWaalsContact O-N 3.12Å; L102-Y104 PolarHBondContact O-N 2.85Å; L102-L105 HydrophobicContact CB-CB 4.2Å; L102-L105 HydrophobicContact CB-CD2 4.21Å; L102-L105 HydrophobicContact CD1-CD2 3.8Å; L102-L105 HydrophobicContact CD2-CD2 4.12Å; L102-L105 HydrophobicContact CG-CD2 4.24Å; L102-L105 PolarHBondContact O-N 3.2Å; L102-L106 HydrophobicContact CB-CD1 4.25Å; L102-L106 HydrophobicContact CB-CG 4.27Å; L102-L106 PolarHBondContact O-N 2.8Å; L102-W210 HydrophobicContact CD1-CH2 4.27Å; L102-L211 HydrophobicContact CD1-CD1 4.35Å
103	D	61.9	Low	76.4	Confident	68 Å²	68	30.3 Å²	30.3	36%	0.364	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-27.5	-172.8	-82.2	-26.9	0	0	0	115.6	A101 T111 K115	A101-D103 VanDerWaalsContact C-N 3.34Å; A101-D103 PolarHBondContact O-N 3.49Å; D103-T111 WeakPolarHBondContact OD1-CB 3.21Å; D103-T111 PolarHBondContact OD1-OG1 2.79Å; D103-K115 WeakPolarHBondContact OD1-CE 3.49Å; D103-K115 IonicContact OD1-NZ 2.72Å; D103-K115 PolarHBondContact OD1-NZ 3Å; D103-K115 WeakPolarHBondContact OD2-CE 3.38Å; D103-K115 IonicContact OD2-NZ 2.6Å; D103-K115 PolarHBondContact OD2-NZ 3.49Å
104	Y	53.6	Low	76.5	Confident	98 Å²	98	30.2 Å²	30.2	38%	0.384	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-10.8	-179.3	-61.3	-85.9	0	0	0	114.1	L102 D435 R438	L102-Y104 PolarHBondContact O-N 2.85Å; Y104-D435 VanDerWaalsContact CD2-OD1 3.28Å; Y104-D435 WeakPolarHBondContact CD2-OD1 3.49Å; Y104-D435 WeakPolarHBondContact CD2-OD2 3.3Å; Y104-D435 WeakPolarHBondContact CE2-OD1 3.48Å; Y104-R438 PolarHBondContact OH-NH1 3.5Å
105	L	59.7	Low	76.5	Confident	22 Å²	22	34.1 Å²	34.1	12%	0.115	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-34.6	-173.2	163.6	64.9	0	0	0	111.5	L102 F208 W210 L420	L102-L105 HydrophobicContact CB-CB 4.2Å; L102-L105 HydrophobicContact CB-CD2 4.21Å; L102-L105 HydrophobicContact CD1-CD2 3.8Å; L102-L105 HydrophobicContact CD2-CD2 4.12Å; L102-L105 HydrophobicContact CG-CD2 4.24Å; L102-L105 PolarHBondContact O-N 3.2Å; L105-F208 HydrophobicContact CD1-CE1 4.33Å; L105-F208 HydrophobicContact CG-CE1 4.47Å; L105-W210 HydrophobicContact CD2-CH2 3.71Å; L105-W210 HydrophobicContact CD2-CZ2 3.46Å; L105-W210 VanDerWaalsContact CD2-CZ2 3.46Å; L105-L420 HydrophobicContact CB-CD1 3.65Å; L105-L420 HydrophobicContact CD1-CB 4.26Å; L105-L420 HydrophobicContact CD1-CD1 3.32Å; L105-L420 HydrophobicContact CD1-CG 4.41Å; L105-L420 HydrophobicContact CD2-CD1 4.3Å; L105-L420 HydrophobicContact CG-CD1 3.88Å
106	L	70.6	Confident	76.5	Confident	14 Å²	14	36.4 Å²	36.4	7%	0.073	18%	0.184	C	C	.	.	S	Bend	trans	-105	152.9	179.9	-64	178.8	0	0	0	110.7	L99 L102 T111 F208	L99-L106 HydrophobicContact CB-CD1 3.9Å; L99-L106 HydrophobicContact CD2-CD1 3.49Å; L99-L106 VanDerWaalsContact CD2-CD1 3.49Å; L99-L106 HydrophobicContact CG-CD1 4.32Å; L99-L106 WeakPolarHBondContact O-CD1 3.47Å; L102-L106 HydrophobicContact CB-CD1 4.25Å; L102-L106 HydrophobicContact CB-CG 4.27Å; L102-L106 PolarHBondContact O-N 2.8Å; L106-T111 HydrophobicContact CB-CG2 3.64Å; L106-F208 HydrophobicContact CD2-CD1 4.33Å; L106-F208 HydrophobicContact CD2-CE1 3.38Å; L106-F208 HydrophobicContact CD2-CZ 3.52Å
107	P	75.5	Confident	76.3	Confident	34 Å²	34	36.6 Å²	36.6	22%	0.221	19%	0.185	C	C	.	.			trans	-54.8	142.4	173.6	-21.1	31	0	0	0	111.3	H74 E109 Y110 T111	H74-P107 WeakPolarHBondContact CE1-CG 3.38Å; H74-P107 WeakPolarHBondContact ND1-CB 3.36Å; H74-P107 WeakPolarHBondContact ND1-CG 3.37Å; P107-E109 VanDerWaalsContact CB-OE2 3.23Å; P107-E109 WeakPolarHBondContact CB-OE2 3.49Å; P107-E109 PolarHBondContact O-N 2.86Å; P107-Y110 HydrophobicContact CB-CD2 4.19Å; P107-Y110 HydrophobicContact CG-CD2 4.06Å; P107-Y110 WeakPolarHBondContact O-CB 3.42Å; P107-Y110 PolarHBondContact O-N 3.34Å; P107-T111 PolarHBondContact O-N 3.14Å
108	E	77.8	Confident	75.9	Confident	144 Å²	144	38.3 Å²	38.3	67%	0.673	19%	0.193	S	C	*	.	H	α-helix	trans	-52.9	-34.7	-177.8	-177.9	-178.4	179.3	0	0	111.7	Y110 T111 S112	E108-Y110 VanDerWaalsContact C-N 3.29Å; E108-Y110 PolarHBondContact O-N 2.86Å; E108-T111 PolarHBondContact O-N 3.06Å; E108-T111 PolarHBondContact O-OG1 3.01Å; E108-S112 WeakPolarHBondContact O-CB 3.43Å; E108-S112 PolarHBondContact O-N 3.37Å; E108-S112 PolarHBondContact O-OG 3.28Å
109	E	86.6	Confident	75.3	Confident	25 Å²	25	41.5 Å²	41.5	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-35.8	177.9	-56	85.4	175.5	0	0	112.7	S71 H74 R75 A78 P107 S112 T113	S71-E109 WeakPolarHBondContact CA-OE1 3.29Å; S71-E109 VanDerWaalsContact CB-OE1 3.29Å; S71-E109 WeakPolarHBondContact CB-OE1 3.26Å; S71-E109 PolarHBondContact OG-OE1 2.96Å; H74-E109 HydrophobicContact CB-CB 3.93Å; H74-E109 HydrophobicContact CB-CG 4.09Å; H74-E109 IonicContact ND1-OE2 3.09Å; R75-E109 HydrophobicContact CB-CB 4.2Å; R75-E109 HydrophobicContact CB-CG 4.17Å; A78-E109 WeakPolarHBondContact CB-O 3.29Å; P107-E109 VanDerWaalsContact CB-OE2 3.23Å; P107-E109 WeakPolarHBondContact CB-OE2 3.49Å; P107-E109 PolarHBondContact O-N 2.86Å; E109-S112 PolarHBondContact O-OG 3.45Å; E109-T113 WeakPolarHBondContact O-CB 3.46Å; E109-T113 PolarHBondContact O-N 2.83Å; E109-T113 PolarHBondContact O-OG1 3.42Å
110	Y	84.8	Confident	74.5	Confident	33 Å²	33	50 Å²	50	13%	0.129	25%	0.249	C	C	.	.	H	α-helix	trans	-72.3	-48.3	175	-82.1	-88.7	0	0	0	111.3	Y52 H74 S77 A78 L81 P107 E108 T113 L114	Y52-Y110 PolarHBondContact OH-OH 3.16Å; H74-Y110 HydrophobicContact CB-CD2 4.38Å; H74-Y110 HydrophobicContact CB-CE2 4.09Å; S77-Y110 WeakPolarHBondContact CB-OH 3.27Å; A78-Y110 HydrophobicContact CB-CD1 3.69Å; A78-Y110 HydrophobicContact CB-CD2 4.38Å; A78-Y110 HydrophobicContact CB-CE1 4.03Å; A78-Y110 HydrophobicContact CB-CG 3.89Å; L81-Y110 HydrophobicContact CD2-CD1 4.25Å; L81-Y110 HydrophobicContact CD2-CE1 4.13Å; P107-Y110 HydrophobicContact CB-CD2 4.19Å; P107-Y110 HydrophobicContact CG-CD2 4.06Å; P107-Y110 WeakPolarHBondContact O-CB 3.42Å; P107-Y110 PolarHBondContact O-N 3.34Å; E108-Y110 VanDerWaalsContact C-N 3.29Å; E108-Y110 PolarHBondContact O-N 2.86Å; Y110-T113 PolarHBondContact O-N 3.21Å; Y110-L114 HydrophobicContact CD1-CD1 4.5Å; Y110-L114 VanDerWaalsContact O-CB 3.32Å; Y110-L114 WeakPolarHBondContact O-CB 3.34Å; Y110-L114 VanDerWaalsContact O-CG 3.27Å; Y110-L114 WeakPolarHBondContact O-CG 3.27Å; Y110-L114 PolarHBondContact O-N 3.29Å
111	T	81.2	Confident	74	Confident	4 Å²	4	51 Å²	51	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-70.1	-44.1	-173.9	67.4	0	0	0	0	111.8	D103 L106 P107 E108 T113 L114 K115	D103-T111 WeakPolarHBondContact OD1-CB 3.21Å; D103-T111 PolarHBondContact OD1-OG1 2.79Å; L106-T111 HydrophobicContact CB-CG2 3.64Å; P107-T111 PolarHBondContact O-N 3.14Å; E108-T111 PolarHBondContact O-N 3.06Å; E108-T111 PolarHBondContact O-OG1 3.01Å; T111-T113 PolarHBondContact O-N 3.35Å; T111-L114 PolarHBondContact O-N 2.97Å; T111-K115 WeakPolarHBondContact O-CB 3.48Å; T111-K115 WeakPolarHBondContact O-CG 3.24Å; T111-K115 PolarHBondContact O-N 3.31Å
112	S	83.3	Confident	73.9	Confident	43 Å²	43	51.8 Å²	51.8	30%	0.301	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-41.4	174.8	60.9	0	0	0	0	112.9	E108 E109	E108-S112 WeakPolarHBondContact O-CB 3.43Å; E108-S112 PolarHBondContact O-N 3.37Å; E108-S112 PolarHBondContact O-OG 3.28Å; E109-S112 PolarHBondContact O-OG 3.45Å
113	T	88.1	Confident	74.6	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.08	28%	0.282	C	S	.	.	H	α-helix	trans	-71.8	-40.1	-179.4	-57.6	0	0	0	0	112.1	A78 E79 R82 E109 Y110 T111	A78-T113 HydrophobicContact CB-CG2 4.1Å; E79-T113 HydrophobicContact CG-CG2 3.96Å; R82-T113 HydrophobicContact CB-CG2 4.08Å; E109-T113 WeakPolarHBondContact O-CB 3.46Å; E109-T113 PolarHBondContact O-N 2.83Å; E109-T113 PolarHBondContact O-OG1 3.42Å; Y110-T113 PolarHBondContact O-N 3.21Å; T111-T113 PolarHBondContact O-N 3.35Å
114	L	86.8	Confident	75.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-81.8	-18.1	-178.5	-64.9	172.7	0	0	0	113.1	L81 R82 L99 Y110 T111 V116 L117	L81-L114 HydrophobicContact CD2-CD1 4.14Å; L81-L114 HydrophobicContact CG-CD2 4.38Å; R82-L114 HydrophobicContact CB-CD2 3.91Å; L99-L114 HydrophobicContact CB-CD1 3.6Å; L99-L114 HydrophobicContact CD1-CD1 4.08Å; L99-L114 HydrophobicContact CG-CD1 4.5Å; Y110-L114 HydrophobicContact CD1-CD1 4.5Å; Y110-L114 VanDerWaalsContact O-CB 3.32Å; Y110-L114 WeakPolarHBondContact O-CB 3.34Å; Y110-L114 VanDerWaalsContact O-CG 3.27Å; Y110-L114 WeakPolarHBondContact O-CG 3.27Å; Y110-L114 PolarHBondContact O-N 3.29Å; T111-L114 PolarHBondContact O-N 2.97Å; L114-V116 PolarHBondContact O-N 3.3Å; L114-V116 VanDerWaalsContact O-N 3.12Å; L114-L117 HydrophobicContact CB-CD1 4.36Å; L114-L117 HydrophobicContact CD2-CD1 3.7Å; L114-L117 VanDerWaalsContact O-CB 3.23Å; L114-L117 WeakPolarHBondContact O-CB 3.33Å; L114-L117 WeakPolarHBondContact O-CG 3.44Å; L114-L117 PolarHBondContact O-N 2.85Å
115	K	81.9	Confident	77.4	Confident	92 Å²	92	52.6 Å²	52.6	40%	0.4	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-53	-32.4	174.1	-93.4	169.2	179.6	170.2	0	113.2	D103 T111 L117 H118	D103-K115 WeakPolarHBondContact OD1-CE 3.49Å; D103-K115 IonicContact OD1-NZ 2.72Å; D103-K115 PolarHBondContact OD1-NZ 3Å; D103-K115 WeakPolarHBondContact OD2-CE 3.38Å; D103-K115 IonicContact OD2-NZ 2.6Å; D103-K115 PolarHBondContact OD2-NZ 3.49Å; T111-K115 WeakPolarHBondContact O-CB 3.48Å; T111-K115 WeakPolarHBondContact O-CG 3.24Å; T111-K115 PolarHBondContact O-N 3.31Å; K115-L117 PolarHBondContact O-N 3.03Å; K115-H118 WeakPolarHBondContact O-CB 3.29Å; K115-H118 PolarHBondContact O-CD2 3.4Å; K115-H118 PolarHBondContact O-N 3.01Å; K115-H118 VanDerWaalsContact O-N 3.07Å
116	V	81.7	Confident	79	Confident	67 Å²	67	52.9 Å²	52.9	41%	0.406	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-60.5	-25.2	177.2	-179.3	0	0	0	0	112.5	L114 H118 S119 R120	L114-V116 PolarHBondContact O-N 3.3Å; L114-V116 VanDerWaalsContact O-N 3.12Å; V116-H118 PolarHBondContact O-N 2.98Å; V116-S119 PolarHBondContact O-N 3.34Å; V116-S119 VanDerWaalsContact O-N 3.11Å; V116-S119 PolarHBondContact O-OG 3.24Å; V116-S119 VanDerWaalsContact O-OG 3.12Å; V116-R120 PolarHBondContact O-N 2.84Å
117	L	80.4	Confident	80	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-66.2	-16.1	177.4	-61.4	176.2	0	0	0	112.9	R82 C85 C86 I93 Q97 L114 K115	R82-L117 HydrophobicContact CG-CD2 4.17Å; R82-L117 HydrophobicContact CG-CG 4.46Å; C85-L117 HydrophobicContact CB-CD1 3.76Å; C85-L117 HydrophobicContact CB-CD2 4.22Å; C86-L117 VanDerWaalsContact SG-CD2 3.58Å; I93-L117 HydrophobicContact CG2-CB 4.33Å; Q97-L117 HydrophobicContact CG-CB 4.02Å; Q97-L117 PolarHBondContact NE2-O 3.25Å; L114-L117 HydrophobicContact CB-CD1 4.36Å; L114-L117 HydrophobicContact CD2-CD1 3.7Å; L114-L117 VanDerWaalsContact O-CB 3.23Å; L114-L117 WeakPolarHBondContact O-CB 3.33Å; L114-L117 WeakPolarHBondContact O-CG 3.44Å; L114-L117 PolarHBondContact O-N 2.85Å; K115-L117 PolarHBondContact O-N 3.03Å
118	H	72	Confident	80.7	Confident	54 Å²	54	58.6 Å²	58.6	25%	0.25	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-78.2	-22	174	-70.1	-82.7	0	0	0	113.4	Q97 K115 V116 H309	Q97-H118 WeakPolarHBondContact CA-NE2 3.21Å; Q97-H118 VanDerWaalsContact CB-CE1 3.42Å; Q97-H118 WeakPolarHBondContact CB-CE1 3.47Å; Q97-H118 PolarHBondContact O-CE1 2.93Å; Q97-H118 PolarHBondContact O-NE2 3.46Å; K115-H118 WeakPolarHBondContact O-CB 3.29Å; K115-H118 PolarHBondContact O-CD2 3.4Å; K115-H118 PolarHBondContact O-N 3.01Å; K115-H118 VanDerWaalsContact O-N 3.07Å; V116-H118 PolarHBondContact O-N 2.98Å; H118-H309 AromaticContact CG-NE2 3.87Å; H118-H309 AromaticContact ND1-CD2 3.8Å; H118-H309 AromaticContact ND1-NE2 3.68Å
119	S	62.9	Low	81.4	Confident	92 Å²	92	51.8 Å²	51.8	64%	0.643	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-13.6	-172.9	61.2	0	0	0	0	115	V116	V116-S119 PolarHBondContact O-N 3.34Å; V116-S119 VanDerWaalsContact O-N 3.11Å; V116-S119 PolarHBondContact O-OG 3.24Å; V116-S119 VanDerWaalsContact O-OG 3.12Å
120	R	61.3	Low	81.8	Confident	200 Å²	200	53.5 Å²	53.5	76%	0.755	27%	0.273	S	S	*	.			trans	-130.2	72.1	-177	-66.2	-172.5	-179.1	-171.7	0.6	112.3	V116	V116-R120 PolarHBondContact O-N 2.84Å
121	A	65.8	Low	82.2	Confident	21 Å²	21	55.2 Å²	55.2	17%	0.174	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-80.1	137.9	170.7	0	0	0	0	0	110.9	A155 A156	A121-A155 HydrophobicContact CB-CB 4.27Å; A121-A156 WeakPolarHBondContact CB-O 3.3Å
122	P	67.5	Low	82.8	Confident	33 Å²	33	55 Å²	55	21%	0.214	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-64.5	141.7	172.9	27.4	-33.1	0	0	0	110.6	R89 I93 H178	R89-P122 HydrophobicContact CB-CG 4.15Å; R89-P122 HydrophobicContact CG-CG 3.94Å; I93-P122 HydrophobicContact CD1-CG 4.05Å; P122-H178 PolarHBondContact O-CE1 3.12Å; P122-H178 PolarHBondContact O-NE2 3.2Å
123	Q	82.8	Confident	83.4	Confident	123 Å²	123	53 Å²	53	58%	0.575	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-96.2	141.1	176.6	-67	178.9	-6.9	0	0	110.5	P152 A155	Q123-P152 HydrophobicContact CG-CG 4.28Å; Q123-A155 HydrophobicContact CG-CB 3.78Å
124	S	85.8	Confident	83.8	Confident	14 Å²	14	57.4 Å²	57.4	10%	0.098	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-79.9	149.5	166.2	-87.3	0	0	0	0	110.1	E128 Q160 H178	S124-E128 VanDerWaalsContact CA-OE2 3.29Å; S124-E128 WeakPolarHBondContact CA-OE2 3.11Å; S124-E128 WeakPolarHBondContact CB-OE2 3.49Å; S124-E128 PolarHBondContact OG-OE2 3.22Å; S124-Q160 VanDerWaalsContact CB-OE1 3.24Å; S124-Q160 PolarHBondContact O-NE2 2.6Å; S124-Q160 PolarHBondContact O-OE1 3.03Å; S124-H178 WeakPolarHBondContact CB-ND1 3.45Å; S124-H178 PolarHBondContact OG-ND1 3.14Å
125	T	90	Very high	84.2	Confident	73 Å²	73	61.4 Å²	61.4	45%	0.448	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-70.3	159.3	177.3	79.8	0	0	0	0	110.4	E127 E128 I129	T125-E127 WeakPolarHBondContact CB-OE2 3.3Å; T125-E127 PolarHBondContact O-N 3.34Å; T125-E127 PolarHBondContact OG1-OE2 3.26Å; T125-E128 PolarHBondContact N-OE2 3.49Å; T125-E128 WeakPolarHBondContact O-CB 3.49Å; T125-E128 PolarHBondContact O-N 3.34Å; T125-E128 VanDerWaalsContact O-N 3.13Å; T125-E128 PolarHBondContact OG1-N 2.92Å; T125-I129 WeakPolarHBondContact O-CG1 3.49Å; T125-I129 PolarHBondContact O-N 2.85Å; T125-I129 VanDerWaalsContact O-N 3.12Å
126	M	91.7	Very high	84.8	Confident	27 Å²	27	59.4 Å²	59.4	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-33.7	-179	-173.1	55.8	-175.5	0	0	111.8	I129 Q130 L141 F148 E150	M126-I129 PolarHBondContact O-N 2.95Å; M126-Q130 HydrophobicContact CE-CG 4Å; M126-Q130 WeakPolarHBondContact O-CB 3.36Å; M126-Q130 WeakPolarHBondContact O-CG 3.36Å; M126-Q130 PolarHBondContact O-N 2.88Å; M126-L141 HydrophobicContact CE-CD1 3.27Å; M126-F148 HydrophobicContact CE-CD1 3.45Å; M126-F148 VanDerWaalsContact CE-CD1 3.45Å; M126-F148 HydrophobicContact CE-CE1 3.57Å; M126-F148 HydrophobicContact CE-CG 4.49Å; M126-F148 HydrophobicContact SD-CD1 4.41Å; M126-F148 HydrophobicContact SD-CE1 4.07Å; M126-E150 HydrophobicContact CE-CG 4.38Å; M126-E150 HydrophobicContact CG-CG 4.32Å; M126-E150 HydrophobicContact SD-CB 4.49Å; M126-E150 HydrophobicContact SD-CG 4.5Å
127	E	91.8	Very high	85.5	Confident	126 Å²	126	57.9 Å²	57.9	59%	0.589	28%	0.283	S	S	*	.	H	α-helix	trans	-64.5	-41.5	176	-56.7	73.7	-159.6	0	0	111.4	T125 I129 Q130 Q131	T125-E127 WeakPolarHBondContact CB-OE2 3.3Å; T125-E127 PolarHBondContact O-N 3.34Å; T125-E127 PolarHBondContact OG1-OE2 3.26Å; E127-I129 VanDerWaalsContact C-N 3.32Å; E127-I129 PolarHBondContact O-N 3.38Å; E127-Q130 PolarHBondContact O-N 2.72Å; E127-Q131 WeakPolarHBondContact O-CB 3.23Å; E127-Q131 PolarHBondContact O-N 2.73Å
128	E	90.4	Very high	86.2	Confident	43 Å²	43	60.8 Å²	60.8	20%	0.201	31%	0.314	C	S	.	.	H	α-helix	trans	-62.3	-40.5	174.7	-72.6	-175.2	147.8	0	0	111.1	S124 T125 Q131 V132 P179 K180	S124-E128 VanDerWaalsContact CA-OE2 3.29Å; S124-E128 WeakPolarHBondContact CA-OE2 3.11Å; S124-E128 WeakPolarHBondContact CB-OE2 3.49Å; S124-E128 PolarHBondContact OG-OE2 3.22Å; T125-E128 PolarHBondContact N-OE2 3.49Å; T125-E128 WeakPolarHBondContact O-CB 3.49Å; T125-E128 PolarHBondContact O-N 3.34Å; T125-E128 VanDerWaalsContact O-N 3.13Å; T125-E128 PolarHBondContact OG1-N 2.92Å; E128-Q131 WeakPolarHBondContact O-CB 3.41Å; E128-Q131 PolarHBondContact O-N 3.5Å; E128-V132 VanDerWaalsContact O-CG2 3.25Å; E128-V132 WeakPolarHBondContact O-CG2 3.15Å; E128-V132 PolarHBondContact O-N 3.06Å; E128-P179 HydrophobicContact CB-CG 3.84Å; E128-P179 HydrophobicContact CG-CG 4.35Å; E128-K180 VanDerWaalsContact OE1-CE 3.29Å; E128-K180 WeakPolarHBondContact OE1-CE 3.48Å; E128-K180 IonicContact OE1-NZ 3.5Å
129	I	93.2	Very high	87.3	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-67.7	-47.2	178.1	-64	-50.2	0	0	0	111.8	T125 M126 E127 Q131 V132 I133 F148 Q160 V176	T125-I129 WeakPolarHBondContact O-CG1 3.49Å; T125-I129 PolarHBondContact O-N 2.85Å; T125-I129 VanDerWaalsContact O-N 3.12Å; M126-I129 PolarHBondContact O-N 2.95Å; E127-I129 VanDerWaalsContact C-N 3.32Å; E127-I129 PolarHBondContact O-N 3.38Å; I129-Q131 PolarHBondContact O-N 2.81Å; I129-V132 PolarHBondContact O-N 3Å; I129-V132 VanDerWaalsContact O-N 3.13Å; I129-I133 HydrophobicContact CG2-CD1 3.98Å; I129-I133 WeakPolarHBondContact O-CG1 3.38Å; I129-I133 PolarHBondContact O-N 2.73Å; I129-F148 HydrophobicContact CG2-CE1 4.48Å; I129-F148 HydrophobicContact CG2-CZ 4.22Å; I129-Q160 VanDerWaalsContact CD1-CD 3.45Å; I129-Q160 HydrophobicContact CD1-CG 3.67Å; I129-Q160 HydrophobicContact CG1-CG 4.2Å; I129-Q160 VanDerWaalsContact CG1-NE2 3.27Å; I129-V176 HydrophobicContact CD1-CB 4.11Å; I129-V176 HydrophobicContact CD1-CG1 3.9Å; I129-V176 HydrophobicContact CG2-CB 4.24Å; I129-V176 HydrophobicContact CG2-CG1 4.18Å; I129-V176 HydrophobicContact CG2-CG2 4.08Å
130	Q	94.3	Very high	88.8	Confident	62 Å²	62	62.1 Å²	62.1	29%	0.29	31%	0.309	S	S	.	.	H	α-helix	trans	-57.9	-40.4	174.1	-76.6	177	-9.4	0	0	111.5	M126 E127 I133 R134 L141	M126-Q130 HydrophobicContact CE-CG 4Å; M126-Q130 WeakPolarHBondContact O-CB 3.36Å; M126-Q130 WeakPolarHBondContact O-CG 3.36Å; M126-Q130 PolarHBondContact O-N 2.88Å; E127-Q130 PolarHBondContact O-N 2.72Å; Q130-I133 PolarHBondContact O-N 3.03Å; Q130-R134 WeakPolarHBondContact O-CB 3.48Å; Q130-R134 PolarHBondContact O-N 3.43Å; Q130-L141 HydrophobicContact CG-CD1 3.48Å; Q130-L141 VanDerWaalsContact CG-CD1 3.48Å; Q130-L141 HydrophobicContact CG-CG 4.14Å
131	Q	93.4	Very high	90.3	Very high	68 Å²	68	53.6 Å²	53.6	32%	0.318	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-47.3	174.9	177	177.3	3.1	0	0	111.5	E127 E128 I129 I133 R134 E135	E127-Q131 WeakPolarHBondContact O-CB 3.23Å; E127-Q131 PolarHBondContact O-N 2.73Å; E128-Q131 WeakPolarHBondContact O-CB 3.41Å; E128-Q131 PolarHBondContact O-N 3.5Å; I129-Q131 PolarHBondContact O-N 2.81Å; Q131-I133 VanDerWaalsContact C-N 3.32Å; Q131-I133 PolarHBondContact O-N 3.3Å; Q131-R134 PolarHBondContact O-N 2.8Å; Q131-E135 HydrophobicContact CG-CG 4.23Å; Q131-E135 WeakPolarHBondContact CG-OE1 3.44Å; Q131-E135 PolarHBondContact NE2-OE1 2.86Å; Q131-E135 WeakPolarHBondContact O-CB 3.29Å; Q131-E135 VanDerWaalsContact O-CG 3.25Å; Q131-E135 WeakPolarHBondContact O-CG 3.41Å; Q131-E135 PolarHBondContact O-N 2.89Å
132	V	94.3	Very high	91.7	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-46.4	176.8	178.6	0	0	0	0	110.9	E128 I129 R134 E135 D136 V176 P179 R258 I259	E128-V132 VanDerWaalsContact O-CG2 3.25Å; E128-V132 WeakPolarHBondContact O-CG2 3.15Å; E128-V132 PolarHBondContact O-N 3.06Å; I129-V132 PolarHBondContact O-N 3Å; I129-V132 VanDerWaalsContact O-N 3.13Å; V132-R134 PolarHBondContact O-N 2.9Å; V132-E135 PolarHBondContact O-N 3.1Å; V132-D136 WeakPolarHBondContact O-CB 3.27Å; V132-D136 PolarHBondContact O-N 3.23Å; V132-V176 HydrophobicContact CB-CG1 3.73Å; V132-V176 HydrophobicContact CG1-CG1 3.59Å; V132-V176 HydrophobicContact CG2-CG1 4.24Å; V132-P179 HydrophobicContact CG2-CB 3.82Å; V132-P179 HydrophobicContact CG2-CG 3.73Å; V132-R258 HydrophobicContact CG1-CB 4.18Å; V132-I259 HydrophobicContact CG1-CD1 4.29Å; V132-I259 HydrophobicContact CG1-CG1 4.13Å
133	I	95.7	Very high	93	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-45.8	-179.8	-69.9	172.3	0	0	0	111.5	I129 Q130 Q131 D136 L137 L141 L144 F148 V176 I259	I129-I133 HydrophobicContact CG2-CD1 3.98Å; I129-I133 WeakPolarHBondContact O-CG1 3.38Å; I129-I133 PolarHBondContact O-N 2.73Å; Q130-I133 PolarHBondContact O-N 3.03Å; Q131-I133 VanDerWaalsContact C-N 3.32Å; Q131-I133 PolarHBondContact O-N 3.3Å; I133-D136 PolarHBondContact O-N 3.21Å; I133-L137 HydrophobicContact CG2-CD1 4.32Å; I133-L137 WeakPolarHBondContact O-CB 3.43Å; I133-L137 PolarHBondContact O-N 2.85Å; I133-L141 HydrophobicContact CD1-CD2 3.47Å; I133-L141 VanDerWaalsContact CD1-CD2 3.47Å; I133-L141 HydrophobicContact CD1-CG 4.44Å; I133-L141 HydrophobicContact CG2-CD2 4.18Å; I133-L144 HydrophobicContact CG2-CD1 3.64Å; I133-F148 HydrophobicContact CD1-CE2 4.02Å; I133-F148 HydrophobicContact CD1-CZ 4.04Å; I133-V176 HydrophobicContact CD1-CG2 4.17Å; I133-V176 HydrophobicContact CG1-CG2 4.26Å; I133-I259 HydrophobicContact CB-CD1 4.42Å; I133-I259 HydrophobicContact CG1-CD1 4.01Å
134	R	95.8	Very high	93.6	Very high	105 Å²	105	55.4 Å²	55.4	40%	0.396	29%	0.291	S	S	.	.	H	α-helix	trans	-64.5	-43.9	177.4	-171.9	-169.9	-61.8	115	7.3	112.3	Q130 Q131 V132 G138 E140	Q130-R134 WeakPolarHBondContact O-CB 3.48Å; Q130-R134 PolarHBondContact O-N 3.43Å; Q131-R134 PolarHBondContact O-N 2.8Å; V132-R134 PolarHBondContact O-N 2.9Å; R134-G138 WeakPolarHBondContact O-CA 3.47Å; R134-G138 PolarHBondContact O-N 2.78Å; R134-E140 IonicContact CZ-OE1 3.36Å; R134-E140 IonicContact CZ-OE2 3.51Å; R134-E140 IonicContact NE-OE1 2.67Å; R134-E140 PolarHBondContact NE-OE1 3.5Å; R134-E140 IonicContact NE-OE2 3.41Å; R134-E140 PolarHBondContact NE-OE2 3.47Å; R134-E140 IonicContact NH2-OE1 3.23Å; R134-E140 PolarHBondContact NH2-OE1 3.28Å; R134-E140 IonicContact NH2-OE2 2.77Å; R134-E140 PolarHBondContact NH2-OE2 3.01Å
135	E	94.7	Very high	94.1	Very high	85 Å²	85	55 Å²	55	40%	0.397	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-41.1	179.3	-76.4	175.6	176.2	0	0	112.1	Q131 V132 R258	Q131-E135 HydrophobicContact CG-CG 4.23Å; Q131-E135 WeakPolarHBondContact CG-OE1 3.44Å; Q131-E135 PolarHBondContact NE2-OE1 2.86Å; Q131-E135 WeakPolarHBondContact O-CB 3.29Å; Q131-E135 VanDerWaalsContact O-CG 3.25Å; Q131-E135 WeakPolarHBondContact O-CG 3.41Å; Q131-E135 PolarHBondContact O-N 2.89Å; V132-E135 PolarHBondContact O-N 3.1Å; E135-R258 IonicContact OE2-CZ 3.11Å; E135-R258 IonicContact OE2-NH1 2.89Å; E135-R258 PolarHBondContact OE2-NH1 3.07Å; E135-R258 IonicContact OE2-NH2 2.89Å
136	D	95.8	Very high	94.5	Very high	49 Å²	49	56.1 Å²	56.1	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-95	-35	-170.4	-86.2	-119.7	0	0	0	113.7	V132 I133 T256 R258 I259	V132-D136 WeakPolarHBondContact O-CB 3.27Å; V132-D136 PolarHBondContact O-N 3.23Å; I133-D136 PolarHBondContact O-N 3.21Å; D136-T256 HydrophobicContact CB-CG2 3.99Å; D136-T256 PolarHBondContact OD1-OG1 2.8Å; D136-R258 WeakPolarHBondContact OD1-CB 3.26Å; D136-R258 WeakPolarHBondContact OD1-CD 3.37Å; D136-R258 WeakPolarHBondContact OD2-CD 3.47Å; D136-R258 IonicContact OD2-CZ 3.09Å; D136-R258 IonicContact OD2-NE 3.59Å; D136-R258 IonicContact OD2-NH1 3.16Å; D136-R258 PolarHBondContact OD2-NH1 3.21Å; D136-I259 HydrophobicContact CB-CD1 3.67Å; D136-I259 HydrophobicContact CB-CG1 4.45Å
137	L	96.2	Very high	94.8	Very high	35 Å²	35	57.6 Å²	57.6	18%	0.183	31%	0.307	C	S	.	.	H	α-helix	trans	-103	-9.5	-179.9	-61.8	178.6	0	0	0	113.3	I133 K139 L144 T256 I259	I133-L137 HydrophobicContact CG2-CD1 4.32Å; I133-L137 WeakPolarHBondContact O-CB 3.43Å; I133-L137 PolarHBondContact O-N 2.85Å; L137-K139 PolarHBondContact O-N 2.8Å; L137-L144 HydrophobicContact CB-CD1 4.27Å; L137-L144 HydrophobicContact CD1-CD1 3.76Å; L137-T256 HydrophobicContact CD2-CG2 3.59Å; L137-T256 HydrophobicContact CG-CG2 4.43Å; L137-I259 HydrophobicContact CD1-CD1 4.06Å; L137-I259 HydrophobicContact CG-CD1 3.9Å
138	G	95.5	Very high	95	Very high	65 Å²	65	53 Å²	53	67%	0.67	29%	0.285	S	S	*	.	S	Bend	trans	68.2	15.6	176.9	0	0	0	0	0	114.9	R134	R134-G138 WeakPolarHBondContact O-CA 3.47Å; R134-G138 PolarHBondContact O-N 2.78Å
139	K	94.4	Very high	95.3	Very high	102 Å²	102	54.3 Å²	54.3	44%	0.443	29%	0.291	S	S	.	.	S	Bend	trans	-137.2	154	-174.8	-69.4	-179.9	176	-177.2	0	111.2	L137 E143 L144	L137-K139 PolarHBondContact O-N 2.8Å; K139-E143 HydrophobicContact CB-CB 4.33Å; K139-L144 HydrophobicContact CB-CD1 4.16Å; K139-L144 HydrophobicContact CB-CD2 3.93Å; K139-L144 HydrophobicContact CB-CG 3.88Å; K139-L144 HydrophobicContact CD-CD2 3.55Å; K139-L144 HydrophobicContact CD-CG 4.33Å; K139-L144 HydrophobicContact CG-CD2 4.36Å
140	E	94.1	Very high	95.2	Very high	72 Å²	72	61 Å²	61	34%	0.336	32%	0.322	S	S	.	.			trans	-76.1	159.3	170.2	-62.7	-62.1	159.9	0	0	111.7	R134 S142 E143 L144	R134-E140 IonicContact CZ-OE1 3.36Å; R134-E140 IonicContact CZ-OE2 3.51Å; R134-E140 IonicContact NE-OE1 2.67Å; R134-E140 PolarHBondContact NE-OE1 3.5Å; R134-E140 IonicContact NE-OE2 3.41Å; R134-E140 PolarHBondContact NE-OE2 3.47Å; R134-E140 IonicContact NH2-OE1 3.23Å; R134-E140 PolarHBondContact NH2-OE1 3.28Å; R134-E140 IonicContact NH2-OE2 2.77Å; R134-E140 PolarHBondContact NH2-OE2 3.01Å; E140-S142 VanDerWaalsContact C-N 3.26Å; E140-S142 PolarHBondContact O-N 2.91Å; E140-E143 HydrophobicContact CB-CG 4.4Å; E140-E143 PolarHBondContact N-OE2 3.44Å; E140-E143 PolarHBondContact O-N 2.83Å; E140-E143 VanDerWaalsContact O-N 3.1Å; E140-L144 PolarHBondContact O-N 3.46Å
141	L	94.1	Very high	95.1	Very high	21 Å²	21	64.4 Å²	64.4	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-55.1	-41.2	177.4	-79.3	179.4	0	0	0	113	M126 Q130 I133 E143 L144 F145 F148	M126-L141 HydrophobicContact CE-CD1 3.27Å; Q130-L141 HydrophobicContact CG-CD1 3.48Å; Q130-L141 VanDerWaalsContact CG-CD1 3.48Å; Q130-L141 HydrophobicContact CG-CG 4.14Å; I133-L141 HydrophobicContact CD1-CD2 3.47Å; I133-L141 VanDerWaalsContact CD1-CD2 3.47Å; I133-L141 HydrophobicContact CD1-CG 4.44Å; I133-L141 HydrophobicContact CG2-CD2 4.18Å; L141-E143 PolarHBondContact O-N 3.27Å; L141-L144 PolarHBondContact O-N 3.34Å; L141-L144 VanDerWaalsContact O-N 3.13Å; L141-F145 HydrophobicContact CD2-CD2 3.74Å; L141-F145 HydrophobicContact CD2-CE2 3.84Å; L141-F145 PolarHBondContact O-N 3.4Å; L141-F148 HydrophobicContact CD1-CB 4.4Å; L141-F148 HydrophobicContact CD1-CD1 4.09Å; L141-F148 HydrophobicContact CD1-CE1 4.48Å; L141-F148 HydrophobicContact CD1-CG 4.13Å; L141-F148 HydrophobicContact CD2-CB 4.4Å; L141-F148 HydrophobicContact CD2-CD1 4.4Å; L141-F148 HydrophobicContact CD2-CD2 3.54Å; L141-F148 HydrophobicContact CD2-CE2 3.78Å; L141-F148 HydrophobicContact CD2-CG 3.87Å; L141-F148 HydrophobicContact CD2-CZ 4.28Å
142	S	94	Very high	95	Very high	94 Å²	94	62.3 Å²	62.3	66%	0.657	34%	0.335	S	S	*	.	H	α-helix	trans	-67.4	-19.2	-178.4	50.7	0	0	0	0	113.9	E140	E140-S142 VanDerWaalsContact C-N 3.26Å; E140-S142 PolarHBondContact O-N 2.91Å
143	E	95.3	Very high	94.5	Very high	108 Å²	108	67.3 Å²	67.3	51%	0.505	36%	0.358	S	S	.	.	H	α-helix	trans	-88.1	-19.1	175.3	-60.9	177.7	81.5	0	0	112.7	K139 E140 L141 H167	K139-E143 HydrophobicContact CB-CB 4.33Å; E140-E143 HydrophobicContact CB-CG 4.4Å; E140-E143 PolarHBondContact N-OE2 3.44Å; E140-E143 PolarHBondContact O-N 2.83Å; E140-E143 VanDerWaalsContact O-N 3.1Å; L141-E143 PolarHBondContact O-N 3.27Å; E143-H167 PolarHBondContact O-NE2 2.86Å
144	L	95.3	Very high	93.8	Very high	13 Å²	13	68.8 Å²	68.8	7%	0.068	37%	0.374	C	S	.	.	H	α-helix	trans	-99.7	-35.8	-176.8	-65.7	174.3	0	0	0	111.8	I133 L137 K139 E140 L141 L254	I133-L144 HydrophobicContact CG2-CD1 3.64Å; L137-L144 HydrophobicContact CB-CD1 4.27Å; L137-L144 HydrophobicContact CD1-CD1 3.76Å; K139-L144 HydrophobicContact CB-CD1 4.16Å; K139-L144 HydrophobicContact CB-CD2 3.93Å; K139-L144 HydrophobicContact CB-CG 3.88Å; K139-L144 HydrophobicContact CD-CD2 3.55Å; K139-L144 HydrophobicContact CD-CG 4.33Å; K139-L144 HydrophobicContact CG-CD2 4.36Å; E140-L144 PolarHBondContact O-N 3.46Å; L141-L144 PolarHBondContact O-N 3.34Å; L141-L144 VanDerWaalsContact O-N 3.13Å; L144-L254 HydrophobicContact CD2-CD2 3.79Å
145	F	97.2	Very high	92.7	Very high	7 Å²	7	65.5 Å²	65.5	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.3	-168.3	-51.4	-75.2	0	0	0	111.6	L141 S147 F148 A164 V165 L166 V172 V174 L254	L141-F145 HydrophobicContact CD2-CD2 3.74Å; L141-F145 HydrophobicContact CD2-CE2 3.84Å; L141-F145 PolarHBondContact O-N 3.4Å; F145-S147 VanDerWaalsContact C-N 3.35Å; F145-F148 AromaticContact CD2-CD2 3.83Å; F145-F148 HydrophobicContact CD2-CD2 3.83Å; F145-F148 HydrophobicContact CE2-CD2 4Å; F145-F148 HydrophobicContact CE2-CE2 4.27Å; F145-F148 HydrophobicContact CG-CD2 4.3Å; F145-A164 HydrophobicContact CB-CB 4.4Å; F145-A164 HydrophobicContact CD1-CB 3.52Å; F145-A164 HydrophobicContact CE1-CB 3.9Å; F145-A164 HydrophobicContact CG-CB 3.93Å; F145-V165 CarbonylContact C-O 3.53Å; F145-V165 VanDerWaalsContact CA-O 3.29Å; F145-V165 WeakPolarHBondContact CA-O 3.42Å; F145-V165 WeakPolarHBondContact CB-O 3.3Å; F145-L166 HydrophobicContact CD1-CD2 3.7Å; F145-L166 HydrophobicContact CE1-CD2 3.63Å; F145-V172 HydrophobicContact CD1-CG2 4.44Å; F145-V172 HydrophobicContact CE1-CG2 4.01Å; F145-V174 HydrophobicContact CE1-CG2 3.87Å; F145-V174 HydrophobicContact CZ-CG2 3.77Å; F145-L254 HydrophobicContact CE1-CD1 4.46Å
146	V	97.5	Very high	91.8	Very high	95 Å²	95	63.8 Å²	63.8	58%	0.576	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	-40.2	167.7	174.5	0	0	0	0	110.4	V165 H167	V146-V165 HydrophobicContact CB-CB 4.48Å; V146-V165 HydrophobicContact CB-CG1 4.41Å; V146-V165 PolarHBondContact N-O 3.02Å; V146-H167 HydrophobicContact CG2-CB 4.44Å
147	S	97.3	Very high	90.7	Very high	58 Å²	58	61.8 Å²	61.8	41%	0.406	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.5	174.7	64.2	0	0	0	0	110.3	F145 A164 V165	F145-S147 VanDerWaalsContact C-N 3.35Å; S147-A164 CarbonylContact O-C 3.48Å; S147-A164 WeakPolarHBondContact O-CA 3.33Å; S147-A164 WeakPolarHBondContact O-CB 3.49Å; S147-V165 PolarHBondContact O-N 2.75Å; S147-V165 WeakPolarHBondContact OG-CB 3.42Å; S147-V165 WeakPolarHBondContact OG-CG2 3.37Å
148	F	97.2	Very high	90.1	Very high	30 Å²	30	60.6 Å²	60.6	13%	0.132	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	119.5	176.6	-170.9	-80.1	0	0	0	107.5	M126 I129 I133 L141 F145 E150 H162 A164 V174	M126-F148 HydrophobicContact CE-CD1 3.45Å; M126-F148 VanDerWaalsContact CE-CD1 3.45Å; M126-F148 HydrophobicContact CE-CE1 3.57Å; M126-F148 HydrophobicContact CE-CG 4.49Å; M126-F148 HydrophobicContact SD-CD1 4.41Å; M126-F148 HydrophobicContact SD-CE1 4.07Å; I129-F148 HydrophobicContact CG2-CE1 4.48Å; I129-F148 HydrophobicContact CG2-CZ 4.22Å; I133-F148 HydrophobicContact CD1-CE2 4.02Å; I133-F148 HydrophobicContact CD1-CZ 4.04Å; L141-F148 HydrophobicContact CD1-CB 4.4Å; L141-F148 HydrophobicContact CD1-CD1 4.09Å; L141-F148 HydrophobicContact CD1-CE1 4.48Å; L141-F148 HydrophobicContact CD1-CG 4.13Å; L141-F148 HydrophobicContact CD2-CB 4.4Å; L141-F148 HydrophobicContact CD2-CD1 4.4Å; L141-F148 HydrophobicContact CD2-CD2 3.54Å; L141-F148 HydrophobicContact CD2-CE2 3.78Å; L141-F148 HydrophobicContact CD2-CG 3.87Å; L141-F148 HydrophobicContact CD2-CZ 4.28Å; F145-F148 AromaticContact CD2-CD2 3.83Å; F145-F148 HydrophobicContact CD2-CD2 3.83Å; F145-F148 HydrophobicContact CE2-CD2 4Å; F145-F148 HydrophobicContact CE2-CE2 4.27Å; F145-F148 HydrophobicContact CG-CD2 4.3Å; F148-E150 PolarHBondContact O-N 3.36Å; F148-H162 HydrophobicContact CD1-CB 4.32Å; F148-H162 HydrophobicContact CE1-CB 3.51Å; F148-H162 AromaticContact CE1-CG 3.39Å; F148-H162 AromaticContact CE1-ND1 3.43Å; F148-H162 WeakPolarHBondContact CE1-ND1 3.47Å; F148-H162 HydrophobicContact CE2-CB 3.94Å; F148-H162 HydrophobicContact CZ-CB 3.29Å; F148-H162 AromaticContact CZ-CD2 3.91Å; F148-H162 AromaticContact CZ-CG 3.45Å; F148-H162 VanDerWaalsContact CZ-CG 3.45Å; F148-A164 HydrophobicContact CB-CB 4.42Å; F148-A164 HydrophobicContact CD2-CB 3.65Å; F148-A164 HydrophobicContact CE2-CB 4.34Å; F148-A164 HydrophobicContact CG-CB 4.32Å; F148-V174 HydrophobicContact CE2-CB 4.06Å; F148-V174 HydrophobicContact CE2-CG1 4.25Å; F148-V174 HydrophobicContact CE2-CG2 4.15Å
149	E	95.7	Very high	89.7	Confident	71 Å²	71	57.6 Å²	57.6	33%	0.332	32%	0.322	S	S	.	.			trans	-72.8	118.5	-179.3	-69	-178.2	-169.6	0	0	109.9	N151 Q153 H162 K163	E149-N151 VanDerWaalsContact C-N 3.32Å; E149-N151 PolarHBondContact O-N 2.9Å; E149-Q153 PolarHBondContact OE2-NE2 3.5Å; E149-H162 PolarHBondContact O-ND1 2.79Å; E149-K163 HydrophobicContact CB-CB 4.49Å; E149-K163 WeakPolarHBondContact CB-O 3.42Å; E149-K163 HydrophobicContact CG-CB 4.27Å; E149-K163 PolarHBondContact N-O 3.44Å; E149-K163 VanDerWaalsContact OE1-CD 3.23Å; E149-K163 WeakPolarHBondContact OE1-CD 3.47Å; E149-K163 WeakPolarHBondContact OE1-CE 3.37Å; E149-K163 IonicContact OE1-NZ 3.82Å; E149-K163 PolarHBondContact OE1-NZ 3.02Å
150	E	91.8	Very high	89.6	Confident	139 Å²	139	52.8 Å²	52.8	65%	0.65	30%	0.301	S	S	*	.	S	Bend	trans	-63.7	-38.4	-179.8	-65.1	-177	176.5	0	0	112.1	M126 F148 H162	M126-E150 HydrophobicContact CE-CG 4.38Å; M126-E150 HydrophobicContact CG-CG 4.32Å; M126-E150 HydrophobicContact SD-CB 4.49Å; M126-E150 HydrophobicContact SD-CG 4.5Å; F148-E150 PolarHBondContact O-N 3.36Å; E150-H162 PolarHBondContact O-CE1 3.47Å
151	N	91.1	Very high	89.5	Confident	134 Å²	134	51 Å²	51	72%	0.717	30%	0.295	S	S	*	.	S	Bend	trans	-76	124	174.9	-69	-47.3	0	0	0	109.4	E149	E149-N151 VanDerWaalsContact C-N 3.32Å; E149-N151 PolarHBondContact O-N 2.9Å
152	P	91.1	Very high	89.6	Confident	24 Å²	24	50.1 Å²	50.1	16%	0.156	29%	0.29	C	S	.	.			trans	-67.4	140.4	177.7	28.4	-34	0	0	0	110.4	Q123 G154 Q160 V161	Q123-P152 HydrophobicContact CG-CG 4.28Å; P152-G154 PolarHBondContact O-N 2.95Å; P152-Q160 HydrophobicContact CB-CB 4.12Å; P152-V161 CarbonylContact C-O 3.56Å; P152-V161 WeakPolarHBondContact CA-O 3.23Å
153	Q	85.4	Confident	89.8	Confident	105 Å²	105	47.8 Å²	47.8	49%	0.491	27%	0.269	S	S	.	.	S	Bend	trans	-67.4	-29.3	171.7	-70.8	-67.6	-11.8	0	0	111.6	E149 V161 K163 F264	E149-Q153 PolarHBondContact OE2-NE2 3.5Å; Q153-V161 PolarHBondContact N-O 3.37Å; Q153-K163 HydrophobicContact CG-CB 3.84Å; Q153-F264 HydrophobicContact CG-CE2 4.38Å
154	G	80.3	Confident	89.9	Confident	33 Å²	33	42.7 Å²	42.7	34%	0.34	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	148.4	174.1	0	0	0	0	0	111.3	P152 Q160 V161	P152-G154 PolarHBondContact O-N 2.95Å; G154-Q160 WeakPolarHBondContact O-CA 3.49Å; G154-V161 PolarHBondContact O-N 2.87Å
155	A	73	Confident	90	Very high	35 Å²	35	43.6 Å²	43.6	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130	171.8	0	0	0	0	0	109	A121 Q123 Q160	A121-A155 HydrophobicContact CB-CB 4.27Å; Q123-A155 HydrophobicContact CG-CB 3.78Å; A155-Q160 HydrophobicContact CB-CB 4.44Å
156	A	75.1	Confident	90	Very high	50 Å²	50	43.8 Å²	43.8	41%	0.413	25%	0.252	S	S	.	.			trans	-114.6	176.1	175.2	0	0	0	0	0	109.6	A121 L158 A159 H178	A121-A156 WeakPolarHBondContact CB-O 3.3Å; A156-L158 PolarHBondContact O-N 2.92Å; A156-A159 CarbonylContact C-O 3.45Å; A156-A159 WeakPolarHBondContact CA-O 3.39Å; A156-A159 PolarHBondContact N-O 3.1Å; A156-H178 PolarHBondContact O-NE2 3.48Å
157	S	72.7	Confident	89.9	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.042	25%	0.251	C	S	.	.	S	Bend	trans	-64.4	-24.8	-174.8	44.7	0	0	0	0	114.8	K94 Q97	K94-S157 WeakPolarHBondContact CD-OG 3.24Å; Q97-S157 PolarHBondContact OE1-OG 3.2Å
158	L	83.2	Confident	89.9	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.052	25%	0.254	C	S	.	.	S	Bend	trans	-113	-17.2	-176.7	-52.6	179.1	0	0	0	113.4	K94 A156 Q177 H178 V181 M219 E222 L223	K94-L158 HydrophobicContact CB-CD2 4.38Å; A156-L158 PolarHBondContact O-N 2.92Å; L158-Q177 WeakPolarHBondContact O-CA 3.43Å; L158-Q177 WeakPolarHBondContact O-CG 3.38Å; L158-H178 PolarHBondContact O-CD2 3.47Å; L158-H178 PolarHBondContact O-N 3.31Å; L158-V181 HydrophobicContact CD2-CG1 3.69Å; L158-M219 HydrophobicContact CD1-CE 4.49Å; L158-M219 HydrophobicContact CD2-CE 3.86Å; L158-E222 HydrophobicContact CD1-CB 3.83Å; L158-L223 HydrophobicContact CB-CD2 4.47Å; L158-L223 HydrophobicContact CD1-CD2 4.12Å; L158-L223 HydrophobicContact CD2-CD2 4.17Å; L158-L223 HydrophobicContact CG-CD2 4.48Å
159	A	88.9	Confident	89.8	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.017	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	162.6	-166.2	0	0	0	0	0	112.1	A156 K175 V176 H178 F225	A156-A159 CarbonylContact C-O 3.45Å; A156-A159 WeakPolarHBondContact CA-O 3.39Å; A156-A159 PolarHBondContact N-O 3.1Å; A159-K175 HydrophobicContact CB-CG 3.87Å; A159-V176 CarbonylContact C-O 3.47Å; A159-V176 VanDerWaalsContact CA-O 3.25Å; A159-V176 WeakPolarHBondContact CA-O 3.45Å; A159-V176 WeakPolarHBondContact CB-O 3.43Å; A159-H178 PolarHBondContact N-CD2 3.15Å; A159-H178 VanDerWaalsContact N-CD2 3.29Å; A159-F225 HydrophobicContact CB-CE2 4.22Å; A159-F225 HydrophobicContact CB-CZ 3.67Å
160	Q	90.9	Very high	89.8	Confident	2 Å²	2	50 Å²	50	1%	0.009	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151	166.3	61.7	-165.7	66.1	0	0	111.1	S124 I129 P152 G154 A155 H162 K175 V176 H178	S124-Q160 VanDerWaalsContact CB-OE1 3.24Å; S124-Q160 PolarHBondContact O-NE2 2.6Å; S124-Q160 PolarHBondContact O-OE1 3.03Å; I129-Q160 VanDerWaalsContact CD1-CD 3.45Å; I129-Q160 HydrophobicContact CD1-CG 3.67Å; I129-Q160 HydrophobicContact CG1-CG 4.2Å; I129-Q160 VanDerWaalsContact CG1-NE2 3.27Å; P152-Q160 HydrophobicContact CB-CB 4.12Å; G154-Q160 WeakPolarHBondContact O-CA 3.49Å; A155-Q160 HydrophobicContact CB-CB 4.44Å; Q160-H162 WeakPolarHBondContact CG-NE2 3.34Å; Q160-H162 PolarHBondContact NE2-CE1 3.36Å; Q160-H162 PolarHBondContact NE2-NE2 3.46Å; Q160-K175 CarbonylContact O-C 3.6Å; Q160-K175 WeakPolarHBondContact O-CA 3.43Å; Q160-V176 PolarHBondContact N-O 2.74Å; Q160-V176 PolarHBondContact O-N 2.86Å; Q160-H178 PolarHBondContact OE1-CE1 2.97Å
161	V	93.4	Very high	90.1	Very high	35 Å²	35	45.9 Å²	45.9	21%	0.212	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	-177.4	-176.5	0	0	0	0	108.7	P152 Q153 G154 A173 V174 K175	P152-V161 CarbonylContact C-O 3.56Å; P152-V161 WeakPolarHBondContact CA-O 3.23Å; Q153-V161 PolarHBondContact N-O 3.37Å; G154-V161 PolarHBondContact O-N 2.87Å; V161-A173 HydrophobicContact CG1-CB 3.89Å; V161-V174 WeakPolarHBondContact CA-O 3.47Å; V161-K175 HydrophobicContact CG2-CB 4.02Å; V161-K175 HydrophobicContact CG2-CG 3.95Å
162	H	95.8	Very high	90.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	148.7	174.3	-67.7	-97.8	0	0	0	110.3	F148 E149 E150 Q160 A173 V174	F148-H162 HydrophobicContact CD1-CB 4.32Å; F148-H162 HydrophobicContact CE1-CB 3.51Å; F148-H162 AromaticContact CE1-CG 3.39Å; F148-H162 AromaticContact CE1-ND1 3.43Å; F148-H162 WeakPolarHBondContact CE1-ND1 3.47Å; F148-H162 HydrophobicContact CE2-CB 3.94Å; F148-H162 HydrophobicContact CZ-CB 3.29Å; F148-H162 AromaticContact CZ-CD2 3.91Å; F148-H162 AromaticContact CZ-CG 3.45Å; F148-H162 VanDerWaalsContact CZ-CG 3.45Å; E149-H162 PolarHBondContact O-ND1 2.79Å; E150-H162 PolarHBondContact O-CE1 3.47Å; Q160-H162 WeakPolarHBondContact CG-NE2 3.34Å; Q160-H162 PolarHBondContact NE2-CE1 3.36Å; Q160-H162 PolarHBondContact NE2-NE2 3.46Å; H162-A173 CarbonylContact O-C 3.29Å; H162-A173 WeakPolarHBondContact O-CA 3.39Å; H162-V174 PolarHBondContact N-O 3.38Å; H162-V174 PolarHBondContact O-N 2.87Å
163	K	97.3	Very high	90.7	Very high	46 Å²	46	38.6 Å²	38.6	20%	0.2	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.6	168.8	174.8	173.6	164	-160.7	0	108.8	E149 Q153 T171 F264	E149-K163 HydrophobicContact CB-CB 4.49Å; E149-K163 WeakPolarHBondContact CB-O 3.42Å; E149-K163 HydrophobicContact CG-CB 4.27Å; E149-K163 PolarHBondContact N-O 3.44Å; E149-K163 VanDerWaalsContact OE1-CD 3.23Å; E149-K163 WeakPolarHBondContact OE1-CD 3.47Å; E149-K163 WeakPolarHBondContact OE1-CE 3.37Å; E149-K163 IonicContact OE1-NZ 3.82Å; E149-K163 PolarHBondContact OE1-NZ 3.02Å; Q153-K163 HydrophobicContact CG-CB 3.84Å; K163-T171 HydrophobicContact CD-CG2 4.23Å; K163-T171 HydrophobicContact CG-CG2 3.91Å; K163-F264 HydrophobicContact CB-CD2 4.36Å; K163-F264 HydrophobicContact CB-CE2 4.15Å; K163-F264 HydrophobicContact CD-CD1 4.27Å; K163-F264 HydrophobicContact CD-CD2 4.33Å; K163-F264 HydrophobicContact CD-CE1 3.83Å; K163-F264 HydrophobicContact CD-CE2 3.94Å; K163-F264 HydrophobicContact CD-CZ 3.68Å; K163-F264 HydrophobicContact CG-CD2 4.2Å; K163-F264 HydrophobicContact CG-CE2 4.18Å; K163-F264 HydrophobicContact CG-CG 4.48Å; K163-F264 HydrophobicContact CG-CZ 4.41Å
164	A	97.6	Very high	91.3	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	163.6	177.9	0	0	0	0	0	111	F145 S147 F148 T171 V172 V174	F145-A164 HydrophobicContact CB-CB 4.4Å; F145-A164 HydrophobicContact CD1-CB 3.52Å; F145-A164 HydrophobicContact CE1-CB 3.9Å; F145-A164 HydrophobicContact CG-CB 3.93Å; S147-A164 CarbonylContact O-C 3.48Å; S147-A164 WeakPolarHBondContact O-CA 3.33Å; S147-A164 WeakPolarHBondContact O-CB 3.49Å; F148-A164 HydrophobicContact CB-CB 4.42Å; F148-A164 HydrophobicContact CD2-CB 3.65Å; F148-A164 HydrophobicContact CE2-CB 4.34Å; F148-A164 HydrophobicContact CG-CB 4.32Å; A164-T171 CarbonylContact O-C 3.55Å; A164-T171 WeakPolarHBondContact O-CA 3.48Å; A164-V172 HydrophobicContact CB-CG2 4.03Å; A164-V172 PolarHBondContact N-O 3.48Å; A164-V172 PolarHBondContact O-N 3.11Å; A164-V174 HydrophobicContact CB-CG2 3.91Å
165	V	98.2	Very high	92.1	Very high	32 Å²	32	33.1 Å²	33.1	19%	0.194	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.1	176.2	-178.4	0	0	0	0	108.7	F145 V146 S147	F145-V165 CarbonylContact C-O 3.53Å; F145-V165 VanDerWaalsContact CA-O 3.29Å; F145-V165 WeakPolarHBondContact CA-O 3.42Å; F145-V165 WeakPolarHBondContact CB-O 3.3Å; V146-V165 HydrophobicContact CB-CB 4.48Å; V146-V165 HydrophobicContact CB-CG1 4.41Å; V146-V165 PolarHBondContact N-O 3.02Å; S147-V165 PolarHBondContact O-N 2.75Å; S147-V165 WeakPolarHBondContact OG-CB 3.42Å; S147-V165 WeakPolarHBondContact OG-CG2 3.37Å
166	L	97.3	Very high	93.1	Very high	10 Å²	10	31.5 Å²	31.5	5%	0.052	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	162.2	176.5	-61.2	-179	0	0	0	111.5	F145 D168 G169 R170 V172 Y251 L254	F145-L166 HydrophobicContact CD1-CD2 3.7Å; F145-L166 HydrophobicContact CE1-CD2 3.63Å; L166-D168 WeakPolarHBondContact CB-OD1 3.46Å; L166-D168 PolarHBondContact O-N 2.7Å; L166-D168 VanDerWaalsContact O-N 3.15Å; L166-G169 PolarHBondContact O-N 3.38Å; L166-R170 HydrophobicContact CD1-CB 4.29Å; L166-R170 PolarHBondContact N-O 3.08Å; L166-V172 HydrophobicContact CD1-CG1 3.76Å; L166-V172 HydrophobicContact CD2-CG1 4.49Å; L166-V172 HydrophobicContact CD2-CG2 4.1Å; L166-V172 HydrophobicContact CG-CG1 3.9Å; L166-V172 HydrophobicContact CG-CG2 4.15Å; L166-Y251 HydrophobicContact CD1-CD1 4.24Å; L166-Y251 HydrophobicContact CD1-CE1 4.14Å; L166-L254 HydrophobicContact CD1-CD1 4.32Å; L166-L254 HydrophobicContact CD2-CD1 3.36Å
167	H	95.5	Very high	93.9	Very high	119 Å²	119	29.1 Å²	29.1	55%	0.551	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.7	176.9	-70	-69	0	0	0	115	E143 V146 G169	E143-H167 PolarHBondContact O-NE2 2.86Å; V146-H167 HydrophobicContact CG2-CB 4.44Å; H167-G169 VanDerWaalsContact C-N 3.31Å
168	D	95.6	Very high	94.6	Very high	89 Å²	89	29.3 Å²	29.3	48%	0.476	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.4	172.5	59.7	32.8	0	0	0	114	L166 R170	L166-D168 WeakPolarHBondContact CB-OD1 3.46Å; L166-D168 PolarHBondContact O-N 2.7Å; L166-D168 VanDerWaalsContact O-N 3.15Å; D168-R170 VanDerWaalsContact OD1-CB 3.26Å; D168-R170 WeakPolarHBondContact OD1-CB 3.48Å; D168-R170 VanDerWaalsContact OD1-CG 3.27Å; D168-R170 WeakPolarHBondContact OD1-CG 3.38Å; D168-R170 PolarHBondContact OD1-N 2.95Å; D168-R170 IonicContact OD1-NE 3.85Å; D168-R170 PolarHBondContact OD1-NE 2.96Å; D168-R170 IonicContact OD2-CZ 2.96Å; D168-R170 IonicContact OD2-NE 2.79Å; D168-R170 PolarHBondContact OD2-NE 3.37Å; D168-R170 IonicContact OD2-NH2 3.64Å; D168-R170 PolarHBondContact OD2-NH2 3.42Å
169	G	95.7	Very high	94.6	Very high	53 Å²	53	29.4 Å²	29.4	55%	0.546	16%	0.159	S	C	.	.	S	Bend	trans	86.3	-2.3	177.7	0	0	0	0	0	115.1	L166 H167	L166-G169 PolarHBondContact O-N 3.38Å; H167-G169 VanDerWaalsContact C-N 3.31Å
170	R	96.5	Very high	94	Very high	123 Å²	123	32 Å²	32	46%	0.464	17%	0.169	S	C	.	.			trans	-72.6	133	176.8	-66.9	179.1	-71.7	-178	1.2	111.3	L166 D168	L166-R170 HydrophobicContact CD1-CB 4.29Å; L166-R170 PolarHBondContact N-O 3.08Å; D168-R170 VanDerWaalsContact OD1-CB 3.26Å; D168-R170 WeakPolarHBondContact OD1-CB 3.48Å; D168-R170 VanDerWaalsContact OD1-CG 3.27Å; D168-R170 WeakPolarHBondContact OD1-CG 3.38Å; D168-R170 PolarHBondContact OD1-N 2.95Å; D168-R170 IonicContact OD1-NE 3.85Å; D168-R170 PolarHBondContact OD1-NE 2.96Å; D168-R170 IonicContact OD2-CZ 2.96Å; D168-R170 IonicContact OD2-NE 2.79Å; D168-R170 PolarHBondContact OD2-NE 3.37Å; D168-R170 IonicContact OD2-NH2 3.64Å; D168-R170 PolarHBondContact OD2-NH2 3.42Å
171	T	97.8	Very high	93.3	Very high	54 Å²	54	32.2 Å²	32.2	33%	0.331	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.8	172.8	-47.9	0	0	0	0	110.7	K163 A164 F264	K163-T171 HydrophobicContact CD-CG2 4.23Å; K163-T171 HydrophobicContact CG-CG2 3.91Å; A164-T171 CarbonylContact O-C 3.55Å; A164-T171 WeakPolarHBondContact O-CA 3.48Å; T171-F264 HydrophobicContact CG2-CB 3.7Å; T171-F264 HydrophobicContact CG2-CD1 3.81Å; T171-F264 HydrophobicContact CG2-CG 3.86Å; T171-F264 WeakPolarHBondContact O-CB 3.25Å; T171-F264 PolarHBondContact O-N 3.37Å
172	V	98	Very high	92.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.7	-177.3	-62.1	0	0	0	0	112.1	F145 A164 L166 V174 Y251 T261 M262	F145-V172 HydrophobicContact CD1-CG2 4.44Å; F145-V172 HydrophobicContact CE1-CG2 4.01Å; A164-V172 HydrophobicContact CB-CG2 4.03Å; A164-V172 PolarHBondContact N-O 3.48Å; A164-V172 PolarHBondContact O-N 3.11Å; L166-V172 HydrophobicContact CD1-CG1 3.76Å; L166-V172 HydrophobicContact CD2-CG1 4.49Å; L166-V172 HydrophobicContact CD2-CG2 4.1Å; L166-V172 HydrophobicContact CG-CG1 3.9Å; L166-V172 HydrophobicContact CG-CG2 4.15Å; V172-V174 HydrophobicContact CG2-CG2 3.92Å; V172-Y251 HydrophobicContact CG1-CD2 3.83Å; V172-Y251 HydrophobicContact CG1-CE2 3.48Å; V172-Y251 VanDerWaalsContact CG1-CE2 3.48Å; V172-Y251 HydrophobicContact CG1-CG 4.49Å; V172-T261 HydrophobicContact CB-CG2 3.82Å; V172-T261 HydrophobicContact CG1-CG2 4.17Å; V172-T261 HydrophobicContact CG2-CG2 3.88Å; V172-M262 CarbonylContact C-O 3.51Å; V172-M262 VanDerWaalsContact CA-O 3.29Å; V172-M262 WeakPolarHBondContact CA-O 3.48Å; V172-M262 WeakPolarHBondContact CB-O 3.45Å
173	A	97.6	Very high	91.1	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	121.1	165.1	0	0	0	0	0	108.2	V161 H162 T261 M262 F264	V161-A173 HydrophobicContact CG1-CB 3.89Å; H162-A173 CarbonylContact O-C 3.29Å; H162-A173 WeakPolarHBondContact O-CA 3.39Å; A173-T261 WeakPolarHBondContact O-CA 3.42Å; A173-M262 HydrophobicContact CB-CE 4.02Å; A173-M262 HydrophobicContact CB-CG 3.91Å; A173-M262 PolarHBondContact N-O 3.5Å; A173-M262 PolarHBondContact O-N 2.91Å; A173-F264 HydrophobicContact CB-CD2 4.09Å
174	V	97.5	Very high	90.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	101.4	178.4	-170	0	0	0	0	108.1	F145 F148 V161 H162 A164 V172 V176 I259 T261	F145-V174 HydrophobicContact CE1-CG2 3.87Å; F145-V174 HydrophobicContact CZ-CG2 3.77Å; F148-V174 HydrophobicContact CE2-CB 4.06Å; F148-V174 HydrophobicContact CE2-CG1 4.25Å; F148-V174 HydrophobicContact CE2-CG2 4.15Å; V161-V174 WeakPolarHBondContact CA-O 3.47Å; H162-V174 PolarHBondContact N-O 3.38Å; H162-V174 PolarHBondContact O-N 2.87Å; A164-V174 HydrophobicContact CB-CG2 3.91Å; V172-V174 HydrophobicContact CG2-CG2 3.92Å; V174-V176 HydrophobicContact CG1-CG2 3.83Å; V174-I259 HydrophobicContact CG1-CG2 3.99Å; V174-T261 HydrophobicContact CG2-CG2 4.3Å
175	K	95.8	Very high	89.5	Confident	22 Å²	22	38.6 Å²	38.6	10%	0.096	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	115.8	175.2	-174.9	-177.3	-169.7	-176.3	0	108.5	A159 Q160 V161 F225 E228 I259 L260	A159-K175 HydrophobicContact CB-CG 3.87Å; Q160-K175 CarbonylContact O-C 3.6Å; Q160-K175 WeakPolarHBondContact O-CA 3.43Å; V161-K175 HydrophobicContact CG2-CB 4.02Å; V161-K175 HydrophobicContact CG2-CG 3.95Å; K175-F225 HydrophobicContact CD-CE1 4.38Å; K175-F225 HydrophobicContact CD-CE2 4.24Å; K175-F225 HydrophobicContact CD-CZ 4.13Å; K175-F225 HydrophobicContact CG-CE2 3.96Å; K175-F225 HydrophobicContact CG-CZ 4.14Å; K175-E228 IonicContact NZ-OE1 2.73Å; K175-E228 PolarHBondContact NZ-OE1 3.21Å; K175-E228 IonicContact NZ-OE2 3.02Å; K175-E228 PolarHBondContact NZ-OE2 3.15Å; K175-I259 CarbonylContact O-C 3.56Å; K175-I259 WeakPolarHBondContact O-CA 3.48Å; K175-L260 HydrophobicContact CB-CB 4.14Å; K175-L260 PolarHBondContact N-O 3.3Å; K175-L260 PolarHBondContact O-N 3.28Å
176	V	94.8	Very high	88.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.2	-177.6	-173.8	0	0	0	0	109.2	I129 V132 I133 A159 Q160 V174 I259	I129-V176 HydrophobicContact CD1-CB 4.11Å; I129-V176 HydrophobicContact CD1-CG1 3.9Å; I129-V176 HydrophobicContact CG2-CB 4.24Å; I129-V176 HydrophobicContact CG2-CG1 4.18Å; I129-V176 HydrophobicContact CG2-CG2 4.08Å; V132-V176 HydrophobicContact CB-CG1 3.73Å; V132-V176 HydrophobicContact CG1-CG1 3.59Å; V132-V176 HydrophobicContact CG2-CG1 4.24Å; I133-V176 HydrophobicContact CD1-CG2 4.17Å; I133-V176 HydrophobicContact CG1-CG2 4.26Å; A159-V176 CarbonylContact C-O 3.47Å; A159-V176 VanDerWaalsContact CA-O 3.25Å; A159-V176 WeakPolarHBondContact CA-O 3.45Å; A159-V176 WeakPolarHBondContact CB-O 3.43Å; Q160-V176 PolarHBondContact N-O 2.74Å; Q160-V176 PolarHBondContact O-N 2.86Å; V174-V176 HydrophobicContact CG1-CG2 3.83Å; V176-I259 HydrophobicContact CG1-CG1 4.46Å
177	Q	92.2	Very high	88.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	138.9	178.7	-171.6	177.9	65.9	0	0	110.8	L158 P179 L223 F225 R258	L158-Q177 WeakPolarHBondContact O-CA 3.43Å; L158-Q177 WeakPolarHBondContact O-CG 3.38Å; Q177-P179 WeakPolarHBondContact O-CD 3.4Å; Q177-L223 PolarHBondContact NE2-O 3.36Å; Q177-L223 VanDerWaalsContact NE2-O 3.13Å; Q177-F225 HydrophobicContact CB-CE2 3.85Å; Q177-F225 HydrophobicContact CB-CZ 4.02Å; Q177-F225 HydrophobicContact CG-CZ 4.48Å; Q177-R258 HydrophobicContact CB-CB 4.19Å; Q177-R258 WeakPolarHBondContact CB-O 3.4Å; Q177-R258 PolarHBondContact N-O 2.79Å
178	H	87.7	Confident	88.1	Confident	11 Å²	11	41 Å²	41	5%	0.051	21%	0.213	C	C	.	.			trans	-60.8	123.9	173.7	-67.2	-61.4	0	0	0	110.1	P122 S124 A156 L158 A159 Q160 K180 V181	P122-H178 PolarHBondContact O-CE1 3.12Å; P122-H178 PolarHBondContact O-NE2 3.2Å; S124-H178 WeakPolarHBondContact CB-ND1 3.45Å; S124-H178 PolarHBondContact OG-ND1 3.14Å; A156-H178 PolarHBondContact O-NE2 3.48Å; L158-H178 PolarHBondContact O-CD2 3.47Å; L158-H178 PolarHBondContact O-N 3.31Å; A159-H178 PolarHBondContact N-CD2 3.15Å; A159-H178 VanDerWaalsContact N-CD2 3.29Å; Q160-H178 PolarHBondContact OE1-CE1 2.97Å; H178-K180 PolarHBondContact O-N 3.37Å; H178-V181 HydrophobicContact CB-CB 4.38Å; H178-V181 HydrophobicContact CB-CG2 3.69Å; H178-V181 PolarHBondContact O-N 3.25Å
179	P	82.1	Confident	87.7	Confident	11 Å²	11	37.4 Å²	37.4	7%	0.071	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-27.1	-173	6.3	-16	0	0	0	114.3	E128 V132 Q177	E128-P179 HydrophobicContact CB-CG 3.84Å; E128-P179 HydrophobicContact CG-CG 4.35Å; V132-P179 HydrophobicContact CG2-CB 3.82Å; V132-P179 HydrophobicContact CG2-CG 3.73Å; Q177-P179 WeakPolarHBondContact O-CD 3.4Å
180	K	76	Confident	87.4	Confident	56 Å²	56	40.2 Å²	40.2	24%	0.243	19%	0.193	C	C	.	.	H	α-helix	trans	-76.4	-29	-179	-63	174.4	174.9	-163	0	113.2	D32 E128 H178 Q184	D32-K180 WeakPolarHBondContact OD2-CD 3.21Å; D32-K180 WeakPolarHBondContact OD2-CE 3.46Å; D32-K180 IonicContact OD2-NZ 3.69Å; D32-K180 PolarHBondContact OD2-NZ 3.09Å; E128-K180 VanDerWaalsContact OE1-CE 3.29Å; E128-K180 WeakPolarHBondContact OE1-CE 3.48Å; E128-K180 IonicContact OE1-NZ 3.5Å; H178-K180 PolarHBondContact O-N 3.37Å; K180-Q184 WeakPolarHBondContact O-CG 3.34Å; K180-Q184 PolarHBondContact O-N 3.02Å
181	V	76.3	Confident	87	Confident	8 Å²	8	35.2 Å²	35.2	5%	0.048	18%	0.177	C	C	.	.	H	α-helix	trans	-69.3	-47.6	-171.1	173.6	0	0	0	0	111.7	L158 H178 R183 Q184 S185 L223	L158-V181 HydrophobicContact CD2-CG1 3.69Å; H178-V181 HydrophobicContact CB-CB 4.38Å; H178-V181 HydrophobicContact CB-CG2 3.69Å; H178-V181 PolarHBondContact O-N 3.25Å; V181-R183 VanDerWaalsContact C-N 3.33Å; V181-R183 PolarHBondContact O-N 2.97Å; V181-Q184 PolarHBondContact O-N 3.39Å; V181-S185 VanDerWaalsContact O-CB 3.3Å; V181-S185 WeakPolarHBondContact O-CB 3.2Å; V181-S185 PolarHBondContact O-N 3.14Å; V181-L223 HydrophobicContact CG1-CD2 3.57Å
182	Q	70.9	Confident	86.6	Confident	75 Å²	75	33.7 Å²	33.7	35%	0.35	17%	0.166	S	C	.	.	H	α-helix	trans	-61.1	-41	-175.2	-160.7	-173.9	43	0	0	112.6	Q184	Q182-Q184 VanDerWaalsContact C-N 3.35Å; Q182-Q184 PolarHBondContact O-N 2.95Å
183	R	72.9	Confident	86.2	Confident	117 Å²	117	34.9 Å²	34.9	44%	0.442	17%	0.172	S	C	.	.	H	α-helix	trans	-71.7	-29.7	-177.9	-65.5	-176.9	-176.4	144	9.1	113.2	V181	V181-R183 VanDerWaalsContact C-N 3.33Å; V181-R183 PolarHBondContact O-N 2.97Å
184	Q	78.7	Confident	85.9	Confident	22 Å²	22	38.2 Å²	38.2	10%	0.103	19%	0.192	C	C	.	.	H	α-helix	trans	-96.5	-25	-174.3	-67.6	174.4	-2.2	0	0	112.4	D32 K180 V181 Q182 S186 K187 D188	D32-Q184 VanDerWaalsContact CB-NE2 3.34Å; D32-Q184 PolarHBondContact O-NE2 2.86Å; D32-Q184 VanDerWaalsContact O-NE2 3.15Å; D32-Q184 PolarHBondContact OD1-NE2 3.14Å; K180-Q184 WeakPolarHBondContact O-CG 3.34Å; K180-Q184 PolarHBondContact O-N 3.02Å; V181-Q184 PolarHBondContact O-N 3.39Å; Q182-Q184 VanDerWaalsContact C-N 3.35Å; Q182-Q184 PolarHBondContact O-N 2.95Å; Q184-S186 PolarHBondContact O-N 3.25Å; Q184-K187 WeakPolarHBondContact O-CA 3.37Å; Q184-K187 WeakPolarHBondContact O-CB 3.48Å; Q184-K187 PolarHBondContact O-N 2.96Å; Q184-D188 PolarHBondContact O-N 3.4Å
185	S	82.8	Confident	85.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-57.8	-47.9	-166.5	-172.8	0	0	0	0	114.4	T91 V181 K187 D188 I189 M219	T91-S185 VanDerWaalsContact OG1-CA 3.27Å; T91-S185 WeakPolarHBondContact OG1-CA 3.2Å; T91-S185 WeakPolarHBondContact OG1-CB 3.35Å; T91-S185 PolarHBondContact OG1-OG 3.18Å; T91-S185 VanDerWaalsContact OG1-OG 3.09Å; V181-S185 VanDerWaalsContact O-CB 3.3Å; V181-S185 WeakPolarHBondContact O-CB 3.2Å; V181-S185 PolarHBondContact O-N 3.14Å; S185-K187 VanDerWaalsContact C-N 3.26Å; S185-K187 PolarHBondContact O-N 3.39Å; S185-D188 PolarHBondContact O-N 2.76Å; S185-I189 VanDerWaalsContact O-CG1 3.3Å; S185-I189 WeakPolarHBondContact O-CG1 2.89Å; S185-I189 PolarHBondContact O-N 2.81Å; S185-M219 WeakPolarHBondContact OG-CE 3.47Å
186	S	84.3	Confident	85	Confident	95 Å²	95	39.4 Å²	39.4	66%	0.664	20%	0.2	S	C	*	.	H	α-helix	trans	-62	-34.8	178.1	-50.4	0	0	0	0	112.9	Q184 M190	Q184-S186 PolarHBondContact O-N 3.25Å; S186-M190 PolarHBondContact O-N 3.38Å
187	K	87.8	Confident	84.6	Confident	111 Å²	111	44.3 Å²	44.3	48%	0.483	22%	0.221	S	C	.	.	H	α-helix	trans	-72	-44.3	177	-63.3	176.9	-178.6	174.7	0	110.8	Q184 S185 I189 M190 V191	Q184-K187 WeakPolarHBondContact O-CA 3.37Å; Q184-K187 WeakPolarHBondContact O-CB 3.48Å; Q184-K187 PolarHBondContact O-N 2.96Å; S185-K187 VanDerWaalsContact C-N 3.26Å; S185-K187 PolarHBondContact O-N 3.39Å; K187-I189 VanDerWaalsContact C-N 3.34Å; K187-I189 PolarHBondContact O-N 2.93Å; K187-M190 WeakPolarHBondContact O-CB 3.29Å; K187-M190 PolarHBondContact O-N 3.09Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 3Å
188	D	88.7	Confident	84.4	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-42.8	177.8	-69.2	-21.4	0	0	0	111.4	R37 T91 F92 Q184 S185 M190 V191 I192	R37-D188 IonicContact CZ-OD1 3.06Å; R37-D188 IonicContact CZ-OD2 2.71Å; R37-D188 IonicContact NE-OD1 2.78Å; R37-D188 PolarHBondContact NE-OD1 2.91Å; R37-D188 IonicContact NE-OD2 3.61Å; R37-D188 VanDerWaalsContact NH2-CG 3.29Å; R37-D188 IonicContact NH2-OD1 3.87Å; R37-D188 PolarHBondContact NH2-OD1 2.81Å; R37-D188 IonicContact NH2-OD2 3.9Å; R37-D188 PolarHBondContact NH2-OD2 2.86Å; T91-D188 HydrophobicContact CG2-CB 3.98Å; T91-D188 PolarHBondContact OG1-OD2 3.09Å; F92-D188 HydrophobicContact CD2-CB 4.24Å; F92-D188 HydrophobicContact CE2-CB 3.8Å; Q184-D188 PolarHBondContact O-N 3.4Å; S185-D188 PolarHBondContact O-N 2.76Å; D188-M190 VanDerWaalsContact C-N 3.32Å; D188-M190 PolarHBondContact O-N 2.75Å; D188-V191 PolarHBondContact O-N 2.63Å; D188-I192 VanDerWaalsContact O-CG1 3.26Å; D188-I192 WeakPolarHBondContact O-CG1 3.45Å; D188-I192 PolarHBondContact O-N 3.02Å
189	I	87.9	Confident	84.4	Confident	13 Å²	13	47 Å²	47	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-43.1	175.6	-67.3	169.4	0	0	0	110.6	T91 S185 K187 I192 E193 K216 M219	T91-I189 HydrophobicContact CG2-CG1 3.77Å; S185-I189 VanDerWaalsContact O-CG1 3.3Å; S185-I189 WeakPolarHBondContact O-CG1 2.89Å; S185-I189 PolarHBondContact O-N 2.81Å; K187-I189 VanDerWaalsContact C-N 3.34Å; K187-I189 PolarHBondContact O-N 2.93Å; I189-I192 PolarHBondContact O-N 3.29Å; I189-E193 WeakPolarHBondContact O-CB 3.41Å; I189-E193 PolarHBondContact O-N 2.86Å; I189-K216 HydrophobicContact CG2-CB 3.92Å; I189-K216 HydrophobicContact CG2-CG 4.05Å; I189-M219 HydrophobicContact CD1-CB 3.58Å; I189-M219 HydrophobicContact CD1-CG 3.82Å
190	M	88.4	Confident	84.5	Confident	111 Å²	111	49 Å²	49	55%	0.547	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-41.3	176.7	-178.5	-108	-80.3	0	0	111.9	S186 K187 D188 E193 V194	S186-M190 PolarHBondContact O-N 3.38Å; K187-M190 WeakPolarHBondContact O-CB 3.29Å; K187-M190 PolarHBondContact O-N 3.09Å; D188-M190 VanDerWaalsContact C-N 3.32Å; D188-M190 PolarHBondContact O-N 2.75Å; M190-E193 PolarHBondContact O-N 3.34Å; M190-V194 WeakPolarHBondContact O-CG2 3.43Å; M190-V194 PolarHBondContact O-N 3.35Å
191	V	89.4	Confident	84.9	Confident	19 Å²	19	56 Å²	56	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-48	174.4	169	0	0	0	0	111	F38 A41 F92 K187 D188 E193 V194 L195	F38-V191 HydrophobicContact CB-CG2 4.43Å; F38-V191 HydrophobicContact CD2-CB 4.39Å; F38-V191 HydrophobicContact CD2-CG1 3.77Å; F38-V191 HydrophobicContact CD2-CG2 3.81Å; F38-V191 HydrophobicContact CE2-CG1 4.45Å; A41-V191 HydrophobicContact CB-CG1 4.02Å; F92-V191 HydrophobicContact CZ-CG1 4.47Å; K187-V191 WeakPolarHBondContact O-CG2 3.39Å; K187-V191 PolarHBondContact O-N 3Å; D188-V191 PolarHBondContact O-N 2.63Å; V191-E193 VanDerWaalsContact C-N 3.31Å; V191-E193 PolarHBondContact O-N 3.48Å; V191-V194 PolarHBondContact O-N 3.22Å; V191-L195 HydrophobicContact CG1-CD1 3.75Å; V191-L195 HydrophobicContact CG1-CG 4.35Å; V191-L195 WeakPolarHBondContact O-CB 3.42Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.2Å; V191-L195 PolarHBondContact O-N 2.77Å
192	I	88.8	Confident	85.3	Confident	21 Å²	21	59.3 Å²	59.3	11%	0.108	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-44.2	177.1	-67.8	165.8	0	0	0	110.1	T91 F92 V95 D188 I189 V194 L195 V196 V212	T91-I192 HydrophobicContact CG2-CD1 4.29Å; F92-I192 HydrophobicContact CD1-CD1 4.23Å; F92-I192 HydrophobicContact CD1-CG1 4.39Å; F92-I192 HydrophobicContact CE1-CD1 4.12Å; F92-I192 HydrophobicContact CE1-CG1 3.83Å; F92-I192 HydrophobicContact CE2-CD1 4.46Å; F92-I192 HydrophobicContact CG-CD1 4.44Å; F92-I192 HydrophobicContact CZ-CD1 4.24Å; F92-I192 HydrophobicContact CZ-CG1 3.93Å; V95-I192 HydrophobicContact CG2-CD1 4.14Å; D188-I192 VanDerWaalsContact O-CG1 3.26Å; D188-I192 WeakPolarHBondContact O-CG1 3.45Å; D188-I192 PolarHBondContact O-N 3.02Å; I189-I192 PolarHBondContact O-N 3.29Å; I192-V194 PolarHBondContact O-N 3Å; I192-L195 PolarHBondContact O-N 2.82Å; I192-V196 HydrophobicContact CG2-CG2 4.13Å; I192-V196 WeakPolarHBondContact O-CB 3.37Å; I192-V196 VanDerWaalsContact O-CG2 3.23Å; I192-V196 WeakPolarHBondContact O-CG2 3.43Å; I192-V196 PolarHBondContact O-N 3.35Å; I192-V212 HydrophobicContact CG2-CG2 4Å
193	E	89.8	Confident	85.8	Confident	26 Å²	26	58.1 Å²	58.1	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-59.1	-46.8	178	-172	-178	162.2	0	0	112.4	I189 M190 V191 K197 M209 V212 K216	I189-E193 WeakPolarHBondContact O-CB 3.41Å; I189-E193 PolarHBondContact O-N 2.86Å; M190-E193 PolarHBondContact O-N 3.34Å; V191-E193 VanDerWaalsContact C-N 3.31Å; V191-E193 PolarHBondContact O-N 3.48Å; E193-K197 HydrophobicContact CG-CD 4.42Å; E193-K197 WeakPolarHBondContact O-CB 3.14Å; E193-K197 VanDerWaalsContact O-CG 3.29Å; E193-K197 WeakPolarHBondContact O-CG 3.46Å; E193-K197 PolarHBondContact O-N 3.45Å; E193-K197 WeakPolarHBondContact OE1-CE 3.28Å; E193-K197 IonicContact OE1-NZ 2.78Å; E193-K197 PolarHBondContact OE1-NZ 3.45Å; E193-M209 HydrophobicContact CG-CE 4.33Å; E193-V212 HydrophobicContact CB-CG1 3.66Å; E193-V212 HydrophobicContact CG-CG1 3.98Å; E193-K216 IonicContact OE1-NZ 3.02Å; E193-K216 IonicContact OE2-NZ 3.51Å; E193-K216 PolarHBondContact OE2-NZ 2.94Å
194	V	90.3	Very high	86	Confident	75 Å²	75	57 Å²	57	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-45.3	178.2	170.9	0	0	0	0	111.2	M190 V191 I192 K197 A198	M190-V194 WeakPolarHBondContact O-CG2 3.43Å; M190-V194 PolarHBondContact O-N 3.35Å; V191-V194 PolarHBondContact O-N 3.22Å; I192-V194 PolarHBondContact O-N 3Å; V194-K197 PolarHBondContact O-N 3.45Å; V194-A198 PolarHBondContact O-N 3.29Å
195	L	89.2	Confident	85.5	Confident	21 Å²	21	63.3 Å²	63.3	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-42.1	-178.8	-68.2	174.1	0	0	0	111.9	A41 A42 T45 V191 I192 K197 A198 V199	A41-L195 HydrophobicContact CB-CD1 3.5Å; A41-L195 VanDerWaalsContact CB-CD1 3.5Å; A42-L195 HydrophobicContact CB-CD2 4.2Å; T45-L195 HydrophobicContact CG2-CB 4.43Å; T45-L195 HydrophobicContact CG2-CD2 4.4Å; V191-L195 HydrophobicContact CG1-CD1 3.75Å; V191-L195 HydrophobicContact CG1-CG 4.35Å; V191-L195 WeakPolarHBondContact O-CB 3.42Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.2Å; V191-L195 PolarHBondContact O-N 2.77Å; I192-L195 PolarHBondContact O-N 2.82Å; L195-K197 VanDerWaalsContact C-N 3.34Å; L195-K197 PolarHBondContact O-N 2.94Å; L195-A198 PolarHBondContact O-N 3.26Å; L195-V199 WeakPolarHBondContact O-CG2 3.36Å; L195-V199 PolarHBondContact O-N 3.12Å
196	V	86.2	Confident	84.9	Confident	27 Å²	27	66.7 Å²	66.7	16%	0.164	35%	0.346	C	S	.	.	H	α-helix	trans	-66.4	-37.2	176.9	176.8	0	0	0	0	110.9	I192 A198 V199 N200 F206 M209 V212	I192-V196 HydrophobicContact CG2-CG2 4.13Å; I192-V196 WeakPolarHBondContact O-CB 3.37Å; I192-V196 VanDerWaalsContact O-CG2 3.23Å; I192-V196 WeakPolarHBondContact O-CG2 3.43Å; I192-V196 PolarHBondContact O-N 3.35Å; V196-A198 PolarHBondContact O-N 3.46Å; V196-V199 PolarHBondContact O-N 3.19Å; V196-N200 WeakPolarHBondContact O-CB 3.38Å; V196-N200 PolarHBondContact O-N 3.21Å; V196-F206 HydrophobicContact CG1-CE1 4.26Å; V196-M209 HydrophobicContact CB-SD 4.08Å; V196-M209 HydrophobicContact CG1-CG 4.34Å; V196-M209 HydrophobicContact CG1-SD 3.52Å; V196-M209 VanDerWaalsContact CG1-SD 3.52Å; V196-V212 HydrophobicContact CB-CG2 3.9Å; V196-V212 HydrophobicContact CG1-CG2 3.98Å; V196-V212 HydrophobicContact CG2-CG2 3.76Å
197	K	87.1	Confident	84	Confident	103 Å²	103	64.5 Å²	64.5	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-41.5	171.8	-76.2	176.6	-174.2	170.9	0	112.3	E193 V194 L195 N200 W201 M209	E193-K197 HydrophobicContact CG-CD 4.42Å; E193-K197 WeakPolarHBondContact O-CB 3.14Å; E193-K197 VanDerWaalsContact O-CG 3.29Å; E193-K197 WeakPolarHBondContact O-CG 3.46Å; E193-K197 PolarHBondContact O-N 3.45Å; E193-K197 WeakPolarHBondContact OE1-CE 3.28Å; E193-K197 IonicContact OE1-NZ 2.78Å; E193-K197 PolarHBondContact OE1-NZ 3.45Å; V194-K197 PolarHBondContact O-N 3.45Å; L195-K197 VanDerWaalsContact C-N 3.34Å; L195-K197 PolarHBondContact O-N 2.94Å; K197-N200 PolarHBondContact O-N 3.11Å; K197-W201 PolarHBondContact O-N 3.12Å; K197-M209 HydrophobicContact CB-SD 4.48Å; K197-M209 HydrophobicContact CD-CE 4.41Å; K197-M209 HydrophobicContact CG-CE 3.77Å; K197-M209 HydrophobicContact CG-SD 3.62Å
198	A	88.3	Confident	83.2	Confident	45 Å²	45	60.9 Å²	60.9	37%	0.372	31%	0.312	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.3	0	0	0	0	0	111.9	V194 L195 V196 W201 L202	V194-A198 PolarHBondContact O-N 3.29Å; L195-A198 PolarHBondContact O-N 3.26Å; V196-A198 PolarHBondContact O-N 3.46Å; A198-W201 PolarHBondContact O-N 2.93Å; A198-L202 WeakPolarHBondContact O-CG 3.27Å; A198-L202 PolarHBondContact O-N 3.18Å
199	V	86.1	Confident	82.5	Confident	21 Å²	21	62.5 Å²	62.5	13%	0.127	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-44.5	174	173.7	0	0	0	0	110.9	T45 L195 V196 W201 L202 F203 F206	T45-V199 HydrophobicContact CG2-CG2 3.46Å; T45-V199 VanDerWaalsContact CG2-CG2 3.46Å; L195-V199 WeakPolarHBondContact O-CG2 3.36Å; L195-V199 PolarHBondContact O-N 3.12Å; V196-V199 PolarHBondContact O-N 3.19Å; V199-W201 PolarHBondContact O-N 3.07Å; V199-L202 PolarHBondContact O-N 2.82Å; V199-L202 VanDerWaalsContact O-N 3.14Å; V199-F203 HydrophobicContact CG1-CD2 3.89Å; V199-F203 WeakPolarHBondContact O-CD2 3.32Å; V199-F203 PolarHBondContact O-N 2.91Å; V199-F206 HydrophobicContact CB-CD1 4.36Å; V199-F206 HydrophobicContact CB-CE1 4.5Å; V199-F206 HydrophobicContact CG1-CB 4.44Å; V199-F206 HydrophobicContact CG1-CD1 3.52Å; V199-F206 HydrophobicContact CG1-CD2 4.48Å; V199-F206 HydrophobicContact CG1-CE1 3.79Å; V199-F206 HydrophobicContact CG1-CG 3.91Å; V199-F206 HydrophobicContact CG1-CZ 4.38Å
200	N	84.3	Confident	81.9	Confident	55 Å²	55	63.8 Å²	63.8	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-32.2	176.2	-177.8	94.9	0	0	0	112.2	V196 K197 F203 P204 F206	V196-N200 WeakPolarHBondContact O-CB 3.38Å; V196-N200 PolarHBondContact O-N 3.21Å; K197-N200 PolarHBondContact O-N 3.11Å; N200-F203 CarbonylContact O-C 3.53Å; N200-F203 VanDerWaalsContact O-C 3.29Å; N200-P204 WeakPolarHBondContact O-CA 3.23Å; N200-F206 PolarHBondContact OD1-O 3.16Å
201	W	85.8	Confident	81.2	Confident	203 Å²	203	59.7 Å²	59.7	77%	0.769	30%	0.304	S	S	*	.	H	α-helix	trans	-70.1	-39.1	173.4	179.9	77.9	0	0	0	112.4	K197 A198 V199	K197-W201 PolarHBondContact O-N 3.12Å; A198-W201 PolarHBondContact O-N 2.93Å; V199-W201 PolarHBondContact O-N 3.07Å
202	L	84.9	Confident	80.6	Confident	76 Å²	76	59.1 Å²	59.1	40%	0.398	30%	0.301	S	S	.	.	H	α-helix	trans	-74	-34.7	176.1	-71.5	172.2	0	0	0	113.3	A198 V199	A198-L202 WeakPolarHBondContact O-CG 3.27Å; A198-L202 PolarHBondContact O-N 3.18Å; V199-L202 PolarHBondContact O-N 2.82Å; V199-L202 VanDerWaalsContact O-N 3.14Å
203	F	81.4	Confident	80.2	Confident	50 Å²	50	60.9 Å²	60.9	22%	0.219	31%	0.309	C	S	.	.			trans	-127.9	85.2	-178.7	-55	-81.7	0	0	0	108.6	L53 V199 N200 D205 F206	L53-F203 HydrophobicContact CD1-CZ 4.46Å; L53-F203 HydrophobicContact CD2-CE1 3.79Å; L53-F203 HydrophobicContact CD2-CZ 4.05Å; L53-F203 HydrophobicContact CG-CE1 4Å; L53-F203 HydrophobicContact CG-CZ 3.78Å; V199-F203 HydrophobicContact CG1-CD2 3.89Å; V199-F203 WeakPolarHBondContact O-CD2 3.32Å; V199-F203 PolarHBondContact O-N 2.91Å; N200-F203 CarbonylContact O-C 3.53Å; N200-F203 VanDerWaalsContact O-C 3.29Å; F203-D205 PolarHBondContact O-N 3.47Å; F203-D205 VanDerWaalsContact O-N 3.09Å; F203-F206 HydrophobicContact CB-CB 3.88Å; F203-F206 WeakPolarHBondContact O-CB 3.4Å; F203-F206 PolarHBondContact O-N 3.22Å
204	P	75.3	Confident	79.6	Confident	94 Å²	94	60.5 Å²	60.5	61%	0.61	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26	-177.9	-28.1	36.7	0	0	0	114.5	N200 F206	N200-P204 WeakPolarHBondContact O-CA 3.23Å; P204-F206 PolarHBondContact O-N 3.34Å
205	D	69.4	Low	79.1	Confident	154 Å²	154	57.4 Å²	57.4	82%	0.824	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.7	175.7	-58.3	-38.5	0	0	0	113	F203 T207	F203-D205 PolarHBondContact O-N 3.47Å; F203-D205 VanDerWaalsContact O-N 3.09Å; D205-T207 PolarHBondContact O-N 3.29Å; D205-T207 VanDerWaalsContact O-N 3.11Å
206	F	69.8	Low	78.8	Confident	74 Å²	74	60.7 Å²	60.7	33%	0.325	30%	0.303	S	S	.	.			trans	-81.1	88.6	-179.8	-173.4	-96.6	0	0	0	111.6	V196 V199 N200 F203 P204 F208	V196-F206 HydrophobicContact CG1-CE1 4.26Å; V199-F206 HydrophobicContact CB-CD1 4.36Å; V199-F206 HydrophobicContact CB-CE1 4.5Å; V199-F206 HydrophobicContact CG1-CB 4.44Å; V199-F206 HydrophobicContact CG1-CD1 3.52Å; V199-F206 HydrophobicContact CG1-CD2 4.48Å; V199-F206 HydrophobicContact CG1-CE1 3.79Å; V199-F206 HydrophobicContact CG1-CG 3.91Å; V199-F206 HydrophobicContact CG1-CZ 4.38Å; N200-F206 PolarHBondContact OD1-O 3.16Å; F203-F206 HydrophobicContact CB-CB 3.88Å; F203-F206 WeakPolarHBondContact O-CB 3.4Å; F203-F206 PolarHBondContact O-N 3.22Å; P204-F206 PolarHBondContact O-N 3.34Å; F206-F208 HydrophobicContact CD1-CB 4.43Å; F206-F208 AromaticContact CD1-CD2 3.92Å; F206-F208 HydrophobicContact CD1-CD2 3.92Å; F206-F208 AromaticContact CD2-CD2 3.43Å; F206-F208 HydrophobicContact CD2-CD2 3.43Å; F206-F208 VanDerWaalsContact CD2-CD2 3.43Å; F206-F208 AromaticContact CD2-CE2 3.61Å; F206-F208 HydrophobicContact CD2-CE2 3.61Å; F206-F208 HydrophobicContact CE1-CB 3.81Å; F206-F208 AromaticContact CE1-CD2 3.64Å; F206-F208 HydrophobicContact CE1-CD2 3.64Å; F206-F208 HydrophobicContact CE1-CG 4.17Å; F206-F208 AromaticContact CE2-CD2 3.11Å; F206-F208 HydrophobicContact CE2-CD2 3.11Å; F206-F208 AromaticContact CE2-CE2 3.38Å; F206-F208 HydrophobicContact CE2-CE2 3.38Å; F206-F208 HydrophobicContact CE2-CG 4.16Å; F206-F208 AromaticContact CG-CD2 3.82Å; F206-F208 HydrophobicContact CG-CD2 3.82Å; F206-F208 HydrophobicContact CG-CE2 4.36Å; F206-F208 HydrophobicContact CZ-CB 3.94Å; F206-F208 AromaticContact CZ-CD2 3.23Å; F206-F208 HydrophobicContact CZ-CD2 3.23Å; F206-F208 AromaticContact CZ-CE2 3.97Å; F206-F208 HydrophobicContact CZ-CE2 3.97Å; F206-F208 AromaticContact CZ-CG 3.88Å; F206-F208 HydrophobicContact CZ-CG 3.88Å; F206-F208 PolarHBondContact O-N 2.67Å
207	T	65	Low	78.7	Confident	48 Å²	48	64.1 Å²	64.1	29%	0.294	32%	0.315	S	S	.	.			trans	-98.7	48.5	-169.5	44.4	0	0	0	0	113.9	D205 W210 N421	D205-T207 PolarHBondContact O-N 3.29Å; D205-T207 VanDerWaalsContact O-N 3.11Å; T207-W210 PolarHBondContact O-NE1 3.5Å; T207-N421 PolarHBondContact O-OD1 3.19Å; T207-N421 PolarHBondContact OG1-ND2 3.03Å
208	F	71.3	Confident	78.5	Confident	35 Å²	35	59.5 Å²	59.5	15%	0.154	30%	0.296	C	S	.	.			trans	-98.6	10.6	-178.2	-65.9	-82.5	0	0	0	115.4	L105 L106 F206 W210 L211	L105-F208 HydrophobicContact CD1-CE1 4.33Å; L105-F208 HydrophobicContact CG-CE1 4.47Å; L106-F208 HydrophobicContact CD2-CD1 4.33Å; L106-F208 HydrophobicContact CD2-CE1 3.38Å; L106-F208 HydrophobicContact CD2-CZ 3.52Å; F206-F208 HydrophobicContact CD1-CB 4.43Å; F206-F208 AromaticContact CD1-CD2 3.92Å; F206-F208 HydrophobicContact CD1-CD2 3.92Å; F206-F208 AromaticContact CD2-CD2 3.43Å; F206-F208 HydrophobicContact CD2-CD2 3.43Å; F206-F208 VanDerWaalsContact CD2-CD2 3.43Å; F206-F208 AromaticContact CD2-CE2 3.61Å; F206-F208 HydrophobicContact CD2-CE2 3.61Å; F206-F208 HydrophobicContact CE1-CB 3.81Å; F206-F208 AromaticContact CE1-CD2 3.64Å; F206-F208 HydrophobicContact CE1-CD2 3.64Å; F206-F208 HydrophobicContact CE1-CG 4.17Å; F206-F208 AromaticContact CE2-CD2 3.11Å; F206-F208 HydrophobicContact CE2-CD2 3.11Å; F206-F208 AromaticContact CE2-CE2 3.38Å; F206-F208 HydrophobicContact CE2-CE2 3.38Å; F206-F208 HydrophobicContact CE2-CG 4.16Å; F206-F208 AromaticContact CG-CD2 3.82Å; F206-F208 HydrophobicContact CG-CD2 3.82Å; F206-F208 HydrophobicContact CG-CE2 4.36Å; F206-F208 HydrophobicContact CZ-CB 3.94Å; F206-F208 AromaticContact CZ-CD2 3.23Å; F206-F208 HydrophobicContact CZ-CD2 3.23Å; F206-F208 AromaticContact CZ-CE2 3.97Å; F206-F208 HydrophobicContact CZ-CE2 3.97Å; F206-F208 AromaticContact CZ-CG 3.88Å; F206-F208 HydrophobicContact CZ-CG 3.88Å; F206-F208 PolarHBondContact O-N 2.67Å; F208-W210 HydrophobicContact CD1-CZ2 4.48Å; F208-W210 PolarHBondContact O-N 3.38Å; F208-W210 VanDerWaalsContact O-N 3.14Å; F208-L211 WeakPolarHBondContact O-CB 3.13Å; F208-L211 PolarHBondContact O-N 2.98Å
209	M	74.7	Confident	78.3	Confident	41 Å²	41	57.5 Å²	57.5	20%	0.202	28%	0.278	C	S	.	.	H	α-helix	trans	-55.3	-32.7	177.2	-80.2	-57.5	-50.8	0	0	113	E193 V196 K197 L211 V212 E213	E193-M209 HydrophobicContact CG-CE 4.33Å; V196-M209 HydrophobicContact CB-SD 4.08Å; V196-M209 HydrophobicContact CG1-CG 4.34Å; V196-M209 HydrophobicContact CG1-SD 3.52Å; V196-M209 VanDerWaalsContact CG1-SD 3.52Å; K197-M209 HydrophobicContact CB-SD 4.48Å; K197-M209 HydrophobicContact CD-CE 4.41Å; K197-M209 HydrophobicContact CG-CE 3.77Å; K197-M209 HydrophobicContact CG-SD 3.62Å; M209-L211 PolarHBondContact O-N 2.77Å; M209-V212 WeakPolarHBondContact O-CB 3.37Å; M209-V212 PolarHBondContact O-N 3.03Å; M209-E213 PolarHBondContact O-N 2.68Å; M209-E213 VanDerWaalsContact O-N 3.14Å
210	W	74.2	Confident	78.3	Confident	41 Å²	41	60 Å²	60	16%	0.155	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-29.9	177.7	66.2	-97.8	0	0	0	113	L102 L105 T207 F208 E213 E214 L428	L102-W210 HydrophobicContact CD1-CH2 4.27Å; L105-W210 HydrophobicContact CD2-CH2 3.71Å; L105-W210 HydrophobicContact CD2-CZ2 3.46Å; L105-W210 VanDerWaalsContact CD2-CZ2 3.46Å; T207-W210 PolarHBondContact O-NE1 3.5Å; F208-W210 HydrophobicContact CD1-CZ2 4.48Å; F208-W210 PolarHBondContact O-N 3.38Å; F208-W210 VanDerWaalsContact O-N 3.14Å; W210-E213 PolarHBondContact O-N 3.24Å; W210-E214 WeakPolarHBondContact O-CB 3.24Å; W210-E214 PolarHBondContact O-N 3.18Å; W210-L428 HydrophobicContact CD2-CD1 4.1Å; W210-L428 HydrophobicContact CE3-CD1 3.68Å; W210-L428 HydrophobicContact CH2-CD1 4.16Å; W210-L428 HydrophobicContact CZ3-CD1 3.73Å
211	L	73.1	Confident	78.5	Confident	24 Å²	24	60.8 Å²	60.8	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-38.3	178.8	-176.6	69.5	0	0	0	111	L99 L102 F208 M209 E214 A215	L99-L211 HydrophobicContact CD2-CD2 3.2Å; L99-L211 HydrophobicContact CG-CD2 3.85Å; L102-L211 HydrophobicContact CD1-CD1 4.35Å; F208-L211 WeakPolarHBondContact O-CB 3.13Å; F208-L211 PolarHBondContact O-N 2.98Å; M209-L211 PolarHBondContact O-N 2.77Å; L211-E214 PolarHBondContact O-N 3.44Å; L211-A215 WeakPolarHBondContact O-CB 3.39Å; L211-A215 PolarHBondContact O-N 3.2Å
212	V	78.3	Confident	78.5	Confident	8 Å²	8	51.6 Å²	51.6	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-45.2	174.4	-178.4	0	0	0	0	110.4	I192 E193 V196 M209 E214 A215 K216	I192-V212 HydrophobicContact CG2-CG2 4Å; E193-V212 HydrophobicContact CB-CG1 3.66Å; E193-V212 HydrophobicContact CG-CG1 3.98Å; V196-V212 HydrophobicContact CB-CG2 3.9Å; V196-V212 HydrophobicContact CG1-CG2 3.98Å; V196-V212 HydrophobicContact CG2-CG2 3.76Å; M209-V212 WeakPolarHBondContact O-CB 3.37Å; M209-V212 PolarHBondContact O-N 3.03Å; V212-E214 VanDerWaalsContact C-N 3.26Å; V212-E214 PolarHBondContact O-N 2.85Å; V212-A215 PolarHBondContact O-N 3.34Å; V212-K216 VanDerWaalsContact O-CB 3.3Å; V212-K216 WeakPolarHBondContact O-CB 3.4Å; V212-K216 PolarHBondContact O-N 3.36Å
213	E	80.2	Confident	78.7	Confident	58 Å²	58	48.8 Å²	48.8	27%	0.271	25%	0.25	S	S	.	.	H	α-helix	trans	-61.1	-37.2	177.1	-66.4	-56.7	136.9	0	0	112.3	M209 W210 K217	M209-E213 PolarHBondContact O-N 2.68Å; M209-E213 VanDerWaalsContact O-N 3.14Å; W210-E213 PolarHBondContact O-N 3.24Å; E213-K217 PolarHBondContact O-N 3.38Å; E213-K217 VanDerWaalsContact O-N 3.16Å
214	E	77.1	Confident	79.2	Confident	18 Å²	18	48.2 Å²	48.2	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-45.9	176.3	-165.4	60.8	-156.2	0	0	111.3	W210 L211 V212 K216 K217 N218	W210-E214 WeakPolarHBondContact O-CB 3.24Å; W210-E214 PolarHBondContact O-N 3.18Å; L211-E214 PolarHBondContact O-N 3.44Å; V212-E214 VanDerWaalsContact C-N 3.26Å; V212-E214 PolarHBondContact O-N 2.85Å; E214-K216 VanDerWaalsContact C-N 3.32Å; E214-K216 PolarHBondContact O-N 2.93Å; E214-K217 PolarHBondContact O-N 3.39Å; E214-N218 WeakPolarHBondContact CG-ND2 3.42Å; E214-N218 WeakPolarHBondContact O-CB 3.45Å; E214-N218 PolarHBondContact O-N 3.48Å; E214-N218 PolarHBondContact O-ND2 2.92Å; E214-N218 PolarHBondContact OE1-ND2 3.36Å
215	A	79.3	Confident	80.2	Confident	10 Å²	10	43.8 Å²	43.8	8%	0.083	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-42.6	174.1	0	0	0	0	0	111.5	V95 L211 V212 K217 N218 M219	V95-A215 HydrophobicContact CG2-CB 4.21Å; L211-A215 WeakPolarHBondContact O-CB 3.39Å; L211-A215 PolarHBondContact O-N 3.2Å; V212-A215 PolarHBondContact O-N 3.34Å; A215-K217 PolarHBondContact O-N 2.87Å; A215-N218 PolarHBondContact O-N 3.12Å; A215-M219 HydrophobicContact CB-CG 4.4Å; A215-M219 WeakPolarHBondContact O-CB 3.34Å; A215-M219 WeakPolarHBondContact O-CG 3.4Å; A215-M219 PolarHBondContact O-N 3.11Å
216	K	84.2	Confident	81.5	Confident	89 Å²	89	38.8 Å²	38.8	39%	0.387	19%	0.194	S	C	.	.	H	α-helix	trans	-60.4	-34.4	177.9	-171.5	172.2	-175.4	170	0	112.8	I189 E193 V212 E214 P220	I189-K216 HydrophobicContact CG2-CB 3.92Å; I189-K216 HydrophobicContact CG2-CG 4.05Å; E193-K216 IonicContact OE1-NZ 3.02Å; E193-K216 IonicContact OE2-NZ 3.51Å; E193-K216 PolarHBondContact OE2-NZ 2.94Å; V212-K216 VanDerWaalsContact O-CB 3.3Å; V212-K216 WeakPolarHBondContact O-CB 3.4Å; V212-K216 PolarHBondContact O-N 3.36Å; E214-K216 VanDerWaalsContact C-N 3.32Å; E214-K216 PolarHBondContact O-N 2.93Å; K216-P220 VanDerWaalsContact O-CD 3.24Å; K216-P220 WeakPolarHBondContact O-CD 3.35Å; K216-P220 WeakPolarHBondContact O-CG 3.37Å
217	K	83.9	Confident	82.8	Confident	99 Å²	99	37.5 Å²	37.5	43%	0.43	19%	0.19	S	C	.	.	H	α-helix	trans	-79.2	-42.3	176.7	-174.8	-172.8	167.7	-147.8	0	112.6	E213 E214 A215 Q335	E213-K217 PolarHBondContact O-N 3.38Å; E213-K217 VanDerWaalsContact O-N 3.16Å; E214-K217 PolarHBondContact O-N 3.39Å; A215-K217 PolarHBondContact O-N 2.87Å; K217-Q335 VanDerWaalsContact NZ-OE1 3.12Å
218	N	82.4	Confident	84.3	Confident	7 Å²	7	35.4 Å²	35.4	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-88.2	-34.9	-170.1	-66	-20.3	0	0	0	113.2	E214 A215 L221 E222 L333	E214-N218 WeakPolarHBondContact CG-ND2 3.42Å; E214-N218 WeakPolarHBondContact O-CB 3.45Å; E214-N218 PolarHBondContact O-N 3.48Å; E214-N218 PolarHBondContact O-ND2 2.92Å; E214-N218 PolarHBondContact OE1-ND2 3.36Å; A215-N218 PolarHBondContact O-N 3.12Å; N218-L221 WeakPolarHBondContact O-CB 3.29Å; N218-L221 PolarHBondContact O-N 2.94Å; N218-E222 PolarHBondContact O-N 3.2Å; N218-L333 HydrophobicContact CB-CD1 3.78Å
219	M	83.8	Confident	85.5	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-55.5	-45.3	-179	-74.5	-65.1	-53.7	0	0	113.2	T91 K94 L158 S185 I189 A215 L221 E222 L223	T91-M219 HydrophobicContact CG2-CE 4.15Å; K94-M219 HydrophobicContact CB-SD 4.09Å; K94-M219 HydrophobicContact CG-SD 3.65Å; L158-M219 HydrophobicContact CD1-CE 4.49Å; L158-M219 HydrophobicContact CD2-CE 3.86Å; S185-M219 WeakPolarHBondContact OG-CE 3.47Å; I189-M219 HydrophobicContact CD1-CB 3.58Å; I189-M219 HydrophobicContact CD1-CG 3.82Å; A215-M219 HydrophobicContact CB-CG 4.4Å; A215-M219 WeakPolarHBondContact O-CB 3.34Å; A215-M219 WeakPolarHBondContact O-CG 3.4Å; A215-M219 PolarHBondContact O-N 3.11Å; M219-L221 VanDerWaalsContact C-N 3.26Å; M219-L221 PolarHBondContact O-N 2.79Å; M219-E222 PolarHBondContact O-N 2.95Å; M219-L223 VanDerWaalsContact O-CG 3.26Å; M219-L223 WeakPolarHBondContact O-CG 3.42Å; M219-L223 PolarHBondContact O-N 3.29Å
220	P	87	Confident	86.6	Confident	75 Å²	75	36.8 Å²	36.8	49%	0.487	18%	0.183	S	C	.	.	H	α-helix	trans	-61	-33.8	176.1	-24	35.1	0	0	0	113.6	K216 L223 D224	K216-P220 VanDerWaalsContact O-CD 3.24Å; K216-P220 WeakPolarHBondContact O-CD 3.35Å; K216-P220 WeakPolarHBondContact O-CG 3.37Å; P220-L223 PolarHBondContact O-N 3.45Å; P220-D224 PolarHBondContact O-N 3.37Å
221	L	87.8	Confident	87.7	Confident	70 Å²	70	35.6 Å²	35.6	37%	0.366	18%	0.18	S	C	.	.	H	α-helix	trans	-71.8	-36	178.7	-61	174.5	0	0	0	111.7	N218 M219 L223 D224 N227	N218-L221 WeakPolarHBondContact O-CB 3.29Å; N218-L221 PolarHBondContact O-N 2.94Å; M219-L221 VanDerWaalsContact C-N 3.26Å; M219-L221 PolarHBondContact O-N 2.79Å; L221-L223 VanDerWaalsContact C-N 3.34Å; L221-D224 PolarHBondContact O-N 3.43Å; L221-N227 PolarHBondContact O-ND2 3.05Å
222	E	86	Confident	88.9	Confident	10 Å²	10	34.7 Å²	34.7	5%	0.047	18%	0.175	C	C	.	.	H	α-helix	trans	-76	-21.9	176.4	-68.8	-163.8	-134.3	0	0	113.4	K94 H98 L158 N218 M219 D224 F225	K94-E222 VanDerWaalsContact CE-CD 3.47Å; K94-E222 VanDerWaalsContact CE-OE1 3.29Å; K94-E222 WeakPolarHBondContact CE-OE1 3.14Å; K94-E222 WeakPolarHBondContact CE-OE2 3.13Å; K94-E222 IonicContact NZ-OE1 2.58Å; K94-E222 IonicContact NZ-OE2 2.84Å; K94-E222 PolarHBondContact NZ-OE2 3.33Å; H98-E222 IonicContact NE2-OE1 2.77Å; L158-E222 HydrophobicContact CD1-CB 3.83Å; N218-E222 PolarHBondContact O-N 3.2Å; M219-E222 PolarHBondContact O-N 2.95Å; E222-D224 VanDerWaalsContact C-N 3.35Å; E222-F225 WeakPolarHBondContact O-CE1 3.38Å
223	L	88.3	Confident	89.8	Confident	18 Å²	18	38.4 Å²	38.4	9%	0.094	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.9	174.4	-65	174.8	0	0	0	113.4	L158 Q177 V181 M219 P220 L221 K257	L158-L223 HydrophobicContact CB-CD2 4.47Å; L158-L223 HydrophobicContact CD1-CD2 4.12Å; L158-L223 HydrophobicContact CD2-CD2 4.17Å; L158-L223 HydrophobicContact CG-CD2 4.48Å; Q177-L223 PolarHBondContact NE2-O 3.36Å; Q177-L223 VanDerWaalsContact NE2-O 3.13Å; V181-L223 HydrophobicContact CG1-CD2 3.57Å; M219-L223 VanDerWaalsContact O-CG 3.26Å; M219-L223 WeakPolarHBondContact O-CG 3.42Å; M219-L223 PolarHBondContact O-N 3.29Å; P220-L223 PolarHBondContact O-N 3.45Å; L221-L223 VanDerWaalsContact C-N 3.34Å; L223-K257 VanDerWaalsContact O-O 3.11Å
224	D	93.3	Very high	90.7	Very high	37 Å²	37	40.2 Å²	40.2	20%	0.198	20%	0.199	C	C	.	.			trans	-105.5	94.2	175.6	-166.4	-26.6	0	0	0	109.7	P220 L221 E222 L226 N227 E228 K257	P220-D224 PolarHBondContact O-N 3.37Å; L221-D224 PolarHBondContact O-N 3.43Å; E222-D224 VanDerWaalsContact C-N 3.35Å; D224-L226 PolarHBondContact O-N 2.72Å; D224-L226 WeakPolarHBondContact OD1-CB 3.08Å; D224-L226 PolarHBondContact OD1-N 3.11Å; D224-L226 VanDerWaalsContact OD1-N 3.13Å; D224-N227 HydrophobicContact CB-CB 4.27Å; D224-N227 WeakPolarHBondContact O-CB 3.18Å; D224-N227 PolarHBondContact O-N 2.73Å; D224-E228 PolarHBondContact O-N 2.96Å; D224-K257 WeakPolarHBondContact OD2-CE 3.45Å; D224-K257 IonicContact OD2-NZ 3.2Å; D224-K257 PolarHBondContact OD2-NZ 3.09Å
225	F	96	Very high	91.7	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-68.2	-15.6	-178.7	-74.3	-7.9	0	0	0	114.7	A159 K175 Q177 E222 N227 E228 G229 K257 R258 L260	A159-F225 HydrophobicContact CB-CE2 4.22Å; A159-F225 HydrophobicContact CB-CZ 3.67Å; K175-F225 HydrophobicContact CD-CE1 4.38Å; K175-F225 HydrophobicContact CD-CE2 4.24Å; K175-F225 HydrophobicContact CD-CZ 4.13Å; K175-F225 HydrophobicContact CG-CE2 3.96Å; K175-F225 HydrophobicContact CG-CZ 4.14Å; Q177-F225 HydrophobicContact CB-CE2 3.85Å; Q177-F225 HydrophobicContact CB-CZ 4.02Å; Q177-F225 HydrophobicContact CG-CZ 4.48Å; E222-F225 WeakPolarHBondContact O-CE1 3.38Å; F225-N227 VanDerWaalsContact C-N 3.34Å; F225-E228 WeakPolarHBondContact CD1-OE2 3.42Å; F225-E228 PolarHBondContact O-N 2.68Å; F225-G229 PolarHBondContact O-N 3.12Å; F225-K257 PolarHBondContact N-O 3.4Å; F225-R258 VanDerWaalsContact CD2-C 3.46Å; F225-R258 WeakPolarHBondContact CD2-O 3.46Å; F225-R258 WeakPolarHBondContact CE2-O 3.42Å; F225-L260 HydrophobicContact CB-CB 4.01Å; F225-L260 HydrophobicContact CD2-CB 4.07Å; F225-L260 HydrophobicContact CG-CB 4.19Å
226	L	96.6	Very high	92.5	Very high	49 Å²	49	40.8 Å²	40.8	26%	0.257	21%	0.207	S	C	.	.	H	α-helix	trans	-68.7	-38.9	170.1	-59.5	176.7	0	0	0	110.5	D224 E228 G229 H230 W252 K257	D224-L226 PolarHBondContact O-N 2.72Å; D224-L226 WeakPolarHBondContact OD1-CB 3.08Å; D224-L226 PolarHBondContact OD1-N 3.11Å; D224-L226 VanDerWaalsContact OD1-N 3.13Å; L226-E228 VanDerWaalsContact C-N 3.34Å; L226-G229 PolarHBondContact O-N 3.06Å; L226-H230 PolarHBondContact O-CD2 3.15Å; L226-H230 PolarHBondContact O-N 3.13Å; L226-W252 HydrophobicContact CB-CZ3 4.48Å; L226-W252 HydrophobicContact CD2-CE3 4.17Å; L226-W252 HydrophobicContact CD2-CZ3 3.81Å; L226-K257 HydrophobicContact CD1-CG 3.85Å; L226-K257 HydrophobicContact CG-CG 4.25Å
227	N	96	Very high	93.2	Very high	46 Å²	46	44.8 Å²	44.8	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-42.1	173.5	171.8	72.3	0	0	0	111.3	L221 D224 F225 H230 N231	L221-N227 PolarHBondContact O-ND2 3.05Å; D224-N227 HydrophobicContact CB-CB 4.27Å; D224-N227 WeakPolarHBondContact O-CB 3.18Å; D224-N227 PolarHBondContact O-N 2.73Å; F225-N227 VanDerWaalsContact C-N 3.34Å; N227-H230 PolarHBondContact O-N 3.45Å; N227-N231 PolarHBondContact ND2-ND2 2.89Å; N227-N231 WeakPolarHBondContact O-CB 3.47Å; N227-N231 PolarHBondContact O-N 3.48Å; N227-N231 PolarHBondContact O-ND2 2.85Å; N227-N231 VanDerWaalsContact O-ND2 3.15Å
228	E	96.1	Very high	93.8	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.019	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-49.5	173.3	179.6	169.9	175	0	0	112	K175 D224 F225 L226 H230 N231 A232 L260 H331	K175-E228 IonicContact NZ-OE1 2.73Å; K175-E228 PolarHBondContact NZ-OE1 3.21Å; K175-E228 IonicContact NZ-OE2 3.02Å; K175-E228 PolarHBondContact NZ-OE2 3.15Å; D224-E228 PolarHBondContact O-N 2.96Å; F225-E228 WeakPolarHBondContact CD1-OE2 3.42Å; F225-E228 PolarHBondContact O-N 2.68Å; L226-E228 VanDerWaalsContact C-N 3.34Å; E228-H230 VanDerWaalsContact C-N 3.35Å; E228-H230 PolarHBondContact O-N 3.18Å; E228-N231 WeakPolarHBondContact O-CB 3.48Å; E228-N231 PolarHBondContact O-N 3.34Å; E228-A232 PolarHBondContact O-N 3.33Å; E228-L260 HydrophobicContact CB-CD2 4.28Å; E228-L260 HydrophobicContact CG-CD2 3.75Å; E228-H331 HydrophobicContact CG-CB 3.95Å; E228-H331 WeakPolarHBondContact O-CB 3.48Å; E228-H331 PolarHBondContact OE1-N 2.98Å
229	G	97.6	Very high	94.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-41.3	177.2	0	0	0	0	0	113.3	F225 L226 N231 A232 E233 W252	F225-G229 PolarHBondContact O-N 3.12Å; L226-G229 PolarHBondContact O-N 3.06Å; G229-N231 VanDerWaalsContact C-N 3.35Å; G229-N231 PolarHBondContact O-N 2.9Å; G229-A232 WeakPolarHBondContact O-CB 3.35Å; G229-A232 PolarHBondContact O-N 3.44Å; G229-E233 PolarHBondContact O-N 2.98Å; G229-E233 VanDerWaalsContact O-N 3.09Å; G229-W252 VanDerWaalsContact C-CH2 3.47Å
230	H	97.9	Very high	95.1	Very high	106 Å²	106	45.5 Å²	45.5	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-67.9	-35.8	177.7	-73.7	-44.6	0	0	0	112.2	L226 N227 E228 A232 K234 W252	L226-H230 PolarHBondContact O-CD2 3.15Å; L226-H230 PolarHBondContact O-N 3.13Å; N227-H230 PolarHBondContact O-N 3.45Å; E228-H230 VanDerWaalsContact C-N 3.35Å; E228-H230 PolarHBondContact O-N 3.18Å; H230-A232 VanDerWaalsContact C-N 3.35Å; H230-K234 VanDerWaalsContact O-CB 3.25Å; H230-K234 WeakPolarHBondContact O-CB 3.46Å; H230-K234 PolarHBondContact O-N 3.23Å; H230-W252 AromaticContact CE1-CH2 3.58Å; H230-W252 AromaticContact CE1-CZ2 3.84Å; H230-W252 AromaticContact CG-CH2 3.82Å; H230-W252 AromaticContact ND1-CH2 3.44Å; H230-W252 WeakPolarHBondContact ND1-CH2 3.43Å; H230-W252 AromaticContact ND1-CZ2 3.54Å
231	N	97.8	Very high	95.5	Very high	16 Å²	16	46.5 Å²	46.5	9%	0.086	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-41	173.3	-70.5	-29.6	0	0	0	111.2	N227 E228 G229 K234 V235 F303 H331 Y334	N227-N231 PolarHBondContact ND2-ND2 2.89Å; N227-N231 WeakPolarHBondContact O-CB 3.47Å; N227-N231 PolarHBondContact O-N 3.48Å; N227-N231 PolarHBondContact O-ND2 2.85Å; N227-N231 VanDerWaalsContact O-ND2 3.15Å; E228-N231 WeakPolarHBondContact O-CB 3.48Å; E228-N231 PolarHBondContact O-N 3.34Å; G229-N231 VanDerWaalsContact C-N 3.35Å; G229-N231 PolarHBondContact O-N 2.9Å; N231-K234 PolarHBondContact O-N 3.35Å; N231-V235 WeakPolarHBondContact O-CG2 3.47Å; N231-V235 PolarHBondContact O-N 3.03Å; N231-F303 HydrophobicContact CB-CZ 4.45Å; N231-F303 WeakPolarHBondContact OD1-CZ 3.37Å; N231-H331 HydrophobicContact CB-CB 3.98Å; N231-H331 WeakPolarHBondContact CB-O 3.2Å; N231-H331 PolarHBondContact ND2-O 3.34Å; N231-H331 VanDerWaalsContact ND2-O 3.12Å; N231-Y334 HydrophobicContact CB-CD2 3.71Å; N231-Y334 HydrophobicContact CB-CE2 3.86Å; N231-Y334 HydrophobicContact CB-CG 4.47Å
232	A	97.6	Very high	95.8	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-53.6	176.1	0	0	0	0	0	111.5	E228 G229 H230 K234 V235 A236 V247 I250 H331	E228-A232 PolarHBondContact O-N 3.33Å; G229-A232 WeakPolarHBondContact O-CB 3.35Å; G229-A232 PolarHBondContact O-N 3.44Å; H230-A232 VanDerWaalsContact C-N 3.35Å; A232-K234 VanDerWaalsContact C-N 3.32Å; A232-K234 PolarHBondContact O-N 2.86Å; A232-V235 PolarHBondContact O-N 3.34Å; A232-A236 WeakPolarHBondContact O-CB 3.24Å; A232-A236 PolarHBondContact O-N 3.44Å; A232-V247 HydrophobicContact CB-CG1 3.9Å; A232-I250 HydrophobicContact CB-CD1 4.17Å; A232-I250 HydrophobicContact CB-CG1 4.36Å; A232-H331 HydrophobicContact CB-CB 4.06Å; A232-H331 VanDerWaalsContact CB-CD2 3.46Å; A232-H331 WeakPolarHBondContact CB-CD2 3.43Å
233	E	98.1	Very high	96.2	Very high	87 Å²	87	49 Å²	49	41%	0.407	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-40.6	178.4	-70.2	-172.1	146.1	0	0	112.6	G229 V235 A236 K237 I250 W252	G229-E233 PolarHBondContact O-N 2.98Å; G229-E233 VanDerWaalsContact O-N 3.09Å; E233-V235 PolarHBondContact O-N 3.22Å; E233-A236 PolarHBondContact O-N 2.9Å; E233-K237 WeakPolarHBondContact O-CB 3.5Å; E233-K237 PolarHBondContact O-N 3.06Å; E233-I250 HydrophobicContact CG-CG1 4.36Å; E233-W252 HydrophobicContact CG-CZ2 4.34Å; E233-W252 PolarHBondContact OE1-NE1 2.62Å
234	K	97.9	Very high	96.5	Very high	96 Å²	96	49.1 Å²	49.1	42%	0.417	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-44.8	177	-178.8	177	174.9	-170.4	0	111.2	H230 N231 A232 M238 F303	H230-K234 VanDerWaalsContact O-CB 3.25Å; H230-K234 WeakPolarHBondContact O-CB 3.46Å; H230-K234 PolarHBondContact O-N 3.23Å; N231-K234 PolarHBondContact O-N 3.35Å; A232-K234 VanDerWaalsContact C-N 3.32Å; A232-K234 PolarHBondContact O-N 2.86Å; K234-M238 WeakPolarHBondContact O-CB 3.14Å; K234-M238 PolarHBondContact O-N 3.36Å; K234-F303 HydrophobicContact CD-CD1 4.12Å; K234-F303 HydrophobicContact CD-CE1 3.68Å; K234-F303 HydrophobicContact CD-CE2 4.35Å; K234-F303 HydrophobicContact CD-CZ 3.81Å; K234-F303 HydrophobicContact CG-CD1 4.43Å; K234-F303 HydrophobicContact CG-CE1 4.1Å; K234-F303 VanDerWaalsContact NZ-CE2 3.32Å
235	V	97.8	Very high	96.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.9	-43.6	177.4	171.1	0	0	0	0	111.5	N231 A232 E233 K237 M238 L239 V247 F303 Y334	N231-V235 WeakPolarHBondContact O-CG2 3.47Å; N231-V235 PolarHBondContact O-N 3.03Å; A232-V235 PolarHBondContact O-N 3.34Å; E233-V235 PolarHBondContact O-N 3.22Å; V235-K237 VanDerWaalsContact C-N 3.28Å; V235-K237 PolarHBondContact O-N 2.97Å; V235-M238 HydrophobicContact CG2-CE 4.26Å; V235-M238 PolarHBondContact O-N 3.29Å; V235-L239 HydrophobicContact CG1-CD1 3.94Å; V235-L239 HydrophobicContact CG1-CG 4.41Å; V235-L239 WeakPolarHBondContact O-CB 3.5Å; V235-L239 PolarHBondContact O-N 3.43Å; V235-V247 HydrophobicContact CG1-CG2 4.34Å; V235-F303 HydrophobicContact CG2-CD1 4.1Å; V235-F303 HydrophobicContact CG2-CE1 3.75Å; V235-Y334 HydrophobicContact CG2-CD1 4.49Å; V235-Y334 HydrophobicContact CG2-CE1 3.46Å; V235-Y334 VanDerWaalsContact CG2-CE1 3.46Å; V235-Y334 HydrophobicContact CG2-CE2 4.47Å; V235-Y334 VanDerWaalsContact CG2-CZ 3.46Å; V235-Y334 WeakPolarHBondContact CG2-OH 3.47Å
236	A	97.4	Very high	96.7	Very high	40 Å²	40	50.6 Å²	50.6	33%	0.331	26%	0.262	S	S	.	.	H	α-helix	trans	-55.1	-45.2	176	0	0	0	0	0	111.6	A232 E233 S240 V247	A232-A236 WeakPolarHBondContact O-CB 3.24Å; A232-A236 PolarHBondContact O-N 3.44Å; E233-A236 PolarHBondContact O-N 2.9Å; A236-S240 WeakPolarHBondContact O-CA 3.49Å; A236-S240 WeakPolarHBondContact O-CB 3.44Å; A236-S240 PolarHBondContact O-N 3.45Å; A236-S240 VanDerWaalsContact O-N 3.11Å; A236-V247 HydrophobicContact CB-CB 3.87Å; A236-V247 HydrophobicContact CB-CG1 4.18Å; A236-V247 HydrophobicContact CB-CG2 4.2Å
237	K	97.8	Very high	96.7	Very high	172 Å²	172	49 Å²	49	75%	0.748	25%	0.254	S	S	*	.	H	α-helix	trans	-68.4	-47.1	176.9	-176.1	175.2	-177.9	173.7	0	112.3	E233 V235 L239 S240	E233-K237 WeakPolarHBondContact O-CB 3.5Å; E233-K237 PolarHBondContact O-N 3.06Å; V235-K237 VanDerWaalsContact C-N 3.28Å; V235-K237 PolarHBondContact O-N 2.97Å; K237-L239 VanDerWaalsContact C-N 3.3Å; K237-L239 PolarHBondContact O-N 3.42Å; K237-S240 WeakPolarHBondContact O-CB 3.29Å; K237-S240 PolarHBondContact O-N 3.42Å; K237-S240 PolarHBondContact O-OG 3.48Å
238	M	96.8	Very high	96.8	Very high	28 Å²	28	47 Å²	47	14%	0.138	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-40	-176.8	-178.2	177.1	74.3	0	0	112	K234 V235 M297 H301 F303	K234-M238 WeakPolarHBondContact O-CB 3.14Å; K234-M238 PolarHBondContact O-N 3.36Å; V235-M238 HydrophobicContact CG2-CE 4.26Å; V235-M238 PolarHBondContact O-N 3.29Å; M238-M297 HydrophobicContact CE-CG 3.82Å; M238-H301 HydrophobicContact CE-CB 4.4Å; M238-H301 HydrophobicContact CG-CB 4.41Å; M238-H301 VanDerWaalsContact CG-CE1 3.44Å; M238-H301 WeakPolarHBondContact CG-CE1 3.41Å; M238-H301 WeakPolarHBondContact CG-NE2 3.16Å; M238-H301 HydrophobicContact SD-CB 3.48Å; M238-H301 WeakPolarHBondContact SD-CB 3.35Å; M238-F303 HydrophobicContact CE-CD1 4.17Å; M238-F303 HydrophobicContact SD-CB 4.27Å; M238-F303 HydrophobicContact SD-CD1 4.34Å
239	L	96.6	Very high	96.9	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	17.1	-174.6	-58.2	-175.4	0	0	0	113.1	V235 K237 H241 F242 L245 M293 E296 M297	V235-L239 HydrophobicContact CG1-CD1 3.94Å; V235-L239 HydrophobicContact CG1-CG 4.41Å; V235-L239 WeakPolarHBondContact O-CB 3.5Å; V235-L239 PolarHBondContact O-N 3.43Å; K237-L239 VanDerWaalsContact C-N 3.3Å; K237-L239 PolarHBondContact O-N 3.42Å; L239-H241 PolarHBondContact O-N 3.22Å; L239-F242 HydrophobicContact CB-CD2 4.11Å; L239-F242 HydrophobicContact CD2-CD2 4.19Å; L239-F242 HydrophobicContact CD2-CE2 3.99Å; L239-F242 WeakPolarHBondContact O-CB 3.47Å; L239-F242 PolarHBondContact O-N 3.2Å; L239-L245 HydrophobicContact CB-CD2 3.59Å; L239-L245 HydrophobicContact CD1-CD2 3.74Å; L239-L245 HydrophobicContact CG-CD2 4.32Å; L239-M293 HydrophobicContact CD1-CG 3.71Å; L239-E296 HydrophobicContact CD2-CB 4.22Å; L239-E296 HydrophobicContact CD2-CG 3.85Å; L239-M297 HydrophobicContact CD1-CG 3.91Å; L239-M297 HydrophobicContact CD1-SD 4.24Å
240	S	96.4	Very high	96.9	Very high	93 Å²	93	52.9 Å²	52.9	65%	0.65	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.4	-179.7	53.9	0	0	0	0	114.9	A236 K237 F242	A236-S240 WeakPolarHBondContact O-CA 3.49Å; A236-S240 WeakPolarHBondContact O-CB 3.44Å; A236-S240 PolarHBondContact O-N 3.45Å; A236-S240 VanDerWaalsContact O-N 3.11Å; K237-S240 WeakPolarHBondContact O-CB 3.29Å; K237-S240 PolarHBondContact O-N 3.42Å; K237-S240 PolarHBondContact O-OG 3.48Å; S240-F242 VanDerWaalsContact C-N 3.29Å
241	H	95	Very high	96.9	Very high	96 Å²	96	49.4 Å²	49.4	44%	0.444	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.4	176.5	63.5	-84.7	0	0	0	113.8	L239 P243	L239-H241 PolarHBondContact O-N 3.22Å; H241-P243 VanDerWaalsContact O-CD 3.23Å; H241-P243 WeakPolarHBondContact O-CD 3.48Å
242	F	95.4	Very high	96.9	Very high	27 Å²	27	52.2 Å²	52.2	12%	0.118	27%	0.265	C	S	.	.			trans	-94.4	99.4	172.2	-68.2	-34.8	0	0	0	110.4	L239 S240 F244 L245 E296	L239-F242 HydrophobicContact CB-CD2 4.11Å; L239-F242 HydrophobicContact CD2-CD2 4.19Å; L239-F242 HydrophobicContact CD2-CE2 3.99Å; L239-F242 WeakPolarHBondContact O-CB 3.47Å; L239-F242 PolarHBondContact O-N 3.2Å; S240-F242 VanDerWaalsContact C-N 3.29Å; F242-F244 HydrophobicContact CB-CD1 4.21Å; F242-F244 HydrophobicContact CB-CE1 3.74Å; F242-F244 HydrophobicContact CB-CE2 4.13Å; F242-F244 HydrophobicContact CB-CZ 3.7Å; F242-F244 AromaticContact CD1-CE1 3.76Å; F242-F244 HydrophobicContact CD1-CE1 3.76Å; F242-F244 AromaticContact CD1-CZ 3.95Å; F242-F244 HydrophobicContact CD1-CZ 3.95Å; F242-F244 AromaticContact CD2-CZ 3.99Å; F242-F244 HydrophobicContact CD2-CZ 3.99Å; F242-F244 AromaticContact CG-CE1 3.8Å; F242-F244 HydrophobicContact CG-CE1 3.8Å; F242-F244 HydrophobicContact CG-CE2 4.41Å; F242-F244 AromaticContact CG-CZ 3.62Å; F242-F244 HydrophobicContact CG-CZ 3.62Å; F242-F244 PolarHBondContact O-N 2.89Å; F242-F244 VanDerWaalsContact O-N 3.13Å; F242-L245 HydrophobicContact CB-CB 4.21Å; F242-L245 PolarHBondContact O-N 3.27Å; F242-E296 HydrophobicContact CE2-CB 3.8Å; F242-E296 HydrophobicContact CE2-CG 3.96Å; F242-E296 HydrophobicContact CZ-CB 3.96Å; F242-E296 HydrophobicContact CZ-CG 4.01Å
243	P	93.4	Very high	96.9	Very high	106 Å²	106	59.7 Å²	59.7	69%	0.688	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.2	-175.5	30.4	-37.5	0	0	0	113.4	H241	H241-P243 VanDerWaalsContact O-CD 3.23Å; H241-P243 WeakPolarHBondContact O-CD 3.48Å
244	F	95.1	Very high	96.8	Very high	20 Å²	20	56.9 Å²	56.9	9%	0.088	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.6	175.7	62.7	-104.1	0	0	0	112.7	F242 N289 K292 M293 E325 I326	F242-F244 HydrophobicContact CB-CD1 4.21Å; F242-F244 HydrophobicContact CB-CE1 3.74Å; F242-F244 HydrophobicContact CB-CE2 4.13Å; F242-F244 HydrophobicContact CB-CZ 3.7Å; F242-F244 AromaticContact CD1-CE1 3.76Å; F242-F244 HydrophobicContact CD1-CE1 3.76Å; F242-F244 AromaticContact CD1-CZ 3.95Å; F242-F244 HydrophobicContact CD1-CZ 3.95Å; F242-F244 AromaticContact CD2-CZ 3.99Å; F242-F244 HydrophobicContact CD2-CZ 3.99Å; F242-F244 AromaticContact CG-CE1 3.8Å; F242-F244 HydrophobicContact CG-CE1 3.8Å; F242-F244 HydrophobicContact CG-CE2 4.41Å; F242-F244 AromaticContact CG-CZ 3.62Å; F242-F244 HydrophobicContact CG-CZ 3.62Å; F242-F244 PolarHBondContact O-N 2.89Å; F242-F244 VanDerWaalsContact O-N 3.13Å; F244-N289 HydrophobicContact CD1-CB 4.17Å; F244-N289 HydrophobicContact CD2-CB 3.65Å; F244-N289 HydrophobicContact CE1-CB 4.14Å; F244-N289 HydrophobicContact CE2-CB 3.63Å; F244-N289 WeakPolarHBondContact CE2-O 3.42Å; F244-N289 HydrophobicContact CG-CB 3.93Å; F244-N289 HydrophobicContact CZ-CB 3.88Å; F244-N289 WeakPolarHBondContact CZ-O 3.37Å; F244-K292 HydrophobicContact CZ-CB 4.31Å; F244-M293 HydrophobicContact CE2-CB 4.32Å; F244-E325 CarbonylContact O-C 3.59Å; F244-E325 WeakPolarHBondContact O-CA 3.16Å; F244-I326 HydrophobicContact CD2-CD1 4.16Å; F244-I326 HydrophobicContact CE2-CD1 4.5Å; F244-I326 PolarHBondContact O-N 2.87Å
245	L	96.8	Very high	96.8	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.131	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.9	-178.4	175.3	60.3	0	0	0	110.2	L239 F242 V247 M293 L328	L239-L245 HydrophobicContact CB-CD2 3.59Å; L239-L245 HydrophobicContact CD1-CD2 3.74Å; L239-L245 HydrophobicContact CG-CD2 4.32Å; F242-L245 HydrophobicContact CB-CB 4.21Å; F242-L245 PolarHBondContact O-N 3.27Å; L245-V247 HydrophobicContact CD1-CG2 4.33Å; L245-V247 HydrophobicContact CD2-CG2 4.45Å; L245-V247 HydrophobicContact CG-CG2 4.29Å; L245-M293 HydrophobicContact CD1-SD 3.53Å; L245-M293 VanDerWaalsContact CD1-SD 3.53Å; L245-M293 HydrophobicContact CD2-CG 4.27Å; L245-M293 HydrophobicContact CD2-SD 3.89Å; L245-M293 HydrophobicContact CG-SD 4.24Å; L245-L328 HydrophobicContact CD1-CB 4.19Å
246	K	96.8	Very high	96.8	Very high	45 Å²	45	54 Å²	54	20%	0.196	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.1	168.7	176.9	65	-179.7	177.1	0	109.1	E263 L265 I326 V327 L328	K246-E263 WeakPolarHBondContact CE-OE2 3.49Å; K246-E263 VanDerWaalsContact NZ-CD 3.33Å; K246-E263 IonicContact NZ-OE1 2.62Å; K246-E263 PolarHBondContact NZ-OE1 3.23Å; K246-E263 VanDerWaalsContact NZ-OE1 3.15Å; K246-E263 IonicContact NZ-OE2 3.07Å; K246-E263 PolarHBondContact NZ-OE2 3.33Å; K246-L265 HydrophobicContact CD-CD1 4.34Å; K246-L265 HydrophobicContact CG-CD1 3.54Å; K246-L265 HydrophobicContact CG-CD2 4.47Å; K246-I326 PolarHBondContact N-O 2.88Å; K246-V327 HydrophobicContact CB-CG2 4.19Å; K246-V327 HydrophobicContact CG-CG2 4.37Å; K246-V327 VanDerWaalsContact O-CA 3.27Å; K246-V327 WeakPolarHBondContact O-CA 3.25Å; K246-L328 PolarHBondContact O-N 2.94Å
247	V	97.5	Very high	96.7	Very high	15 Å²	15	57.4 Å²	57.4	9%	0.091	29%	0.291	C	S	.	.			trans	-109.6	130.5	167.1	177.7	0	0	0	0	107	A232 V235 A236 L245 H331	A232-V247 HydrophobicContact CB-CG1 3.9Å; V235-V247 HydrophobicContact CG1-CG2 4.34Å; A236-V247 HydrophobicContact CB-CB 3.87Å; A236-V247 HydrophobicContact CB-CG1 4.18Å; A236-V247 HydrophobicContact CB-CG2 4.2Å; L245-V247 HydrophobicContact CD1-CG2 4.33Å; L245-V247 HydrophobicContact CD2-CG2 4.45Å; L245-V247 HydrophobicContact CG-CG2 4.29Å; V247-H331 WeakPolarHBondContact CG1-NE2 3.44Å
248	P	97	Very high	96.5	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.039	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-53.8	138.4	175.3	-23.2	29.8	0	0	0	112.2	M262 E263 L265 L328 L329	P248-M262 HydrophobicContact CB-CB 3.96Å; P248-M262 HydrophobicContact CB-CG 4.1Å; P248-M262 HydrophobicContact CB-SD 3.9Å; P248-M262 HydrophobicContact CG-SD 3.95Å; P248-E263 HydrophobicContact CB-CB 4.23Å; P248-L265 HydrophobicContact CB-CD1 4.29Å; P248-L265 HydrophobicContact CG-CD1 3.87Å; P248-L328 WeakPolarHBondContact CD-O 3.4Å; P248-L329 HydrophobicContact CG-CD2 4.01Å
249	M	97.7	Very high	96.5	Very high	108 Å²	108	48.8 Å²	48.8	53%	0.532	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-70.6	142	169.4	-63.3	-173.1	-60.1	0	0	110.6	M262 E263	M249-M262 CarbonylContact O-C 3.56Å; M249-M262 WeakPolarHBondContact O-CA 3.48Å; M249-M262 WeakPolarHBondContact O-CB 3.39Å; M249-E263 HydrophobicContact CB-CB 4.31Å; M249-E263 PolarHBondContact N-OE2 3.42Å; M249-E263 PolarHBondContact O-N 3.15Å
250	I	98.4	Very high	96.6	Very high	19 Å²	19	48.8 Å²	48.8	10%	0.097	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-93.1	136.4	178.3	-52.2	-53.5	0	0	0	110.1	A232 E233 W252 L260 M262	A232-I250 HydrophobicContact CB-CD1 4.17Å; A232-I250 HydrophobicContact CB-CG1 4.36Å; E233-I250 HydrophobicContact CG-CG1 4.36Å; I250-W252 HydrophobicContact CB-CD2 4.48Å; I250-W252 HydrophobicContact CB-CZ2 4.22Å; I250-W252 HydrophobicContact CG1-CZ2 4.48Å; I250-W252 HydrophobicContact CG2-CD2 3.74Å; I250-W252 HydrophobicContact CG2-CE3 3.99Å; I250-W252 HydrophobicContact CG2-CG 4.27Å; I250-W252 HydrophobicContact CG2-CH2 4.19Å; I250-W252 HydrophobicContact CG2-CZ2 3.93Å; I250-W252 HydrophobicContact CG2-CZ3 4.2Å; I250-L260 HydrophobicContact CD1-CD1 4.2Å; I250-L260 HydrophobicContact CG2-CD1 3.87Å; I250-M262 HydrophobicContact CD1-CB 3.89Å
251	Y	98	Very high	96.7	Very high	32 Å²	32	44.3 Å²	44.3	13%	0.125	22%	0.221	C	C	.	.			trans	-100.4	89	172.9	-64.6	-90.3	0	0	0	109	L166 V172 D253 L254 S255 T261 E263	L166-Y251 HydrophobicContact CD1-CD1 4.24Å; L166-Y251 HydrophobicContact CD1-CE1 4.14Å; V172-Y251 HydrophobicContact CG1-CD2 3.83Å; V172-Y251 HydrophobicContact CG1-CE2 3.48Å; V172-Y251 VanDerWaalsContact CG1-CE2 3.48Å; V172-Y251 HydrophobicContact CG1-CG 4.49Å; Y251-D253 VanDerWaalsContact C-N 3.33Å; Y251-D253 PolarHBondContact O-N 3.33Å; Y251-L254 CarbonylContact O-C 3.57Å; Y251-L254 PolarHBondContact O-N 3.46Å; Y251-L254 VanDerWaalsContact O-N 3.12Å; Y251-S255 PolarHBondContact O-N 3.47Å; Y251-S255 PolarHBondContact O-OG 2.77Å; Y251-T261 HydrophobicContact CD2-CG2 4.11Å; Y251-T261 HydrophobicContact CG-CG2 4.3Å; Y251-T261 PolarHBondContact N-O 3.1Å; Y251-E263 HydrophobicContact CE2-CB 4.38Å
252	W	98	Very high	96.8	Very high	75 Å²	75	40.4 Å²	40.4	28%	0.284	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-62.8	-34.9	-173.1	-68.9	112.3	0	0	0	114	L226 G229 H230 E233 I250 L254 S255	L226-W252 HydrophobicContact CB-CZ3 4.48Å; L226-W252 HydrophobicContact CD2-CE3 4.17Å; L226-W252 HydrophobicContact CD2-CZ3 3.81Å; G229-W252 VanDerWaalsContact C-CH2 3.47Å; H230-W252 AromaticContact CE1-CH2 3.58Å; H230-W252 AromaticContact CE1-CZ2 3.84Å; H230-W252 AromaticContact CG-CH2 3.82Å; H230-W252 AromaticContact ND1-CH2 3.44Å; H230-W252 WeakPolarHBondContact ND1-CH2 3.43Å; H230-W252 AromaticContact ND1-CZ2 3.54Å; E233-W252 HydrophobicContact CG-CZ2 4.34Å; E233-W252 PolarHBondContact OE1-NE1 2.62Å; I250-W252 HydrophobicContact CB-CD2 4.48Å; I250-W252 HydrophobicContact CB-CZ2 4.22Å; I250-W252 HydrophobicContact CG1-CZ2 4.48Å; I250-W252 HydrophobicContact CG2-CD2 3.74Å; I250-W252 HydrophobicContact CG2-CE3 3.99Å; I250-W252 HydrophobicContact CG2-CG 4.27Å; I250-W252 HydrophobicContact CG2-CH2 4.19Å; I250-W252 HydrophobicContact CG2-CZ2 3.93Å; I250-W252 HydrophobicContact CG2-CZ3 4.2Å; W252-L254 PolarHBondContact O-N 2.93Å; W252-L254 VanDerWaalsContact O-N 3.09Å; W252-S255 PolarHBondContact O-N 3.41Å
253	D	96.2	Very high	96.9	Very high	162 Å²	162	41 Å²	41	87%	0.866	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-64.1	-16.1	177.9	-57.9	-37.4	0	0	0	113.2	Y251	Y251-D253 VanDerWaalsContact C-N 3.33Å; Y251-D253 PolarHBondContact O-N 3.33Å
254	L	97.3	Very high	97	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.141	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-118.7	21.5	178.7	-60.5	176.5	0	0	0	111.7	L144 F145 L166 Y251 W252 T261	L144-L254 HydrophobicContact CD2-CD2 3.79Å; F145-L254 HydrophobicContact CE1-CD1 4.46Å; L166-L254 HydrophobicContact CD1-CD1 4.32Å; L166-L254 HydrophobicContact CD2-CD1 3.36Å; Y251-L254 CarbonylContact O-C 3.57Å; Y251-L254 PolarHBondContact O-N 3.46Å; Y251-L254 VanDerWaalsContact O-N 3.12Å; W252-L254 PolarHBondContact O-N 2.93Å; W252-L254 VanDerWaalsContact O-N 3.09Å; L254-T261 HydrophobicContact CB-CG2 4.07Å; L254-T261 HydrophobicContact CD1-CG2 4.24Å; L254-T261 WeakPolarHBondContact O-CB 3.48Å; L254-T261 PolarHBondContact O-OG1 3.17Å
255	S	98	Very high	97	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.091	18%	0.181	C	C	.	.			trans	-126.4	138	-178.3	-59.1	0	0	0	0	111.3	Y251 W252 I259 T261	Y251-S255 PolarHBondContact O-N 3.47Å; Y251-S255 PolarHBondContact O-OG 2.77Å; W252-S255 PolarHBondContact O-N 3.41Å; S255-I259 CarbonylContact C-O 3.48Å; S255-I259 VanDerWaalsContact CA-O 3.23Å; S255-I259 WeakPolarHBondContact CA-O 3.4Å; S255-T261 PolarHBondContact OG-N 3.16Å
256	T	97.1	Very high	96.8	Very high	23 Å²	23	42.8 Å²	42.8	14%	0.141	20%	0.204	C	C	.	.			trans	-133.5	-171.6	176.8	76.5	0	0	0	0	109.3	D136 L137 R258 I259	D136-T256 HydrophobicContact CB-CG2 3.99Å; D136-T256 PolarHBondContact OD1-OG1 2.8Å; L137-T256 HydrophobicContact CD2-CG2 3.59Å; L137-T256 HydrophobicContact CG-CG2 4.43Å; T256-R258 PolarHBondContact O-N 3.13Å; T256-R258 PolarHBondContact OG1-N 2.91Å; T256-R258 VanDerWaalsContact OG1-N 3.11Å; T256-I259 PolarHBondContact N-O 3.24Å; T256-I259 PolarHBondContact OG1-N 3.45Å
257	K	94.9	Very high	96.6	Very high	112 Å²	112	41.9 Å²	41.9	49%	0.487	21%	0.208	S	C	.	.	S	Bend	trans	-63.2	-26.4	171.9	-66.3	-164.5	169.8	-161	0	113.3	L223 D224 F225 L226	L223-K257 VanDerWaalsContact O-O 3.11Å; D224-K257 WeakPolarHBondContact OD2-CE 3.45Å; D224-K257 IonicContact OD2-NZ 3.2Å; D224-K257 PolarHBondContact OD2-NZ 3.09Å; F225-K257 PolarHBondContact N-O 3.4Å; L226-K257 HydrophobicContact CD1-CG 3.85Å; L226-K257 HydrophobicContact CG-CG 4.25Å
258	R	94.6	Very high	96.4	Very high	18 Å²	18	41.5 Å²	41.5	7%	0.068	21%	0.207	C	C	.	.	S	Bend	trans	-108.1	-9.9	-176	-59.3	173.1	54.2	-161.9	5.4	113.4	V132 E135 D136 Q177 F225 T256	V132-R258 HydrophobicContact CG1-CB 4.18Å; E135-R258 IonicContact OE2-CZ 3.11Å; E135-R258 IonicContact OE2-NH1 2.89Å; E135-R258 PolarHBondContact OE2-NH1 3.07Å; E135-R258 IonicContact OE2-NH2 2.89Å; D136-R258 WeakPolarHBondContact OD1-CB 3.26Å; D136-R258 WeakPolarHBondContact OD1-CD 3.37Å; D136-R258 WeakPolarHBondContact OD2-CD 3.47Å; D136-R258 IonicContact OD2-CZ 3.09Å; D136-R258 IonicContact OD2-NE 3.59Å; D136-R258 IonicContact OD2-NH1 3.16Å; D136-R258 PolarHBondContact OD2-NH1 3.21Å; Q177-R258 HydrophobicContact CB-CB 4.19Å; Q177-R258 WeakPolarHBondContact CB-O 3.4Å; Q177-R258 PolarHBondContact N-O 2.79Å; F225-R258 VanDerWaalsContact CD2-C 3.46Å; F225-R258 WeakPolarHBondContact CD2-O 3.46Å; F225-R258 WeakPolarHBondContact CE2-O 3.42Å; T256-R258 PolarHBondContact O-N 3.13Å; T256-R258 PolarHBondContact OG1-N 2.91Å; T256-R258 VanDerWaalsContact OG1-N 3.11Å
259	I	96.9	Very high	96.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.3	-177.3	-59.2	168.1	0	0	0	109	V132 I133 D136 L137 V174 K175 V176 S255 T256	V132-I259 HydrophobicContact CG1-CD1 4.29Å; V132-I259 HydrophobicContact CG1-CG1 4.13Å; I133-I259 HydrophobicContact CB-CD1 4.42Å; I133-I259 HydrophobicContact CG1-CD1 4.01Å; D136-I259 HydrophobicContact CB-CD1 3.67Å; D136-I259 HydrophobicContact CB-CG1 4.45Å; L137-I259 HydrophobicContact CD1-CD1 4.06Å; L137-I259 HydrophobicContact CG-CD1 3.9Å; V174-I259 HydrophobicContact CG1-CG2 3.99Å; K175-I259 CarbonylContact O-C 3.56Å; K175-I259 WeakPolarHBondContact O-CA 3.48Å; V176-I259 HydrophobicContact CG1-CG1 4.46Å; S255-I259 CarbonylContact C-O 3.48Å; S255-I259 VanDerWaalsContact CA-O 3.23Å; S255-I259 WeakPolarHBondContact CA-O 3.4Å; T256-I259 PolarHBondContact N-O 3.24Å; T256-I259 PolarHBondContact OG1-N 3.45Å
260	L	97.8	Very high	95.9	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.6	170.2	-173	60.4	0	0	0	109	K175 F225 E228 I250	K175-L260 HydrophobicContact CB-CB 4.14Å; K175-L260 PolarHBondContact N-O 3.3Å; K175-L260 PolarHBondContact O-N 3.28Å; F225-L260 HydrophobicContact CB-CB 4.01Å; F225-L260 HydrophobicContact CD2-CB 4.07Å; F225-L260 HydrophobicContact CG-CB 4.19Å; E228-L260 HydrophobicContact CB-CD2 4.28Å; E228-L260 HydrophobicContact CG-CD2 3.75Å; I250-L260 HydrophobicContact CD1-CD1 4.2Å; I250-L260 HydrophobicContact CG2-CD1 3.87Å
261	T	98.2	Very high	95.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.3	173.8	-58.7	0	0	0	0	109.2	V172 A173 V174 Y251 L254 S255	V172-T261 HydrophobicContact CB-CG2 3.82Å; V172-T261 HydrophobicContact CG1-CG2 4.17Å; V172-T261 HydrophobicContact CG2-CG2 3.88Å; A173-T261 WeakPolarHBondContact O-CA 3.42Å; V174-T261 HydrophobicContact CG2-CG2 4.3Å; Y251-T261 HydrophobicContact CD2-CG2 4.11Å; Y251-T261 HydrophobicContact CG-CG2 4.3Å; Y251-T261 PolarHBondContact N-O 3.1Å; L254-T261 HydrophobicContact CB-CG2 4.07Å; L254-T261 HydrophobicContact CD1-CG2 4.24Å; L254-T261 WeakPolarHBondContact O-CB 3.48Å; L254-T261 PolarHBondContact O-OG1 3.17Å; S255-T261 PolarHBondContact OG-N 3.16Å
262	M	98	Very high	95	Very high	14 Å²	14	43.7 Å²	43.7	7%	0.069	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	164.3	-177.9	67	-179.2	175.4	0	0	112.6	V172 A173 P248 M249 I250 F264 L329	V172-M262 CarbonylContact C-O 3.51Å; V172-M262 VanDerWaalsContact CA-O 3.29Å; V172-M262 WeakPolarHBondContact CA-O 3.48Å; V172-M262 WeakPolarHBondContact CB-O 3.45Å; A173-M262 HydrophobicContact CB-CE 4.02Å; A173-M262 HydrophobicContact CB-CG 3.91Å; A173-M262 PolarHBondContact N-O 3.5Å; A173-M262 PolarHBondContact O-N 2.91Å; P248-M262 HydrophobicContact CB-CB 3.96Å; P248-M262 HydrophobicContact CB-CG 4.1Å; P248-M262 HydrophobicContact CB-SD 3.9Å; P248-M262 HydrophobicContact CG-SD 3.95Å; M249-M262 CarbonylContact O-C 3.56Å; M249-M262 WeakPolarHBondContact O-CA 3.48Å; M249-M262 WeakPolarHBondContact O-CB 3.39Å; I250-M262 HydrophobicContact CD1-CB 3.89Å; M262-F264 PolarHBondContact O-N 3.48Å; M262-L329 HydrophobicContact CE-CD2 4.48Å
263	E	97.6	Very high	94.7	Very high	38 Å²	38	45 Å²	45	18%	0.178	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	126.9	174.9	-175.9	-175	179.9	0	0	110.5	K246 P248 M249 Y251 L265	K246-E263 WeakPolarHBondContact CE-OE2 3.49Å; K246-E263 VanDerWaalsContact NZ-CD 3.33Å; K246-E263 IonicContact NZ-OE1 2.62Å; K246-E263 PolarHBondContact NZ-OE1 3.23Å; K246-E263 VanDerWaalsContact NZ-OE1 3.15Å; K246-E263 IonicContact NZ-OE2 3.07Å; K246-E263 PolarHBondContact NZ-OE2 3.33Å; P248-E263 HydrophobicContact CB-CB 4.23Å; M249-E263 HydrophobicContact CB-CB 4.31Å; M249-E263 PolarHBondContact N-OE2 3.42Å; M249-E263 PolarHBondContact O-N 3.15Å; Y251-E263 HydrophobicContact CE2-CB 4.38Å; E263-L265 HydrophobicContact CG-CD2 3.9Å; E263-L265 HydrophobicContact CG-CG 4.3Å; E263-L265 PolarHBondContact O-N 2.9Å
264	F	96.3	Very high	94.5	Very high	46 Å²	46	45.1 Å²	45.1	20%	0.202	22%	0.22	C	C	.	.			trans	-75.5	125.2	174.8	-173.6	-101.6	0	0	0	109.9	Q153 K163 T171 A173 M262 E266	Q153-F264 HydrophobicContact CG-CE2 4.38Å; K163-F264 HydrophobicContact CB-CD2 4.36Å; K163-F264 HydrophobicContact CB-CE2 4.15Å; K163-F264 HydrophobicContact CD-CD1 4.27Å; K163-F264 HydrophobicContact CD-CD2 4.33Å; K163-F264 HydrophobicContact CD-CE1 3.83Å; K163-F264 HydrophobicContact CD-CE2 3.94Å; K163-F264 HydrophobicContact CD-CZ 3.68Å; K163-F264 HydrophobicContact CG-CD2 4.2Å; K163-F264 HydrophobicContact CG-CE2 4.18Å; K163-F264 HydrophobicContact CG-CG 4.48Å; K163-F264 HydrophobicContact CG-CZ 4.41Å; T171-F264 HydrophobicContact CG2-CB 3.7Å; T171-F264 HydrophobicContact CG2-CD1 3.81Å; T171-F264 HydrophobicContact CG2-CG 3.86Å; T171-F264 WeakPolarHBondContact O-CB 3.25Å; T171-F264 PolarHBondContact O-N 3.37Å; A173-F264 HydrophobicContact CB-CD2 4.09Å; M262-F264 PolarHBondContact O-N 3.48Å; F264-E266 HydrophobicContact CD1-CG 4.17Å; F264-E266 HydrophobicContact CE1-CG 3.45Å; F264-E266 VanDerWaalsContact CE1-CG 3.45Å; F264-E266 HydrophobicContact CZ-CG 4.22Å
265	L	94.4	Very high	94.3	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.058	22%	0.223	C	C	.	.			trans	-126.3	125.8	178.9	-59.8	174.9	0	0	0	109.8	K246 P248 E263 V327	K246-L265 HydrophobicContact CD-CD1 4.34Å; K246-L265 HydrophobicContact CG-CD1 3.54Å; K246-L265 HydrophobicContact CG-CD2 4.47Å; P248-L265 HydrophobicContact CB-CD1 4.29Å; P248-L265 HydrophobicContact CG-CD1 3.87Å; E263-L265 HydrophobicContact CG-CD2 3.9Å; E263-L265 HydrophobicContact CG-CG 4.3Å; E263-L265 PolarHBondContact O-N 2.9Å; L265-V327 HydrophobicContact CB-CG1 4.11Å; L265-V327 HydrophobicContact CD1-CB 4.44Å; L265-V327 HydrophobicContact CD1-CG1 3.37Å; L265-V327 HydrophobicContact CD1-CG2 4.21Å; L265-V327 HydrophobicContact CG-CG1 4.39Å
266	E	92.1	Very high	94.1	Very high	132 Å²	132	45.6 Å²	45.6	62%	0.617	22%	0.218	S	C	*	.			trans	-86.8	149.7	174.8	-63	179	157.7	0	0	111.2	F264 R316	F264-E266 HydrophobicContact CD1-CG 4.17Å; F264-E266 HydrophobicContact CE1-CG 3.45Å; F264-E266 VanDerWaalsContact CE1-CG 3.45Å; F264-E266 HydrophobicContact CZ-CG 4.22Å; E266-R316 WeakPolarHBondContact O-CD 3.49Å
267	G	93.4	Very high	94	Very high	27 Å²	27	53 Å²	53	28%	0.278	25%	0.249	S	C	.	.			trans	172.1	168.6	177.6	0	0	0	0	0	111.9	V315	G267-V315 WeakPolarHBondContact CA-O 3.39Å
268	G	93.3	Very high	94	Very high	6 Å²	6	55.2 Å²	55.2	6%	0.062	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	152.8	170	0	0	0	0	0	110.8	Y275 L314 V315	G268-Y275 VanDerWaalsContact N-CE1 3.28Å; G268-L314 CarbonylContact O-C 3.6Å; G268-L314 VanDerWaalsContact O-CA 3.28Å; G268-L314 WeakPolarHBondContact O-CA 3.49Å; G268-V315 PolarHBondContact N-O 3.11Å; G268-V315 PolarHBondContact O-N 3.34Å
269	Q	92.6	Very high	93.9	Very high	94 Å²	94	57.6 Å²	57.6	44%	0.439	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	149.8	174.7	-64.7	-177.1	4.1	0	0	110.7	N271 D272 L314	Q269-N271 WeakPolarHBondContact CB-OD1 3.33Å; Q269-N271 PolarHBondContact O-N 3.01Å; Q269-N271 PolarHBondContact OE1-OD1 3.21Å; Q269-D272 HydrophobicContact CB-CB 4.49Å; Q269-D272 WeakPolarHBondContact O-CB 3.47Å; Q269-D272 PolarHBondContact O-N 2.84Å; Q269-L314 HydrophobicContact CG-CD2 4.25Å
270	V	91.1	Very high	93.8	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.7	-176.1	73.4	0	0	0	0	114.6	M276 I286 L290 P310 V313 V315 I440 L444	V270-M276 VanDerWaalsContact O-CE 3.23Å; V270-M276 WeakPolarHBondContact O-CE 3.47Å; V270-I286 HydrophobicContact CG2-CG2 3.84Å; V270-L290 HydrophobicContact CG2-CD1 3.84Å; V270-P310 HydrophobicContact CG1-CB 3.87Å; V270-V313 HydrophobicContact CB-CB 3.95Å; V270-V313 HydrophobicContact CB-CG1 3.84Å; V270-V313 WeakPolarHBondContact CB-O 3.45Å; V270-V313 HydrophobicContact CG1-CB 3.89Å; V270-V313 HydrophobicContact CG1-CG1 4.24Å; V270-V313 HydrophobicContact CG2-CG1 3.99Å; V270-V313 PolarHBondContact N-O 3.06Å; V270-V315 HydrophobicContact CB-CG2 4.05Å; V270-V315 HydrophobicContact CG2-CG2 3.88Å; V270-I440 HydrophobicContact CG1-CD1 3.88Å; V270-I440 HydrophobicContact CG1-CG1 4.03Å; V270-I440 HydrophobicContact CG1-CG2 4.19Å; V270-I440 HydrophobicContact CG2-CG2 3.92Å; V270-L444 WeakPolarHBondContact O-CD2 3.38Å
271	N	87.1	Confident	93.6	Very high	55 Å²	55	67.9 Å²	67.9	29%	0.294	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-2.9	174.7	61.3	-16.3	0	0	0	113.2	Q269 R273 P310 T443	Q269-N271 WeakPolarHBondContact CB-OD1 3.33Å; Q269-N271 PolarHBondContact O-N 3.01Å; Q269-N271 PolarHBondContact OE1-OD1 3.21Å; N271-R273 PolarHBondContact O-N 3.29Å; N271-P310 HydrophobicContact CB-CB 4.12Å; N271-T443 HydrophobicContact CB-CG2 3.87Å
272	D	90.9	Very high	93.3	Very high	62 Å²	62	71.9 Å²	71.9	33%	0.332	33%	0.332	S	S	.	.			trans	-84.7	91.7	179.9	-172.2	-15.6	0	0	0	111.4	Q269 E274 Y275 M276	Q269-D272 HydrophobicContact CB-CB 4.49Å; Q269-D272 WeakPolarHBondContact O-CB 3.47Å; Q269-D272 PolarHBondContact O-N 2.84Å; D272-E274 VanDerWaalsContact C-N 3.32Å; D272-E274 PolarHBondContact OD1-N 3.36Å; D272-E274 VanDerWaalsContact OD1-N 3.08Å; D272-Y275 PolarHBondContact OD1-N 3.23Å; D272-Y275 WeakPolarHBondContact OD2-CB 3.5Å; D272-M276 WeakPolarHBondContact O-CE 3.39Å; D272-M276 PolarHBondContact O-N 3.32Å
273	R	90.4	Very high	93	Very high	102 Å²	102	72.6 Å²	72.6	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-30.7	179	-63.9	-178.8	77	-178.9	4.9	113	N271 M276 K277 T443 L444	N271-R273 PolarHBondContact O-N 3.29Å; R273-M276 PolarHBondContact O-N 3.36Å; R273-K277 WeakPolarHBondContact O-CB 3.27Å; R273-K277 PolarHBondContact O-N 2.7Å; R273-T443 WeakPolarHBondContact CD-O 3.33Å; R273-L444 HydrophobicContact CG-CD2 4.12Å
274	E	92.3	Very high	92.6	Very high	165 Å²	165	74.5 Å²	74.5	77%	0.771	35%	0.349	S	S	*	.	H	α-helix	trans	-69.3	-43.8	-179.1	-64.5	-169.1	156.2	0	0	110.1	D272 M276 K277 K278	D272-E274 VanDerWaalsContact C-N 3.32Å; D272-E274 PolarHBondContact OD1-N 3.36Å; D272-E274 VanDerWaalsContact OD1-N 3.08Å; E274-M276 PolarHBondContact O-N 2.97Å; E274-K277 PolarHBondContact O-N 2.92Å; E274-K278 WeakPolarHBondContact O-CB 3.27Å; E274-K278 PolarHBondContact O-N 3.5Å
275	Y	94.2	Very high	92.2	Very high	49 Å²	49	75.6 Å²	75.6	19%	0.192	36%	0.355	C	S	.	.	H	α-helix	trans	-55.8	-50.4	170.5	-178.5	-86.8	0	0	0	111.3	G268 D272 K277 K278 H279 I281 V315	G268-Y275 VanDerWaalsContact N-CE1 3.28Å; D272-Y275 PolarHBondContact OD1-N 3.23Å; D272-Y275 WeakPolarHBondContact OD2-CB 3.5Å; Y275-K277 VanDerWaalsContact C-N 3.28Å; Y275-K277 PolarHBondContact O-N 3.39Å; Y275-K278 PolarHBondContact O-N 3.05Å; Y275-H279 AromaticContact CD1-CD2 3.99Å; Y275-H279 AromaticContact CD2-CD2 3.57Å; Y275-H279 AromaticContact CD2-NE2 3.76Å; Y275-H279 HydrophobicContact CE1-CB 4.3Å; Y275-H279 AromaticContact CE1-CD2 3.81Å; Y275-H279 AromaticContact CE2-CD2 3.38Å; Y275-H279 WeakPolarHBondContact CE2-CD2 3.28Å; Y275-H279 AromaticContact CE2-NE2 3.32Å; Y275-H279 VanDerWaalsContact CE2-NE2 3.32Å; Y275-H279 WeakPolarHBondContact CE2-NE2 3.02Å; Y275-H279 AromaticContact CG-CD2 3.86Å; Y275-H279 AromaticContact CZ-CD2 3.5Å; Y275-H279 AromaticContact CZ-CG 3.9Å; Y275-H279 AromaticContact CZ-NE2 3.73Å; Y275-H279 WeakPolarHBondContact O-CB 3.43Å; Y275-H279 PolarHBondContact O-CD2 2.84Å; Y275-H279 VanDerWaalsContact O-CD2 3.24Å; Y275-H279 PolarHBondContact O-N 3.28Å; Y275-I281 HydrophobicContact CE1-CD1 4.04Å; Y275-V315 VanDerWaalsContact CE1-O 3.25Å; Y275-V315 WeakPolarHBondContact CE1-O 3.49Å
276	M	93.9	Very high	92.1	Very high	1 Å²	1	75.1 Å²	75.1	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-39.1	-179.9	-76	-178.1	-100.9	0	0	112.6	V270 D272 R273 E274 H279 Y280 I281 V283 I286 L444	V270-M276 VanDerWaalsContact O-CE 3.23Å; V270-M276 WeakPolarHBondContact O-CE 3.47Å; D272-M276 WeakPolarHBondContact O-CE 3.39Å; D272-M276 PolarHBondContact O-N 3.32Å; R273-M276 PolarHBondContact O-N 3.36Å; E274-M276 PolarHBondContact O-N 2.97Å; M276-H279 PolarHBondContact O-N 3.01Å; M276-Y280 PolarHBondContact O-N 2.84Å; M276-Y280 VanDerWaalsContact O-N 3.12Å; M276-I281 HydrophobicContact CB-CB 4.08Å; M276-I281 HydrophobicContact CB-CG2 4.46Å; M276-I281 HydrophobicContact CG-CB 4.04Å; M276-I281 HydrophobicContact CG-CG2 4Å; M276-I281 PolarHBondContact O-N 3.33Å; M276-I281 HydrophobicContact SD-CG2 4.35Å; M276-V283 HydrophobicContact CB-CG1 4.29Å; M276-V283 HydrophobicContact SD-CG1 3.74Å; M276-I286 HydrophobicContact SD-CG1 4.31Å; M276-L444 HydrophobicContact CE-CD2 3.31Å; M276-L444 HydrophobicContact SD-CD2 4.02Å
277	K	93.4	Very high	92	Very high	178 Å²	178	69 Å²	69	77%	0.774	32%	0.324	S	S	*	.	H	α-helix	trans	-66.5	-45	176.9	-151.7	177.4	-173.1	-176.6	0	111.5	R273 E274 Y275 H279 Y280	R273-K277 WeakPolarHBondContact O-CB 3.27Å; R273-K277 PolarHBondContact O-N 2.7Å; E274-K277 PolarHBondContact O-N 2.92Å; Y275-K277 VanDerWaalsContact C-N 3.28Å; Y275-K277 PolarHBondContact O-N 3.39Å; K277-H279 VanDerWaalsContact C-N 3.29Å; K277-H279 PolarHBondContact O-N 3.06Å; K277-Y280 PolarHBondContact O-N 2.82Å
278	K	94.9	Very high	91.7	Very high	160 Å²	160	70.2 Å²	70.2	70%	0.696	32%	0.323	S	S	*	.	H	α-helix	trans	-62.1	-34.9	177.6	-177.1	-179.7	178.3	-177.5	0	112.7	E274 Y275	E274-K278 WeakPolarHBondContact O-CB 3.27Å; E274-K278 PolarHBondContact O-N 3.5Å; Y275-K278 PolarHBondContact O-N 3.05Å
279	H	93.6	Very high	91.6	Very high	67 Å²	67	70.5 Å²	70.5	31%	0.31	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	11.7	-176.8	-70.8	-87.6	0	0	0	114.1	Y275 M276 K277 I281	Y275-H279 AromaticContact CD1-CD2 3.99Å; Y275-H279 AromaticContact CD2-CD2 3.57Å; Y275-H279 AromaticContact CD2-NE2 3.76Å; Y275-H279 HydrophobicContact CE1-CB 4.3Å; Y275-H279 AromaticContact CE1-CD2 3.81Å; Y275-H279 AromaticContact CE2-CD2 3.38Å; Y275-H279 WeakPolarHBondContact CE2-CD2 3.28Å; Y275-H279 AromaticContact CE2-NE2 3.32Å; Y275-H279 VanDerWaalsContact CE2-NE2 3.32Å; Y275-H279 WeakPolarHBondContact CE2-NE2 3.02Å; Y275-H279 AromaticContact CG-CD2 3.86Å; Y275-H279 AromaticContact CZ-CD2 3.5Å; Y275-H279 AromaticContact CZ-CG 3.9Å; Y275-H279 AromaticContact CZ-NE2 3.73Å; Y275-H279 WeakPolarHBondContact O-CB 3.43Å; Y275-H279 PolarHBondContact O-CD2 2.84Å; Y275-H279 VanDerWaalsContact O-CD2 3.24Å; Y275-H279 PolarHBondContact O-N 3.28Å; M276-H279 PolarHBondContact O-N 3.01Å; K277-H279 VanDerWaalsContact C-N 3.29Å; K277-H279 PolarHBondContact O-N 3.06Å; H279-I281 VanDerWaalsContact C-N 3.29Å; H279-I281 HydrophobicContact CB-CD1 3.96Å; H279-I281 HydrophobicContact CB-CG1 4.1Å; H279-I281 PolarHBondContact O-N 3.04Å
280	Y	93.8	Very high	91.6	Very high	207 Å²	207	66.3 Å²	66.3	81%	0.812	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	43.8	179.4	-52.4	-84.5	0	0	0	113.2	M276 K277 K317	M276-Y280 PolarHBondContact O-N 2.84Å; M276-Y280 VanDerWaalsContact O-N 3.12Å; K277-Y280 PolarHBondContact O-N 2.82Å; Y280-K317 WeakPolarHBondContact O-CE 3.37Å; Y280-K317 PolarHBondContact O-NZ 3.13Å
281	I	94.9	Very high	91.5	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.056	31%	0.307	C	S	.	.			trans	-99.5	128.7	178.4	-62.3	175.9	0	0	0	109.1	Y275 M276 H279 V283 I286 V315 K317 T324	Y275-I281 HydrophobicContact CE1-CD1 4.04Å; M276-I281 HydrophobicContact CB-CB 4.08Å; M276-I281 HydrophobicContact CB-CG2 4.46Å; M276-I281 HydrophobicContact CG-CB 4.04Å; M276-I281 HydrophobicContact CG-CG2 4Å; M276-I281 PolarHBondContact O-N 3.33Å; M276-I281 HydrophobicContact SD-CG2 4.35Å; H279-I281 VanDerWaalsContact C-N 3.29Å; H279-I281 HydrophobicContact CB-CD1 3.96Å; H279-I281 HydrophobicContact CB-CG1 4.1Å; H279-I281 PolarHBondContact O-N 3.04Å; I281-V283 PolarHBondContact O-N 3.3Å; I281-I286 HydrophobicContact CG2-CD1 4.01Å; I281-I286 HydrophobicContact CG2-CG1 3.87Å; I281-V315 HydrophobicContact CD1-CG1 3.96Å; I281-V315 HydrophobicContact CG2-CG1 3.81Å; I281-K317 HydrophobicContact CD1-CG 4.31Å; I281-K317 HydrophobicContact CG1-CD 4.16Å; I281-K317 HydrophobicContact CG1-CG 4.1Å; I281-T324 HydrophobicContact CG2-CG2 3.7Å
282	N	91.8	Very high	91.7	Very high	84 Å²	84	66.6 Å²	66.6	45%	0.449	30%	0.304	S	S	.	.			trans	-82.7	112.7	-179.6	-175.1	-13.3	0	0	0	110.8	N284 E285 I286	N282-N284 PolarHBondContact O-N 2.98Å; N282-N284 WeakPolarHBondContact OD1-CB 3.34Å; N282-N284 PolarHBondContact OD1-N 3.04Å; N282-N284 PolarHBondContact OD1-ND2 2.97Å; N282-E285 HydrophobicContact CB-CB 3.99Å; N282-E285 WeakPolarHBondContact O-CB 3.2Å; N282-E285 PolarHBondContact O-N 2.91Å; N282-E285 VanDerWaalsContact O-N 3.07Å; N282-I286 PolarHBondContact O-N 2.78Å
283	V	91.3	Very high	91.8	Very high	29 Å²	29	63.7 Å²	63.7	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-30.1	179.5	-59.6	0	0	0	0	113.6	M276 I281 I286 S287 L444 T446	M276-V283 HydrophobicContact CB-CG1 4.29Å; M276-V283 HydrophobicContact SD-CG1 3.74Å; I281-V283 PolarHBondContact O-N 3.3Å; V283-I286 PolarHBondContact O-N 2.78Å; V283-S287 PolarHBondContact O-N 3.14Å; V283-S287 PolarHBondContact O-OG 3.06Å; V283-L444 HydrophobicContact CB-CB 4.35Å; V283-L444 HydrophobicContact CB-CD2 4.12Å; V283-L444 HydrophobicContact CG1-CD2 3.93Å; V283-T446 HydrophobicContact CB-CG2 4.27Å; V283-T446 HydrophobicContact CG2-CG2 3.9Å
284	N	88.2	Confident	91.9	Very high	79 Å²	79	59 Å²	59	42%	0.422	27%	0.27	S	S	.	.	H	α-helix	trans	-71.2	-39	177.3	-63.6	-69.2	0	0	0	111.2	N282 I286 S287 E288 T446	N282-N284 PolarHBondContact O-N 2.98Å; N282-N284 WeakPolarHBondContact OD1-CB 3.34Å; N282-N284 PolarHBondContact OD1-N 3.04Å; N282-N284 PolarHBondContact OD1-ND2 2.97Å; N284-I286 VanDerWaalsContact C-N 3.32Å; N284-I286 PolarHBondContact O-N 2.99Å; N284-S287 PolarHBondContact O-N 3Å; N284-E288 WeakPolarHBondContact O-CB 3.18Å; N284-E288 PolarHBondContact O-N 2.93Å; N284-T446 WeakPolarHBondContact OD1-CG2 3.5Å
285	E	89.8	Confident	91.9	Very high	69 Å²	69	51.4 Å²	51.4	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-43.1	174.8	-178	-173.1	-166.9	0	0	110.3	N282 E288 N289 T324	N282-E285 HydrophobicContact CB-CB 3.99Å; N282-E285 WeakPolarHBondContact O-CB 3.2Å; N282-E285 PolarHBondContact O-N 2.91Å; N282-E285 VanDerWaalsContact O-N 3.07Å; E285-E288 PolarHBondContact O-N 2.71Å; E285-N289 VanDerWaalsContact O-CB 3.25Å; E285-N289 WeakPolarHBondContact O-CB 3.2Å; E285-N289 VanDerWaalsContact O-CG 3.22Å; E285-N289 PolarHBondContact O-N 3.05Å; E285-N289 PolarHBondContact O-ND2 2.98Å; E285-T324 PolarHBondContact OE2-OG1 2.91Å
286	I	91.7	Very high	91.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-50.4	176.3	-61.2	-55	0	0	0	111.5	V270 M276 I281 N282 V283 N284 E288 N289 L290 V315 T324 I326 L444	V270-I286 HydrophobicContact CG2-CG2 3.84Å; M276-I286 HydrophobicContact SD-CG1 4.31Å; I281-I286 HydrophobicContact CG2-CD1 4.01Å; I281-I286 HydrophobicContact CG2-CG1 3.87Å; N282-I286 PolarHBondContact O-N 2.78Å; V283-I286 PolarHBondContact O-N 2.78Å; N284-I286 VanDerWaalsContact C-N 3.32Å; N284-I286 PolarHBondContact O-N 2.99Å; I286-E288 VanDerWaalsContact C-N 3.32Å; I286-E288 PolarHBondContact O-N 2.8Å; I286-N289 PolarHBondContact O-N 2.9Å; I286-L290 HydrophobicContact CG2-CD1 3.99Å; I286-L290 HydrophobicContact CG2-CG 4.36Å; I286-L290 WeakPolarHBondContact O-CB 3.34Å; I286-L290 WeakPolarHBondContact O-CG 3.25Å; I286-L290 PolarHBondContact O-N 3.16Å; I286-V315 HydrophobicContact CD1-CB 4.47Å; I286-V315 HydrophobicContact CD1-CG1 3.34Å; I286-V315 HydrophobicContact CD1-CG2 4.26Å; I286-V315 HydrophobicContact CG1-CG1 3.93Å; I286-V315 HydrophobicContact CG2-CG2 4.16Å; I286-T324 HydrophobicContact CD1-CG2 3.32Å; I286-T324 HydrophobicContact CG1-CG2 4.42Å; I286-I326 HydrophobicContact CD1-CD1 4.45Å; I286-I326 HydrophobicContact CD1-CG1 3.99Å; I286-I326 HydrophobicContact CG2-CD1 4.41Å; I286-L444 HydrophobicContact CG2-CD1 4.34Å
287	S	88.9	Confident	91.9	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.028	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-42.8	-178.9	-57.1	0	0	0	0	111.3	V283 N284 G291 L444 T446	V283-S287 PolarHBondContact O-N 3.14Å; V283-S287 PolarHBondContact O-OG 3.06Å; N284-S287 PolarHBondContact O-N 3Å; S287-G291 PolarHBondContact O-N 3.11Å; S287-L444 WeakPolarHBondContact OG-CD1 3.23Å; S287-T446 WeakPolarHBondContact CB-OG1 3.15Å; S287-T446 WeakPolarHBondContact OG-CB 3.17Å; S287-T446 WeakPolarHBondContact OG-CG2 3.32Å; S287-T446 PolarHBondContact OG-OG1 3.46Å
288	E	87.5	Confident	91.8	Very high	53 Å²	53	41.5 Å²	41.5	25%	0.248	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-45.3	176.5	-174.1	-175.5	164.6	0	0	112	N284 E285 I286 G291 K292	N284-E288 WeakPolarHBondContact O-CB 3.18Å; N284-E288 PolarHBondContact O-N 2.93Å; E285-E288 PolarHBondContact O-N 2.71Å; I286-E288 VanDerWaalsContact C-N 3.32Å; I286-E288 PolarHBondContact O-N 2.8Å; E288-G291 PolarHBondContact O-N 3.48Å; E288-K292 HydrophobicContact CG-CD 4.5Å; E288-K292 WeakPolarHBondContact O-CG 3.41Å; E288-K292 PolarHBondContact O-N 3.32Å; E288-K292 WeakPolarHBondContact OE1-CE 3.34Å; E288-K292 IonicContact OE1-NZ 3.66Å; E288-K292 PolarHBondContact OE1-NZ 3.38Å
289	N	91.9	Very high	91.8	Very high	12 Å²	12	33.9 Å²	33.9	6%	0.064	16%	0.161	C	C	.	.	H	α-helix	trans	-68.5	-37.4	-179.3	-76.1	-17.4	0	0	0	112.4	F244 E285 I286 K292 M293 I326	F244-N289 HydrophobicContact CD1-CB 4.17Å; F244-N289 HydrophobicContact CD2-CB 3.65Å; F244-N289 HydrophobicContact CE1-CB 4.14Å; F244-N289 HydrophobicContact CE2-CB 3.63Å; F244-N289 WeakPolarHBondContact CE2-O 3.42Å; F244-N289 HydrophobicContact CG-CB 3.93Å; F244-N289 HydrophobicContact CZ-CB 3.88Å; F244-N289 WeakPolarHBondContact CZ-O 3.37Å; E285-N289 VanDerWaalsContact O-CB 3.25Å; E285-N289 WeakPolarHBondContact O-CB 3.2Å; E285-N289 VanDerWaalsContact O-CG 3.22Å; E285-N289 PolarHBondContact O-N 3.05Å; E285-N289 PolarHBondContact O-ND2 2.98Å; I286-N289 PolarHBondContact O-N 2.9Å; N289-K292 PolarHBondContact O-N 2.82Å; N289-M293 WeakPolarHBondContact O-CB 3.36Å; N289-M293 PolarHBondContact O-N 2.58Å; N289-I326 HydrophobicContact CB-CD1 3.63Å
290	L	91.6	Very high	91.6	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.031	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-48.6	169.2	-74.8	172.5	0	0	0	111	V270 I286 K292 M293 Y294 V313 I326 I440	V270-L290 HydrophobicContact CG2-CD1 3.84Å; I286-L290 HydrophobicContact CG2-CD1 3.99Å; I286-L290 HydrophobicContact CG2-CG 4.36Å; I286-L290 WeakPolarHBondContact O-CB 3.34Å; I286-L290 WeakPolarHBondContact O-CG 3.25Å; I286-L290 PolarHBondContact O-N 3.16Å; L290-K292 VanDerWaalsContact C-N 3.32Å; L290-K292 PolarHBondContact O-N 2.97Å; L290-M293 HydrophobicContact CD2-CE 4.02Å; L290-M293 PolarHBondContact O-N 3.48Å; L290-Y294 WeakPolarHBondContact O-CD2 3.23Å; L290-Y294 PolarHBondContact O-N 2.62Å; L290-V313 HydrophobicContact CD2-CG1 4.26Å; L290-I326 HydrophobicContact CD2-CD1 4.09Å; L290-I326 HydrophobicContact CD2-CG2 4.09Å; L290-I326 HydrophobicContact CG-CD1 3.96Å; L290-I440 HydrophobicContact CD1-CG2 3.88Å
291	G	89.2	Confident	91.6	Very high	7 Å²	7	24.7 Å²	24.7	7%	0.072	13%	0.127	C	C	.	.	H	α-helix	trans	-57.4	-43.5	176.8	0	0	0	0	0	112.5	S287 E288 S295	S287-G291 PolarHBondContact O-N 3.11Å; E288-G291 PolarHBondContact O-N 3.48Å; G291-S295 WeakPolarHBondContact O-CB 3.29Å; G291-S295 PolarHBondContact O-N 2.87Å; G291-S295 PolarHBondContact O-OG 3.24Å
292	K	90.8	Very high	91.6	Very high	54 Å²	54	24.3 Å²	24.3	24%	0.235	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-51.4	174.3	-73.7	172	-175.2	161.4	0	111.8	F244 E288 N289 L290 Y294 S295 E296 N455	F244-K292 HydrophobicContact CZ-CB 4.31Å; E288-K292 HydrophobicContact CG-CD 4.5Å; E288-K292 WeakPolarHBondContact O-CG 3.41Å; E288-K292 PolarHBondContact O-N 3.32Å; E288-K292 WeakPolarHBondContact OE1-CE 3.34Å; E288-K292 IonicContact OE1-NZ 3.66Å; E288-K292 PolarHBondContact OE1-NZ 3.38Å; N289-K292 PolarHBondContact O-N 2.82Å; L290-K292 VanDerWaalsContact C-N 3.32Å; L290-K292 PolarHBondContact O-N 2.97Å; K292-Y294 PolarHBondContact O-N 2.87Å; K292-S295 PolarHBondContact O-N 3.08Å; K292-E296 WeakPolarHBondContact O-CB 3.2Å; K292-E296 PolarHBondContact O-N 2.87Å; K292-N455 HydrophobicContact CG-CB 4.12Å; K292-N455 WeakPolarHBondContact CG-ND2 3.35Å
293	M	93.3	Very high	91.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-50.3	-177.8	-172.7	-175	65.9	0	0	111.7	L239 F244 L245 N289 L290 E296 M297 L328	L239-M293 HydrophobicContact CD1-CG 3.71Å; F244-M293 HydrophobicContact CE2-CB 4.32Å; L245-M293 HydrophobicContact CD1-SD 3.53Å; L245-M293 VanDerWaalsContact CD1-SD 3.53Å; L245-M293 HydrophobicContact CD2-CG 4.27Å; L245-M293 HydrophobicContact CD2-SD 3.89Å; L245-M293 HydrophobicContact CG-SD 4.24Å; N289-M293 WeakPolarHBondContact O-CB 3.36Å; N289-M293 PolarHBondContact O-N 2.58Å; L290-M293 HydrophobicContact CD2-CE 4.02Å; L290-M293 PolarHBondContact O-N 3.48Å; M293-E296 PolarHBondContact O-N 3.48Å; M293-M297 HydrophobicContact CE-CE 4.19Å; M293-M297 HydrophobicContact CG-CE 4.08Å; M293-M297 WeakPolarHBondContact O-CG 3.38Å; M293-M297 PolarHBondContact O-N 3.23Å; M293-M297 VanDerWaalsContact O-N 3.09Å; M293-L328 HydrophobicContact CE-CD2 4.4Å; M293-L328 HydrophobicContact SD-CD2 4.45Å
294	Y	92.7	Very high	91.9	Very high	3 Å²	3	19.5 Å²	19.5	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-70.4	-36.9	179.8	-85.1	-87.4	0	0	0	112.9	L290 K292 E296 M297 I298 H305 P308 T433 L437	L290-Y294 WeakPolarHBondContact O-CD2 3.23Å; L290-Y294 PolarHBondContact O-N 2.62Å; K292-Y294 PolarHBondContact O-N 2.87Å; Y294-E296 VanDerWaalsContact C-N 3.32Å; Y294-E296 PolarHBondContact O-N 2.95Å; Y294-M297 HydrophobicContact CD1-CE 3.5Å; Y294-M297 VanDerWaalsContact CD1-CE 3.5Å; Y294-M297 HydrophobicContact CD2-CE 3.92Å; Y294-M297 HydrophobicContact CE1-CE 3.48Å; Y294-M297 VanDerWaalsContact CE1-CE 3.48Å; Y294-M297 HydrophobicContact CE2-CE 3.94Å; Y294-M297 HydrophobicContact CG-CE 3.68Å; Y294-M297 PolarHBondContact O-N 2.91Å; Y294-I298 WeakPolarHBondContact O-CB 3.32Å; Y294-I298 WeakPolarHBondContact O-CD1 3.24Å; Y294-I298 VanDerWaalsContact O-CG1 3.22Å; Y294-I298 WeakPolarHBondContact O-CG1 3.38Å; Y294-I298 PolarHBondContact O-N 3.16Å; Y294-H305 HydrophobicContact CE1-CB 3.94Å; Y294-H305 WeakPolarHBondContact CE1-O 3.25Å; Y294-P308 HydrophobicContact CE1-CB 4.19Å; Y294-P308 HydrophobicContact CE1-CG 4.08Å; Y294-P308 HydrophobicContact CE2-CB 4.17Å; Y294-P308 WeakPolarHBondContact OH-CB 2.97Å; Y294-T433 HydrophobicContact CD1-CG2 3.63Å; Y294-T433 HydrophobicContact CE1-CG2 3.71Å; Y294-L437 HydrophobicContact CD1-CD1 3.91Å; Y294-L437 HydrophobicContact CD2-CD1 4.02Å; Y294-L437 HydrophobicContact CD2-CD2 3.59Å; Y294-L437 HydrophobicContact CD2-CG 4.39Å; Y294-L437 HydrophobicContact CE2-CD2 3.79Å; Y294-L437 HydrophobicContact CG-CD1 3.58Å; Y294-L437 HydrophobicContact CG-CD2 4.05Å; Y294-L437 HydrophobicContact CG-CG 4.37Å
295	S	91.8	Very high	92.1	Very high	7 Å²	7	15.8 Å²	15.8	5%	0.049	8%	0.078	C	C	.	.	H	α-helix	trans	-61.4	-41	173.8	-64.6	0	0	0	0	112	G291 K292 I298 F299 M456 C459	G291-S295 WeakPolarHBondContact O-CB 3.29Å; G291-S295 PolarHBondContact O-N 2.87Å; G291-S295 PolarHBondContact O-OG 3.24Å; K292-S295 PolarHBondContact O-N 3.08Å; S295-I298 PolarHBondContact O-N 3.41Å; S295-F299 WeakPolarHBondContact O-CB 3.41Å; S295-F299 VanDerWaalsContact O-CD2 3.27Å; S295-F299 WeakPolarHBondContact O-CD2 3.27Å; S295-F299 PolarHBondContact O-N 3.01Å; S295-M456 VanDerWaalsContact OG-CG 3.29Å; S295-M456 WeakPolarHBondContact OG-CG 3.49Å; S295-C459 VanDerWaalsContact CB-SG 3.52Å
296	E	93.2	Very high	91.9	Very high	15 Å²	15	12.5 Å²	12.5	7%	0.07	6%	0.063	C	C	.	.	I	π-helix	trans	-65.1	-45.8	177	-165	72.9	-162	0	0	110.7	L239 F242 K292 M293 Y294 I298 V300 H301	L239-E296 HydrophobicContact CD2-CB 4.22Å; L239-E296 HydrophobicContact CD2-CG 3.85Å; F242-E296 HydrophobicContact CE2-CB 3.8Å; F242-E296 HydrophobicContact CE2-CG 3.96Å; F242-E296 HydrophobicContact CZ-CB 3.96Å; F242-E296 HydrophobicContact CZ-CG 4.01Å; K292-E296 WeakPolarHBondContact O-CB 3.2Å; K292-E296 PolarHBondContact O-N 2.87Å; M293-E296 PolarHBondContact O-N 3.48Å; Y294-E296 VanDerWaalsContact C-N 3.32Å; Y294-E296 PolarHBondContact O-N 2.95Å; E296-I298 PolarHBondContact O-N 3.25Å; E296-V300 HydrophobicContact CG-CB 4.27Å; E296-V300 WeakPolarHBondContact O-CA 3.5Å; E296-V300 WeakPolarHBondContact O-CB 3.43Å; E296-V300 PolarHBondContact O-N 3.48Å; E296-V300 WeakPolarHBondContact OE1-CB 3.47Å; E296-V300 VanDerWaalsContact OE1-CG1 3.29Å; E296-V300 WeakPolarHBondContact OE1-CG1 3.21Å; E296-H301 PolarHBondContact O-CD2 3.31Å; E296-H301 PolarHBondContact O-N 3.01Å; E296-H301 IonicContact OE1-NE2 2.73Å
297	M	94.9	Very high	91.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.067	C	C	.	.	I	π-helix	trans	-57.6	-46.9	175.5	-75.4	-167.5	-71.7	0	0	112.5	M238 L239 M293 Y294 G302 F303 H305 Y334	M238-M297 HydrophobicContact CE-CG 3.82Å; L239-M297 HydrophobicContact CD1-CG 3.91Å; L239-M297 HydrophobicContact CD1-SD 4.24Å; M293-M297 HydrophobicContact CE-CE 4.19Å; M293-M297 HydrophobicContact CG-CE 4.08Å; M293-M297 WeakPolarHBondContact O-CG 3.38Å; M293-M297 PolarHBondContact O-N 3.23Å; M293-M297 VanDerWaalsContact O-N 3.09Å; Y294-M297 HydrophobicContact CD1-CE 3.5Å; Y294-M297 VanDerWaalsContact CD1-CE 3.5Å; Y294-M297 HydrophobicContact CD2-CE 3.92Å; Y294-M297 HydrophobicContact CE1-CE 3.48Å; Y294-M297 VanDerWaalsContact CE1-CE 3.48Å; Y294-M297 HydrophobicContact CE2-CE 3.94Å; Y294-M297 HydrophobicContact CG-CE 3.68Å; Y294-M297 PolarHBondContact O-N 2.91Å; M297-G302 WeakPolarHBondContact O-CA 3.48Å; M297-G302 PolarHBondContact O-N 2.89Å; M297-F303 WeakPolarHBondContact CB-O 3.32Å; M297-F303 PolarHBondContact O-N 3.24Å; M297-F303 VanDerWaalsContact O-N 3.16Å; M297-H305 HydrophobicContact CE-CB 4.14Å; M297-H305 HydrophobicContact SD-CB 4.09Å; M297-Y334 HydrophobicContact SD-CE1 4.46Å
298	I	93.1	Very high	91	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.021	7%	0.065	C	C	.	.	I	π-helix	trans	-74.3	-58	-176.2	-65.5	166	0	0	0	111.5	Y294 S295 E296 V304 L337 R342 Y345 L430	Y294-I298 WeakPolarHBondContact O-CB 3.32Å; Y294-I298 WeakPolarHBondContact O-CD1 3.24Å; Y294-I298 VanDerWaalsContact O-CG1 3.22Å; Y294-I298 WeakPolarHBondContact O-CG1 3.38Å; Y294-I298 PolarHBondContact O-N 3.16Å; S295-I298 PolarHBondContact O-N 3.41Å; E296-I298 PolarHBondContact O-N 3.25Å; I298-V304 HydrophobicContact CB-CG2 4.31Å; I298-V304 HydrophobicContact CD1-CG1 4.42Å; I298-V304 HydrophobicContact CG1-CB 4.43Å; I298-V304 HydrophobicContact CG1-CG1 3.68Å; I298-V304 HydrophobicContact CG1-CG2 3.83Å; I298-L337 HydrophobicContact CG2-CD1 4.28Å; I298-R342 WeakPolarHBondContact O-CD 3.47Å; I298-Y345 HydrophobicContact CG2-CD1 3.97Å; I298-Y345 HydrophobicContact CG2-CE1 3.65Å; I298-L430 HydrophobicContact CD1-CD2 4.15Å; I298-L430 HydrophobicContact CG1-CD2 3.9Å; I298-L430 HydrophobicContact CG2-CD1 4.47Å; I298-L430 HydrophobicContact CG2-CD2 4.08Å
299	F	93.3	Very high	90.7	Very high	1 Å²	1	13.1 Å²	13.1	0%	0.004	7%	0.065	C	C	.	.	I	π-helix	trans	-87.6	-38.8	-167.4	-59.5	-68.6	0	0	0	112.3	S295 R342 Y345 C346 W349 M456 C459 C460 A463	S295-F299 WeakPolarHBondContact O-CB 3.41Å; S295-F299 VanDerWaalsContact O-CD2 3.27Å; S295-F299 WeakPolarHBondContact O-CD2 3.27Å; S295-F299 PolarHBondContact O-N 3.01Å; F299-R342 PolarHBondContact O-NH1 3.22Å; F299-Y345 HydrophobicContact CD1-CD1 4.03Å; F299-Y345 HydrophobicContact CD1-CE1 4.34Å; F299-Y345 AromaticContact CE1-CD1 3.38Å; F299-Y345 HydrophobicContact CE1-CD1 3.38Å; F299-Y345 AromaticContact CE1-CE1 3.42Å; F299-Y345 HydrophobicContact CE1-CE1 3.42Å; F299-Y345 VanDerWaalsContact CE1-CE1 3.42Å; F299-Y345 HydrophobicContact CE1-CG 4.49Å; F299-Y345 HydrophobicContact CZ-CD1 4.16Å; F299-Y345 AromaticContact CZ-CE1 3.71Å; F299-Y345 HydrophobicContact CZ-CE1 3.71Å; F299-C346 HydrophobicContact CD1-CB 4.43Å; F299-C346 VanDerWaalsContact CD1-SG 3.57Å; F299-W349 HydrophobicContact CE1-CB 4.38Å; F299-W349 AromaticContact CE1-CD1 3.59Å; F299-W349 HydrophobicContact CE1-CG 4.08Å; F299-W349 HydrophobicContact CZ-CB 4.47Å; F299-W349 AromaticContact CZ-CD1 3.62Å; F299-W349 HydrophobicContact CZ-CD2 4.45Å; F299-W349 AromaticContact CZ-CG 3.92Å; F299-W349 HydrophobicContact CZ-CG 3.92Å; F299-W349 AromaticContact CZ-NE1 3.96Å; F299-M456 HydrophobicContact CE2-CB 4.11Å; F299-M456 HydrophobicContact CE2-CE 3.82Å; F299-M456 HydrophobicContact CE2-CG 4.06Å; F299-M456 HydrophobicContact CZ-CE 3.68Å; F299-C459 HydrophobicContact CB-CB 3.89Å; F299-C459 HydrophobicContact CD2-CB 4.02Å; F299-C459 HydrophobicContact CG-CB 4.34Å; F299-C460 VanDerWaalsContact CD1-SG 3.56Å; F299-C460 VanDerWaalsContact CE1-SG 3.59Å; F299-A463 HydrophobicContact CB-CB 4.47Å; F299-A463 WeakPolarHBondContact O-CB 3.41Å
300	V	91.3	Very high	90.2	Very high	16 Å²	16	13.5 Å²	13.5	10%	0.097	7%	0.069	C	C	.	.	I	π-helix	trans	-91.2	-41	-172.1	-175.8	0	0	0	0	112.9	E296 R342 C459	E296-V300 HydrophobicContact CG-CB 4.27Å; E296-V300 WeakPolarHBondContact O-CA 3.5Å; E296-V300 WeakPolarHBondContact O-CB 3.43Å; E296-V300 PolarHBondContact O-N 3.48Å; E296-V300 WeakPolarHBondContact OE1-CB 3.47Å; E296-V300 VanDerWaalsContact OE1-CG1 3.29Å; E296-V300 WeakPolarHBondContact OE1-CG1 3.21Å; V300-R342 PolarHBondContact O-NH1 3.43Å; V300-C459 HydrophobicContact CG2-CB 4.04Å
301	H	93.1	Very high	89.7	Confident	65 Å²	65	14.4 Å²	14.4	30%	0.301	8%	0.08	S	C	.	.	I	π-helix	trans	-99.5	-37.8	-179.3	-65.1	-73.1	0	0	0	113.6	M238 E296 R342	M238-H301 HydrophobicContact CE-CB 4.4Å; M238-H301 HydrophobicContact CG-CB 4.41Å; M238-H301 VanDerWaalsContact CG-CE1 3.44Å; M238-H301 WeakPolarHBondContact CG-CE1 3.41Å; M238-H301 WeakPolarHBondContact CG-NE2 3.16Å; M238-H301 HydrophobicContact SD-CB 3.48Å; M238-H301 WeakPolarHBondContact SD-CB 3.35Å; E296-H301 PolarHBondContact O-CD2 3.31Å; E296-H301 PolarHBondContact O-N 3.01Å; E296-H301 IonicContact OE1-NE2 2.73Å; H301-R342 VanDerWaalsContact C-NH1 3.29Å
302	G	93.9	Very high	89.7	Confident	2 Å²	2	15.7 Å²	15.7	2%	0.021	9%	0.085	C	C	.	.			trans	69.9	24	-171.2	0	0	0	0	0	112.9	M297 V336 L337	M297-G302 WeakPolarHBondContact O-CA 3.48Å; M297-G302 PolarHBondContact O-N 2.89Å; G302-V336 CarbonylContact O-C 3.45Å; G302-V336 WeakPolarHBondContact O-CA 3.18Å; G302-L337 PolarHBondContact O-N 3.45Å
303	F	95.7	Very high	89.8	Confident	13 Å²	13	13.1 Å²	13.1	6%	0.057	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	102.1	172.5	-177.2	-114.5	0	0	0	107.1	N231 K234 V235 M238 M297 Y334 V336	N231-F303 HydrophobicContact CB-CZ 4.45Å; N231-F303 WeakPolarHBondContact OD1-CZ 3.37Å; K234-F303 HydrophobicContact CD-CD1 4.12Å; K234-F303 HydrophobicContact CD-CE1 3.68Å; K234-F303 HydrophobicContact CD-CE2 4.35Å; K234-F303 HydrophobicContact CD-CZ 3.81Å; K234-F303 HydrophobicContact CG-CD1 4.43Å; K234-F303 HydrophobicContact CG-CE1 4.1Å; K234-F303 VanDerWaalsContact NZ-CE2 3.32Å; V235-F303 HydrophobicContact CG2-CD1 4.1Å; V235-F303 HydrophobicContact CG2-CE1 3.75Å; M238-F303 HydrophobicContact CE-CD1 4.17Å; M238-F303 HydrophobicContact SD-CB 4.27Å; M238-F303 HydrophobicContact SD-CD1 4.34Å; M297-F303 WeakPolarHBondContact CB-O 3.32Å; M297-F303 PolarHBondContact O-N 3.24Å; M297-F303 VanDerWaalsContact O-N 3.16Å; F303-Y334 AromaticContact CD1-CD1 3.7Å; F303-Y334 HydrophobicContact CD1-CD1 3.7Å; F303-Y334 AromaticContact CD1-CE1 3.96Å; F303-Y334 HydrophobicContact CD1-CE1 3.96Å; F303-Y334 HydrophobicContact CD2-CD1 4.22Å; F303-Y334 AromaticContact CE1-CD1 3.27Å; F303-Y334 HydrophobicContact CE1-CD1 3.27Å; F303-Y334 AromaticContact CE1-CE1 3.58Å; F303-Y334 HydrophobicContact CE1-CE1 3.58Å; F303-Y334 AromaticContact CE1-CG 3.84Å; F303-Y334 HydrophobicContact CE1-CG 3.84Å; F303-Y334 AromaticContact CE2-CD1 3.86Å; F303-Y334 HydrophobicContact CE2-CD1 3.86Å; F303-Y334 AromaticContact CE2-CG 3.95Å; F303-Y334 HydrophobicContact CE2-CG 3.95Å; F303-Y334 HydrophobicContact CG-CD1 4.16Å; F303-Y334 AromaticContact CZ-CD1 3.37Å; F303-Y334 HydrophobicContact CZ-CD1 3.37Å; F303-Y334 HydrophobicContact CZ-CD2 4.26Å; F303-Y334 HydrophobicContact CZ-CE1 4.11Å; F303-Y334 AromaticContact CZ-CG 3.46Å; F303-Y334 HydrophobicContact CZ-CG 3.46Å; F303-Y334 VanDerWaalsContact CZ-CG 3.46Å; F303-V336 HydrophobicContact CD2-CG2 3.8Å; F303-V336 HydrophobicContact CE2-CG2 4.24Å
304	V	93.8	Very high	89.8	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.7	-160.7	-172.2	0	0	0	0	110.2	I298 C306 Y334 Q335 L337 L430 T433	I298-V304 HydrophobicContact CB-CG2 4.31Å; I298-V304 HydrophobicContact CD1-CG1 4.42Å; I298-V304 HydrophobicContact CG1-CB 4.43Å; I298-V304 HydrophobicContact CG1-CG1 3.68Å; I298-V304 HydrophobicContact CG1-CG2 3.83Å; V304-C306 PolarHBondContact O-N 3.37Å; V304-C306 PolarHBondContact O-SG 2.89Å; V304-Y334 VanDerWaalsContact C-CD1 3.45Å; V304-Y334 VanDerWaalsContact O-CA 3.29Å; V304-Y334 WeakPolarHBondContact O-CA 3.32Å; V304-Y334 WeakPolarHBondContact O-CD1 3.48Å; V304-Q335 PolarHBondContact N-O 3.26Å; V304-Q335 PolarHBondContact O-N 2.84Å; V304-L337 HydrophobicContact CG2-CD1 3.85Å; V304-L337 HydrophobicContact CG2-CD2 4.46Å; V304-L337 HydrophobicContact CG2-CG 3.9Å; V304-L430 HydrophobicContact CG1-CD2 3.97Å; V304-L430 HydrophobicContact CG2-CD2 4.24Å; V304-T433 HydrophobicContact CG1-CG2 4.42Å
305	H	92.7	Very high	90	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.4	167.3	-174.4	-44.5	0	0	0	108.8	Y294 M297 D307 D330 Y334 T433	Y294-H305 HydrophobicContact CE1-CB 3.94Å; Y294-H305 WeakPolarHBondContact CE1-O 3.25Å; M297-H305 HydrophobicContact CE-CB 4.14Å; M297-H305 HydrophobicContact SD-CB 4.09Å; H305-D307 PolarHBondContact CE1-N 2.67Å; H305-D307 PolarHBondContact CE1-O 2.81Å; H305-D307 PolarHBondContact ND1-N 3.03Å; H305-D330 PolarHBondContact NE2-O 3.13Å; H305-Y334 HydrophobicContact CB-CD1 4.34Å; H305-Y334 HydrophobicContact CB-CE1 3.66Å; H305-Y334 HydrophobicContact CB-CE2 4.45Å; H305-Y334 AromaticContact CD2-CZ 3.75Å; H305-Y334 PolarHBondContact CD2-OH 3.01Å; H305-Y334 AromaticContact CG-CZ 3.99Å; H305-T433 WeakPolarHBondContact O-CG2 3.34Å
306	C	85.3	Confident	90.2	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.007	8%	0.082	C	C	.	.	S	Bend	trans	-104.8	8.2	-172.7	-64	0	0	0	0	114.9	V304 L333 L429 K432	V304-C306 PolarHBondContact O-N 3.37Å; V304-C306 PolarHBondContact O-SG 2.89Å; C306-L333 HydrophobicContact CB-CD2 4.03Å; C306-L333 HydrophobicContact CB-CG 4.06Å; C306-L333 PolarHBondContact N-O 3.49Å; C306-L429 HydrophobicContact CB-CB 4.34Å; C306-L429 HydrophobicContact CB-CD2 4.31Å; C306-K432 PolarHBondContact O-NZ 3.05Å
307	D	81.6	Confident	90.2	Very high	16 Å²	16	17.2 Å²	17.2	9%	0.086	9%	0.09	C	C	.	.			trans	-135.1	57.5	175.3	-150.2	28.7	0	0	0	115.2	K94 H305 H309 L333 K432	K94-D307 IonicContact NZ-OD2 3.35Å; H305-D307 PolarHBondContact CE1-N 2.67Å; H305-D307 PolarHBondContact CE1-O 2.81Å; H305-D307 PolarHBondContact ND1-N 3.03Å; D307-H309 PolarHBondContact O-N 3.45Å; D307-L333 HydrophobicContact CB-CB 4.3Å; D307-L333 HydrophobicContact CB-CD2 4.21Å; D307-K432 IonicContact OD1-NZ 2.89Å; D307-K432 PolarHBondContact OD1-NZ 3.2Å
308	P	81.2	Confident	90	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.			trans	-67.2	46.9	174.4	24.4	-30.6	0	0	0	114	Y294 T433 L436 L437	Y294-P308 HydrophobicContact CE1-CB 4.19Å; Y294-P308 HydrophobicContact CE1-CG 4.08Å; Y294-P308 HydrophobicContact CE2-CB 4.17Å; Y294-P308 WeakPolarHBondContact OH-CB 2.97Å; P308-T433 HydrophobicContact CG-CG2 4.06Å; P308-L436 HydrophobicContact CG-CB 3.76Å; P308-L436 HydrophobicContact CG-CD1 3.99Å; P308-L437 HydrophobicContact CB-CD2 4.34Å; P308-L437 HydrophobicContact CG-CD2 4.48Å; P308-L437 HydrophobicContact CG-CG 4.4Å
309	H	80.8	Confident	89.7	Confident	53 Å²	53	22.5 Å²	22.5	25%	0.245	13%	0.125	C	C	.	.			trans	-59.5	138.1	176.4	-170.6	-94.4	0	0	0	109.5	H118 D307 G311 N312	H118-H309 AromaticContact CG-NE2 3.87Å; H118-H309 AromaticContact ND1-CD2 3.8Å; H118-H309 AromaticContact ND1-NE2 3.68Å; D307-H309 PolarHBondContact O-N 3.45Å; H309-G311 PolarHBondContact ND1-N 3.33Å; H309-G311 PolarHBondContact O-N 3.01Å; H309-N312 WeakPolarHBondContact O-CB 3.45Å; H309-N312 PolarHBondContact O-N 2.69Å
310	P	81	Confident	89.4	Confident	21 Å²	21	34.1 Å²	34.1	14%	0.136	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-54.7	-29.9	-176.4	-29.1	35.2	0	0	0	114.7	V270 N271 N312 V313 I440	V270-P310 HydrophobicContact CG1-CB 3.87Å; N271-P310 HydrophobicContact CB-CB 4.12Å; P310-N312 PolarHBondContact O-N 3.11Å; P310-V313 PolarHBondContact O-N 2.89Å; P310-V313 VanDerWaalsContact O-O 3.11Å; P310-I440 HydrophobicContact CG-CG1 4.06Å
311	G	81.9	Confident	89.3	Confident	25 Å²	25	36.2 Å²	36.2	26%	0.258	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-66.5	-19.7	175	0	0	0	0	0	115	H309	H309-G311 PolarHBondContact ND1-N 3.33Å; H309-G311 PolarHBondContact O-N 3.01Å
312	N	88.3	Confident	89.2	Confident	34 Å²	34	38.9 Å²	38.9	18%	0.182	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-95.8	1.5	-179.6	-68.5	-13.2	0	0	0	112.9	H309 P310 L329 D330	H309-N312 WeakPolarHBondContact O-CB 3.45Å; H309-N312 PolarHBondContact O-N 2.69Å; P310-N312 PolarHBondContact O-N 3.11Å; N312-L329 PolarHBondContact O-N 3.07Å; N312-D330 HydrophobicContact CB-CB 3.72Å; N312-D330 WeakPolarHBondContact ND2-CB 3.32Å; N312-D330 PolarHBondContact ND2-OD2 3.5Å
313	V	92.5	Very high	89.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	111.8	-178	-172.9	0	0	0	0	108.8	V270 L290 P310 I326 V327 L328	V270-V313 HydrophobicContact CB-CB 3.95Å; V270-V313 HydrophobicContact CB-CG1 3.84Å; V270-V313 WeakPolarHBondContact CB-O 3.45Å; V270-V313 HydrophobicContact CG1-CB 3.89Å; V270-V313 HydrophobicContact CG1-CG1 4.24Å; V270-V313 HydrophobicContact CG2-CG1 3.99Å; V270-V313 PolarHBondContact N-O 3.06Å; L290-V313 HydrophobicContact CD2-CG1 4.26Å; P310-V313 PolarHBondContact O-N 2.89Å; P310-V313 VanDerWaalsContact O-O 3.11Å; V313-I326 HydrophobicContact CG1-CG2 3.67Å; V313-V327 WeakPolarHBondContact CA-O 3.4Å; V313-L328 HydrophobicContact CG2-CD1 3.95Å
314	L	94.9	Very high	89.1	Confident	22 Å²	22	45.1 Å²	45.1	12%	0.115	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	157.8	171.4	-51.2	177.3	0	0	0	110.8	G268 Q269 V327 L329	G268-L314 CarbonylContact O-C 3.6Å; G268-L314 VanDerWaalsContact O-CA 3.28Å; G268-L314 WeakPolarHBondContact O-CA 3.49Å; Q269-L314 HydrophobicContact CG-CD2 4.25Å; L314-V327 HydrophobicContact CB-CB 4.06Å; L314-V327 PolarHBondContact N-O 3.5Å; L314-V327 PolarHBondContact O-N 3.25Å; L314-L329 HydrophobicContact CD1-CD1 3.8Å; L314-L329 HydrophobicContact CD1-CD2 4.4Å; L314-L329 HydrophobicContact CD1-CG 4.42Å; L314-L329 HydrophobicContact CD2-CD1 4.35Å; L314-L329 HydrophobicContact CG-CD1 3.72Å; L314-L329 HydrophobicContact CG-CG 4.32Å
315	V	96.6	Very high	89.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135	175.1	-173.5	0	0	0	0	108.1	G267 G268 V270 Y275 I281 I286 T324 E325	G267-V315 WeakPolarHBondContact CA-O 3.39Å; G268-V315 PolarHBondContact N-O 3.11Å; G268-V315 PolarHBondContact O-N 3.34Å; V270-V315 HydrophobicContact CB-CG2 4.05Å; V270-V315 HydrophobicContact CG2-CG2 3.88Å; Y275-V315 VanDerWaalsContact CE1-O 3.25Å; Y275-V315 WeakPolarHBondContact CE1-O 3.49Å; I281-V315 HydrophobicContact CD1-CG1 3.96Å; I281-V315 HydrophobicContact CG2-CG1 3.81Å; I286-V315 HydrophobicContact CD1-CB 4.47Å; I286-V315 HydrophobicContact CD1-CG1 3.34Å; I286-V315 HydrophobicContact CD1-CG2 4.26Å; I286-V315 HydrophobicContact CG1-CG1 3.93Å; I286-V315 HydrophobicContact CG2-CG2 4.16Å; V315-T324 HydrophobicContact CG1-CG2 4.26Å; V315-E325 WeakPolarHBondContact CA-O 3.19Å
316	R	95.1	Very high	89.4	Confident	31 Å²	31	46.4 Å²	46.4	12%	0.117	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	167.2	-179.9	71.6	-177.1	-167.2	173	0.6	112.4	E266 E325 V327	E266-R316 WeakPolarHBondContact O-CD 3.49Å; R316-E325 HydrophobicContact CG-CB 4.04Å; R316-E325 IonicContact CZ-OE2 3.42Å; R316-E325 VanDerWaalsContact CZ-OE2 3.28Å; R316-E325 PolarHBondContact N-O 2.87Å; R316-E325 IonicContact NE-OE2 2.8Å; R316-E325 PolarHBondContact NE-OE2 3.42Å; R316-E325 IonicContact NH2-OE2 2.66Å; R316-E325 PolarHBondContact NH2-OE2 3.13Å; R316-E325 PolarHBondContact O-N 2.86Å; R316-V327 HydrophobicContact CG-CG2 4.26Å
317	K	94	Very high	90	Very high	57 Å²	57	46.3 Å²	46.3	25%	0.248	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.5	160.3	-69.7	-65.1	-166.1	-179.2	0	108.5	Y280 I281 P319 Q322 T324	Y280-K317 WeakPolarHBondContact O-CE 3.37Å; Y280-K317 PolarHBondContact O-NZ 3.13Å; I281-K317 HydrophobicContact CD1-CG 4.31Å; I281-K317 HydrophobicContact CG1-CD 4.16Å; I281-K317 HydrophobicContact CG1-CG 4.1Å; K317-P319 WeakPolarHBondContact O-CD 3.49Å; K317-Q322 WeakPolarHBondContact CD-O 3.32Å; K317-T324 PolarHBondContact NZ-OG1 3.38Å
318	C	91	Very high	90.6	Very high	16 Å²	16	45.6 Å²	45.6	11%	0.108	23%	0.226	C	C	.	.			trans	-55.4	121.1	173.6	-176.7	0	0	0	0	109.2	R320 S321 Q322 K323 E325	C318-R320 PolarHBondContact O-N 3.46Å; C318-R320 VanDerWaalsContact O-N 3.14Å; C318-S321 WeakPolarHBondContact CB-OG 3.22Å; C318-S321 PolarHBondContact O-N 3.09Å; C318-S321 PolarHBondContact SG-OG 3.5Å; C318-S321 VanDerWaalsContact SG-OG 3.33Å; C318-Q322 VanDerWaalsContact O-CA 3.27Å; C318-Q322 WeakPolarHBondContact O-CA 3.18Å; C318-Q322 PolarHBondContact O-N 2.9Å; C318-K323 WeakPolarHBondContact CB-O 3.45Å; C318-K323 PolarHBondContact N-O 3.43Å; C318-E325 HydrophobicContact CB-CG 4.01Å; C318-E325 VanDerWaalsContact CB-OE1 3.27Å; C318-E325 WeakPolarHBondContact CB-OE1 3.44Å; C318-E325 PolarHBondContact SG-OE1 3.49Å
319	P	86.4	Confident	91.2	Very high	100 Å²	100	47.3 Å²	47.3	65%	0.649	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.9	-175.5	-27.9	35.1	0	0	0	113	K317 Q322	K317-P319 WeakPolarHBondContact O-CD 3.49Å; P319-Q322 PolarHBondContact O-NE2 2.91Å
320	R	87.3	Confident	91.6	Very high	244 Å²	244	45.8 Å²	45.8	92%	0.921	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-45.9	-177.5	-172	177.6	-179.3	170.6	1.5	113.5	C318	C318-R320 PolarHBondContact O-N 3.46Å; C318-R320 VanDerWaalsContact O-N 3.14Å
321	S	89.5	Confident	92.2	Very high	60 Å²	60	44.9 Å²	44.9	42%	0.42	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-12.7	-171.8	72.1	0	0	0	0	114.1	C318 K323	C318-S321 WeakPolarHBondContact CB-OG 3.22Å; C318-S321 PolarHBondContact O-N 3.09Å; C318-S321 PolarHBondContact SG-OG 3.5Å; C318-S321 VanDerWaalsContact SG-OG 3.33Å; S321-K323 PolarHBondContact O-N 2.97Å; S321-K323 WeakPolarHBondContact OG-CB 3.35Å; S321-K323 PolarHBondContact OG-N 3.33Å
322	Q	90.1	Very high	92.5	Very high	121 Å²	121	43.9 Å²	43.9	57%	0.565	21%	0.212	S	C	*	.			trans	55.1	13.1	-171.4	-62	-62.5	-47.8	0	0	114.2	K317 C318 P319	K317-Q322 WeakPolarHBondContact CD-O 3.32Å; C318-Q322 VanDerWaalsContact O-CA 3.27Å; C318-Q322 WeakPolarHBondContact O-CA 3.18Å; C318-Q322 PolarHBondContact O-N 2.9Å; P319-Q322 PolarHBondContact O-NE2 2.91Å
323	K	92.7	Very high	92.5	Very high	140 Å²	140	42.5 Å²	42.5	61%	0.609	20%	0.204	S	C	*	.			trans	-79	149.9	171.8	-64.5	-174.4	179.3	-179.1	0	110.1	C318 S321 E325	C318-K323 WeakPolarHBondContact CB-O 3.45Å; C318-K323 PolarHBondContact N-O 3.43Å; S321-K323 PolarHBondContact O-N 2.97Å; S321-K323 WeakPolarHBondContact OG-CB 3.35Å; S321-K323 PolarHBondContact OG-N 3.33Å; K323-E325 PolarHBondContact O-N 2.83Å
324	T	95.1	Very high	92.4	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.043	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	127.7	174.5	-51.6	0	0	0	0	109.5	I281 E285 I286 V315 K317	I281-T324 HydrophobicContact CG2-CG2 3.7Å; E285-T324 PolarHBondContact OE2-OG1 2.91Å; I286-T324 HydrophobicContact CD1-CG2 3.32Å; I286-T324 HydrophobicContact CG1-CG2 4.42Å; V315-T324 HydrophobicContact CG1-CG2 4.26Å; K317-T324 PolarHBondContact NZ-OG1 3.38Å
325	E	96.2	Very high	92.2	Very high	25 Å²	25	43.7 Å²	43.7	12%	0.117	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.7	175	-72.8	177.9	174.4	0	0	110.1	F244 V315 R316 C318 K323	F244-E325 CarbonylContact O-C 3.59Å; F244-E325 WeakPolarHBondContact O-CA 3.16Å; V315-E325 WeakPolarHBondContact CA-O 3.19Å; R316-E325 HydrophobicContact CG-CB 4.04Å; R316-E325 IonicContact CZ-OE2 3.42Å; R316-E325 VanDerWaalsContact CZ-OE2 3.28Å; R316-E325 PolarHBondContact N-O 2.87Å; R316-E325 IonicContact NE-OE2 2.8Å; R316-E325 PolarHBondContact NE-OE2 3.42Å; R316-E325 IonicContact NH2-OE2 2.66Å; R316-E325 PolarHBondContact NH2-OE2 3.13Å; R316-E325 PolarHBondContact O-N 2.86Å; C318-E325 HydrophobicContact CB-CG 4.01Å; C318-E325 VanDerWaalsContact CB-OE1 3.27Å; C318-E325 WeakPolarHBondContact CB-OE1 3.44Å; C318-E325 PolarHBondContact SG-OE1 3.49Å; K323-E325 PolarHBondContact O-N 2.83Å
326	I	96.7	Very high	92	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.7	164.7	-63.4	167.9	0	0	0	106.6	F244 K246 I286 N289 L290 V313	F244-I326 HydrophobicContact CD2-CD1 4.16Å; F244-I326 HydrophobicContact CE2-CD1 4.5Å; F244-I326 PolarHBondContact O-N 2.87Å; K246-I326 PolarHBondContact N-O 2.88Å; I286-I326 HydrophobicContact CD1-CD1 4.45Å; I286-I326 HydrophobicContact CD1-CG1 3.99Å; I286-I326 HydrophobicContact CG2-CD1 4.41Å; N289-I326 HydrophobicContact CB-CD1 3.63Å; L290-I326 HydrophobicContact CD2-CD1 4.09Å; L290-I326 HydrophobicContact CD2-CG2 4.09Å; L290-I326 HydrophobicContact CG-CD1 3.96Å; V313-I326 HydrophobicContact CG1-CG2 3.67Å
327	V	96.7	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.7	176.5	-177.4	0	0	0	0	108.8	K246 L265 V313 L314 R316 L329	K246-V327 HydrophobicContact CB-CG2 4.19Å; K246-V327 HydrophobicContact CG-CG2 4.37Å; K246-V327 VanDerWaalsContact O-CA 3.27Å; K246-V327 WeakPolarHBondContact O-CA 3.25Å; L265-V327 HydrophobicContact CB-CG1 4.11Å; L265-V327 HydrophobicContact CD1-CB 4.44Å; L265-V327 HydrophobicContact CD1-CG1 3.37Å; L265-V327 HydrophobicContact CD1-CG2 4.21Å; L265-V327 HydrophobicContact CG-CG1 4.39Å; V313-V327 WeakPolarHBondContact CA-O 3.4Å; L314-V327 HydrophobicContact CB-CB 4.06Å; L314-V327 PolarHBondContact N-O 3.5Å; L314-V327 PolarHBondContact O-N 3.25Å; R316-V327 HydrophobicContact CG-CG2 4.26Å; V327-L329 HydrophobicContact CG1-CD2 3.69Å; V327-L329 HydrophobicContact CG1-CG 4.28Å
328	L	95.8	Very high	92	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.2	174.8	-165.1	61.7	0	0	0	108.4	L245 K246 P248 M293 V313 H331	L245-L328 HydrophobicContact CD1-CB 4.19Å; K246-L328 PolarHBondContact O-N 2.94Å; P248-L328 WeakPolarHBondContact CD-O 3.4Å; M293-L328 HydrophobicContact CE-CD2 4.4Å; M293-L328 HydrophobicContact SD-CD2 4.45Å; V313-L328 HydrophobicContact CG2-CD1 3.95Å; L328-H331 PolarHBondContact O-NE2 3.38Å
329	L	92.4	Very high	92	Very high	36 Å²	36	51.7 Å²	51.7	19%	0.188	26%	0.258	C	S	.	.			trans	-96.4	-49.5	-169.7	-65.9	176.7	0	0	0	113.5	P248 M262 N312 L314 V327	P248-L329 HydrophobicContact CG-CD2 4.01Å; M262-L329 HydrophobicContact CE-CD2 4.48Å; N312-L329 PolarHBondContact O-N 3.07Å; L314-L329 HydrophobicContact CD1-CD1 3.8Å; L314-L329 HydrophobicContact CD1-CD2 4.4Å; L314-L329 HydrophobicContact CD1-CG 4.42Å; L314-L329 HydrophobicContact CD2-CD1 4.35Å; L314-L329 HydrophobicContact CG-CD1 3.72Å; L314-L329 HydrophobicContact CG-CG 4.32Å; V327-L329 HydrophobicContact CG1-CD2 3.69Å; V327-L329 HydrophobicContact CG1-CG 4.28Å
330	D	90.1	Very high	92.4	Very high	22 Å²	22	51.6 Å²	51.6	12%	0.118	25%	0.252	C	S	.	.			trans	-90.5	136.2	-175.1	-168.6	-30.7	0	0	0	109.5	H305 N312 G332	H305-D330 PolarHBondContact NE2-O 3.13Å; N312-D330 HydrophobicContact CB-CB 3.72Å; N312-D330 WeakPolarHBondContact ND2-CB 3.32Å; N312-D330 PolarHBondContact ND2-OD2 3.5Å; D330-G332 PolarHBondContact OD1-N 2.8Å
331	H	93.8	Very high	92.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	21%	0.212	C	C	.	.			trans	-132.7	21.3	176.9	-69.8	-87.6	0	0	0	113.3	E228 N231 A232 V247 L328 Y334	E228-H331 HydrophobicContact CG-CB 3.95Å; E228-H331 WeakPolarHBondContact O-CB 3.48Å; E228-H331 PolarHBondContact OE1-N 2.98Å; N231-H331 HydrophobicContact CB-CB 3.98Å; N231-H331 WeakPolarHBondContact CB-O 3.2Å; N231-H331 PolarHBondContact ND2-O 3.34Å; N231-H331 VanDerWaalsContact ND2-O 3.12Å; A232-H331 HydrophobicContact CB-CB 4.06Å; A232-H331 VanDerWaalsContact CB-CD2 3.46Å; A232-H331 WeakPolarHBondContact CB-CD2 3.43Å; V247-H331 WeakPolarHBondContact CG1-NE2 3.44Å; L328-H331 PolarHBondContact O-NE2 3.38Å; H331-Y334 HydrophobicContact CB-CE2 3.8Å; H331-Y334 PolarHBondContact CE1-OH 2.94Å; H331-Y334 AromaticContact ND1-CE2 3.54Å; H331-Y334 AromaticContact ND1-CZ 3.55Å; H331-Y334 PolarHBondContact ND1-OH 3.33Å; H331-Y334 WeakPolarHBondContact O-CD2 3.45Å
332	G	88.4	Confident	93	Very high	3 Å²	3	40.1 Å²	40.1	3%	0.031	20%	0.201	C	C	.	.	S	Bend	trans	-71.1	-30.8	-174	0	0	0	0	0	114.1	D330	D330-G332 PolarHBondContact OD1-N 2.8Å
333	L	87.2	Confident	93.2	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	18%	0.175	C	C	.	.			trans	-120.4	99.2	-173.9	-169.5	65.6	0	0	0	113.4	N218 C306 D307	N218-L333 HydrophobicContact CB-CD1 3.78Å; C306-L333 HydrophobicContact CB-CD2 4.03Å; C306-L333 HydrophobicContact CB-CG 4.06Å; C306-L333 PolarHBondContact N-O 3.49Å; D307-L333 HydrophobicContact CB-CB 4.3Å; D307-L333 HydrophobicContact CB-CD2 4.21Å
334	Y	91.4	Very high	93.3	Very high	22 Å²	22	28.5 Å²	28.5	9%	0.086	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.4	173.4	-81.9	-95.2	0	0	0	112.9	N231 V235 M297 F303 V304 H305 H331	N231-Y334 HydrophobicContact CB-CD2 3.71Å; N231-Y334 HydrophobicContact CB-CE2 3.86Å; N231-Y334 HydrophobicContact CB-CG 4.47Å; V235-Y334 HydrophobicContact CG2-CD1 4.49Å; V235-Y334 HydrophobicContact CG2-CE1 3.46Å; V235-Y334 VanDerWaalsContact CG2-CE1 3.46Å; V235-Y334 HydrophobicContact CG2-CE2 4.47Å; V235-Y334 VanDerWaalsContact CG2-CZ 3.46Å; V235-Y334 WeakPolarHBondContact CG2-OH 3.47Å; M297-Y334 HydrophobicContact SD-CE1 4.46Å; F303-Y334 AromaticContact CD1-CD1 3.7Å; F303-Y334 HydrophobicContact CD1-CD1 3.7Å; F303-Y334 AromaticContact CD1-CE1 3.96Å; F303-Y334 HydrophobicContact CD1-CE1 3.96Å; F303-Y334 HydrophobicContact CD2-CD1 4.22Å; F303-Y334 AromaticContact CE1-CD1 3.27Å; F303-Y334 HydrophobicContact CE1-CD1 3.27Å; F303-Y334 AromaticContact CE1-CE1 3.58Å; F303-Y334 HydrophobicContact CE1-CE1 3.58Å; F303-Y334 AromaticContact CE1-CG 3.84Å; F303-Y334 HydrophobicContact CE1-CG 3.84Å; F303-Y334 AromaticContact CE2-CD1 3.86Å; F303-Y334 HydrophobicContact CE2-CD1 3.86Å; F303-Y334 AromaticContact CE2-CG 3.95Å; F303-Y334 HydrophobicContact CE2-CG 3.95Å; F303-Y334 HydrophobicContact CG-CD1 4.16Å; F303-Y334 AromaticContact CZ-CD1 3.37Å; F303-Y334 HydrophobicContact CZ-CD1 3.37Å; F303-Y334 HydrophobicContact CZ-CD2 4.26Å; F303-Y334 HydrophobicContact CZ-CE1 4.11Å; F303-Y334 AromaticContact CZ-CG 3.46Å; F303-Y334 HydrophobicContact CZ-CG 3.46Å; F303-Y334 VanDerWaalsContact CZ-CG 3.46Å; V304-Y334 VanDerWaalsContact C-CD1 3.45Å; V304-Y334 VanDerWaalsContact O-CA 3.29Å; V304-Y334 WeakPolarHBondContact O-CA 3.32Å; V304-Y334 WeakPolarHBondContact O-CD1 3.48Å; H305-Y334 HydrophobicContact CB-CD1 4.34Å; H305-Y334 HydrophobicContact CB-CE1 3.66Å; H305-Y334 HydrophobicContact CB-CE2 4.45Å; H305-Y334 AromaticContact CD2-CZ 3.75Å; H305-Y334 PolarHBondContact CD2-OH 3.01Å; H305-Y334 AromaticContact CG-CZ 3.99Å; H331-Y334 HydrophobicContact CB-CE2 3.8Å; H331-Y334 PolarHBondContact CE1-OH 2.94Å; H331-Y334 AromaticContact ND1-CE2 3.54Å; H331-Y334 AromaticContact ND1-CZ 3.55Å; H331-Y334 PolarHBondContact ND1-OH 3.33Å; H331-Y334 WeakPolarHBondContact O-CD2 3.45Å
335	Q	89.4	Confident	93.3	Very high	25 Å²	25	28.2 Å²	28.2	12%	0.117	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.9	171.8	-177.5	60	48.3	0	0	110.8	K217 V304 L337 Q426 L429	K217-Q335 VanDerWaalsContact NZ-OE1 3.12Å; V304-Q335 PolarHBondContact N-O 3.26Å; V304-Q335 PolarHBondContact O-N 2.84Å; Q335-L337 HydrophobicContact CG-CD2 4.44Å; Q335-Q426 HydrophobicContact CG-CG 4.28Å; Q335-L429 HydrophobicContact CB-CD1 3.89Å; Q335-L429 HydrophobicContact CG-CD1 3.87Å
336	V	93.4	Very high	93.2	Very high	81 Å²	81	27 Å²	27	49%	0.491	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.7	168.3	-178.6	0	0	0	0	108.5	G302 F303 Q426	G302-V336 CarbonylContact O-C 3.45Å; G302-V336 WeakPolarHBondContact O-CA 3.18Å; F303-V336 HydrophobicContact CD2-CG2 3.8Å; F303-V336 HydrophobicContact CE2-CG2 4.24Å; V336-Q426 PolarHBondContact O-OE1 2.96Å
337	L	94.2	Very high	93.1	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.037	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-80.4	132.1	177.2	-59.3	-175.2	0	0	0	111	I298 G302 V304 Q335 F341 R342 Q426 L430	I298-L337 HydrophobicContact CG2-CD1 4.28Å; G302-L337 PolarHBondContact O-N 3.45Å; V304-L337 HydrophobicContact CG2-CD1 3.85Å; V304-L337 HydrophobicContact CG2-CD2 4.46Å; V304-L337 HydrophobicContact CG2-CG 3.9Å; Q335-L337 HydrophobicContact CG-CD2 4.44Å; L337-F341 HydrophobicContact CB-CD1 4.48Å; L337-F341 HydrophobicContact CD2-CD1 4.3Å; L337-F341 HydrophobicContact CD2-CE1 4.02Å; L337-R342 HydrophobicContact CB-CB 4.1Å; L337-R342 HydrophobicContact CD1-CB 4.37Å; L337-R342 HydrophobicContact CD1-CG 4.2Å; L337-Q426 VanDerWaalsContact CA-OE1 3.25Å; L337-Q426 HydrophobicContact CD2-CB 4.17Å; L337-L430 HydrophobicContact CD1-CD1 4.06Å; L337-L430 HydrophobicContact CD1-CD2 4.31Å; L337-L430 HydrophobicContact CD2-CD1 4.2Å; L337-L430 HydrophobicContact CD2-CD2 4.4Å; L337-L430 HydrophobicContact CD2-CG 4.3Å
338	Q	94.5	Very high	93	Very high	111 Å²	111	30.6 Å²	30.6	52%	0.519	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-61.2	136.6	173.3	-67.3	-59.7	-29.3	0	0	110.1	D340 F341 R342	Q338-D340 VanDerWaalsContact C-N 3.33Å; Q338-D340 PolarHBondContact O-N 3.42Å; Q338-F341 HydrophobicContact CB-CB 4.09Å; Q338-F341 PolarHBondContact O-N 3.17Å; Q338-R342 WeakPolarHBondContact O-CB 3.48Å; Q338-R342 PolarHBondContact O-N 3.23Å
339	P	91.6	Very high	92.8	Very high	73 Å²	73	31 Å²	31	47%	0.474	16%	0.157	S	C	.	.	H	α-helix	trans	-55.1	-44.5	-172.9	-29.1	35.5	0	0	0	114	R342 M343	P339-R342 PolarHBondContact O-N 3.16Å; P339-M343 VanDerWaalsContact O-CG 3.27Å; P339-M343 WeakPolarHBondContact O-CG 2.95Å; P339-M343 PolarHBondContact O-N 2.94Å
340	D	93.1	Very high	92.7	Very high	98 Å²	98	31.4 Å²	31.4	52%	0.524	16%	0.158	S	C	.	.	H	α-helix	trans	-70	-43.4	-179.2	-71.5	-32.3	0	0	0	112	Q338 R342 M343 D344	Q338-D340 VanDerWaalsContact C-N 3.33Å; Q338-D340 PolarHBondContact O-N 3.42Å; D340-R342 VanDerWaalsContact C-N 3.34Å; D340-R342 PolarHBondContact O-N 3.1Å; D340-M343 PolarHBondContact O-N 2.76Å; D340-M343 VanDerWaalsContact O-N 3.16Å; D340-D344 PolarHBondContact O-N 3.34Å
341	F	95	Very high	92.9	Very high	19 Å²	19	30.7 Å²	30.7	8%	0.083	16%	0.155	C	C	.	.	H	α-helix	trans	-55.3	-49.3	173.1	172.7	-90.5	0	0	0	111.2	L337 Q338 M343 D344 Y345 L367 P424 Q426 M427 L430	L337-F341 HydrophobicContact CB-CD1 4.48Å; L337-F341 HydrophobicContact CD2-CD1 4.3Å; L337-F341 HydrophobicContact CD2-CE1 4.02Å; Q338-F341 HydrophobicContact CB-CB 4.09Å; Q338-F341 PolarHBondContact O-N 3.17Å; F341-M343 VanDerWaalsContact C-N 3.3Å; F341-M343 PolarHBondContact O-N 3.09Å; F341-D344 PolarHBondContact O-N 2.84Å; F341-Y345 WeakPolarHBondContact O-CB 3.28Å; F341-Y345 PolarHBondContact O-N 3.4Å; F341-L367 HydrophobicContact CD2-CD2 3.48Å; F341-L367 VanDerWaalsContact CD2-CD2 3.48Å; F341-L367 HydrophobicContact CE2-CD2 3.46Å; F341-L367 VanDerWaalsContact CE2-CD2 3.46Å; F341-L367 HydrophobicContact CG-CD2 4.22Å; F341-L367 HydrophobicContact CZ-CD2 4.18Å; F341-P424 HydrophobicContact CD2-CB 4.48Å; F341-P424 HydrophobicContact CD2-CG 4.32Å; F341-P424 HydrophobicContact CE2-CB 4.23Å; F341-P424 HydrophobicContact CE2-CG 4.19Å; F341-Q426 HydrophobicContact CD1-CB 4.3Å; F341-Q426 HydrophobicContact CE1-CB 3.9Å; F341-Q426 HydrophobicContact CE2-CB 4.36Å; F341-Q426 HydrophobicContact CZ-CB 3.92Å; F341-M427 HydrophobicContact CE2-CB 4.16Å; F341-M427 HydrophobicContact CE2-CE 3.9Å; F341-M427 HydrophobicContact CZ-CB 4.01Å; F341-M427 HydrophobicContact CZ-CE 3.7Å; F341-L430 HydrophobicContact CE1-CD1 3.73Å; F341-L430 HydrophobicContact CZ-CD1 4.14Å
342	R	94.9	Very high	92.7	Very high	45 Å²	45	30.6 Å²	30.6	17%	0.17	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-39.5	178.7	-175.5	178.9	62.7	142.7	-6.1	111.9	I298 F299 V300 H301 L337 Q338 P339 D340 Y345 C346	I298-R342 WeakPolarHBondContact O-CD 3.47Å; F299-R342 PolarHBondContact O-NH1 3.22Å; V300-R342 PolarHBondContact O-NH1 3.43Å; H301-R342 VanDerWaalsContact C-NH1 3.29Å; L337-R342 HydrophobicContact CB-CB 4.1Å; L337-R342 HydrophobicContact CD1-CB 4.37Å; L337-R342 HydrophobicContact CD1-CG 4.2Å; Q338-R342 WeakPolarHBondContact O-CB 3.48Å; Q338-R342 PolarHBondContact O-N 3.23Å; P339-R342 PolarHBondContact O-N 3.16Å; D340-R342 VanDerWaalsContact C-N 3.34Å; D340-R342 PolarHBondContact O-N 3.1Å; R342-Y345 PolarHBondContact O-N 2.84Å; R342-C346 PolarHBondContact O-N 2.84Å; R342-C346 PolarHBondContact O-SG 3.47Å
343	M	94.6	Very high	92.5	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-68.7	-38.2	177.6	-71.1	-55.7	94.3	0	0	112.6	P339 D340 F341 Y345 C346 R347 A463 H467	P339-M343 VanDerWaalsContact O-CG 3.27Å; P339-M343 WeakPolarHBondContact O-CG 2.95Å; P339-M343 PolarHBondContact O-N 2.94Å; D340-M343 PolarHBondContact O-N 2.76Å; D340-M343 VanDerWaalsContact O-N 3.16Å; F341-M343 VanDerWaalsContact C-N 3.3Å; F341-M343 PolarHBondContact O-N 3.09Å; M343-Y345 VanDerWaalsContact C-N 3.32Å; M343-C346 PolarHBondContact O-N 2.99Å; M343-R347 WeakPolarHBondContact O-CG 3.47Å; M343-R347 PolarHBondContact O-N 2.95Å; M343-A463 HydrophobicContact CE-CB 4.24Å; M343-H467 HydrophobicContact SD-CB 3.65Å
344	D	95.7	Very high	92.4	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.064	19%	0.188	C	C	.	.	H	α-helix	trans	-65.2	-39.9	173.5	-71.6	-26.3	0	0	0	111	D340 F341 R347 L348 Y363 R366 L367	D340-D344 PolarHBondContact O-N 3.34Å; F341-D344 PolarHBondContact O-N 2.84Å; D344-R347 PolarHBondContact O-N 3.15Å; D344-L348 WeakPolarHBondContact O-CB 3.49Å; D344-L348 PolarHBondContact O-N 3.05Å; D344-Y363 HydrophobicContact CB-CD1 4.26Å; D344-R366 VanDerWaalsContact CG-NH2 3.31Å; D344-R366 IonicContact OD1-CZ 3.84Å; D344-R366 IonicContact OD1-NE 3.19Å; D344-R366 PolarHBondContact OD1-NE 2.85Å; D344-R366 IonicContact OD1-NH1 3.34Å; D344-R366 IonicContact OD1-NH2 3.38Å; D344-R366 PolarHBondContact OD1-NH2 3.21Å; D344-R366 IonicContact OD2-CZ 3.62Å; D344-R366 IonicContact OD2-NE 2.67Å; D344-R366 PolarHBondContact OD2-NE 3.27Å; D344-R366 IonicContact OD2-NH2 2.68Å; D344-R366 PolarHBondContact OD2-NH2 3.46Å; D344-L367 HydrophobicContact CB-CD2 4.06Å; D344-L367 HydrophobicContact CB-CG 4.21Å
345	Y	94.9	Very high	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-46.1	173.6	-168.8	-111.2	0	0	0	112.9	I298 F299 F341 R342 M343 R347 L348 W349 L367 L380 M427 L430 N434	I298-Y345 HydrophobicContact CG2-CD1 3.97Å; I298-Y345 HydrophobicContact CG2-CE1 3.65Å; F299-Y345 HydrophobicContact CD1-CD1 4.03Å; F299-Y345 HydrophobicContact CD1-CE1 4.34Å; F299-Y345 AromaticContact CE1-CD1 3.38Å; F299-Y345 HydrophobicContact CE1-CD1 3.38Å; F299-Y345 AromaticContact CE1-CE1 3.42Å; F299-Y345 HydrophobicContact CE1-CE1 3.42Å; F299-Y345 VanDerWaalsContact CE1-CE1 3.42Å; F299-Y345 HydrophobicContact CE1-CG 4.49Å; F299-Y345 HydrophobicContact CZ-CD1 4.16Å; F299-Y345 AromaticContact CZ-CE1 3.71Å; F299-Y345 HydrophobicContact CZ-CE1 3.71Å; F341-Y345 WeakPolarHBondContact O-CB 3.28Å; F341-Y345 PolarHBondContact O-N 3.4Å; R342-Y345 PolarHBondContact O-N 2.84Å; M343-Y345 VanDerWaalsContact C-N 3.32Å; Y345-R347 VanDerWaalsContact C-N 3.27Å; Y345-R347 PolarHBondContact O-N 2.81Å; Y345-L348 PolarHBondContact O-N 3Å; Y345-W349 AromaticContact CD1-CD1 3.92Å; Y345-W349 AromaticContact CE1-CD1 3.59Å; Y345-W349 AromaticContact CE1-NE1 3.4Å; Y345-W349 AromaticContact CE2-CD1 3.87Å; Y345-W349 AromaticContact CE2-NE1 3.41Å; Y345-W349 AromaticContact CZ-CD1 3.61Å; Y345-W349 AromaticContact CZ-NE1 2.99Å; Y345-W349 PolarHBondContact O-N 3.5Å; Y345-W349 PolarHBondContact OH-NE1 3.21Å; Y345-L367 HydrophobicContact CD2-CD1 4.28Å; Y345-L380 HydrophobicContact CE2-CD1 3.79Å; Y345-L380 HydrophobicContact CE2-CD2 4.02Å; Y345-M427 HydrophobicContact CD2-CE 3.76Å; Y345-M427 HydrophobicContact CD2-SD 4.41Å; Y345-M427 HydrophobicContact CE2-CE 4.01Å; Y345-M427 HydrophobicContact CE2-SD 4.06Å; Y345-L430 HydrophobicContact CD1-CD1 4.08Å; Y345-L430 HydrophobicContact CD2-CD1 4.44Å; Y345-L430 HydrophobicContact CE1-CD1 3.91Å; Y345-L430 HydrophobicContact CE2-CD1 4.25Å; Y345-L430 HydrophobicContact CG-CD1 4.33Å; Y345-N434 PolarHBondContact OH-ND2 3.43Å; Y345-N434 VanDerWaalsContact OH-ND2 3.13Å
346	C	93.9	Very high	92.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-55.5	-44	173.3	-70.5	0	0	0	0	111.6	F299 R342 M343 W349 M350 C460 V464	F299-C346 HydrophobicContact CD1-CB 4.43Å; F299-C346 VanDerWaalsContact CD1-SG 3.57Å; R342-C346 PolarHBondContact O-N 2.84Å; R342-C346 PolarHBondContact O-SG 3.47Å; M343-C346 PolarHBondContact O-N 2.99Å; C346-W349 PolarHBondContact O-N 2.81Å; C346-M350 VanDerWaalsContact O-CG 3.31Å; C346-M350 WeakPolarHBondContact O-CG 3.46Å; C346-M350 PolarHBondContact O-N 3.4Å; C346-C460 HydrophobicContact CB-CB 4.45Å; C346-V464 HydrophobicContact CB-CG2 4.05Å
347	R	94.7	Very high	92.4	Very high	77 Å²	77	39.4 Å²	39.4	29%	0.291	20%	0.196	S	C	.	.	H	α-helix	trans	-73.7	-35.9	-176.7	-67.9	174.4	-174.9	-148.6	7.7	112.2	M343 D344 Y345 M350 S351 Y363 V464	M343-R347 WeakPolarHBondContact O-CG 3.47Å; M343-R347 PolarHBondContact O-N 2.95Å; D344-R347 PolarHBondContact O-N 3.15Å; Y345-R347 VanDerWaalsContact C-N 3.27Å; Y345-R347 PolarHBondContact O-N 2.81Å; R347-M350 PolarHBondContact O-N 2.89Å; R347-S351 PolarHBondContact O-N 3.18Å; R347-S351 PolarHBondContact O-OG 3.34Å; R347-Y363 HydrophobicContact CB-CD1 3.91Å; R347-Y363 HydrophobicContact CB-CD2 3.65Å; R347-Y363 HydrophobicContact CB-CE1 3.75Å; R347-Y363 HydrophobicContact CB-CE2 3.51Å; R347-Y363 HydrophobicContact CB-CG 3.9Å; R347-Y363 WeakPolarHBondContact CD-OH 3.32Å; R347-Y363 HydrophobicContact CG-CE1 4.24Å; R347-Y363 HydrophobicContact CG-CE2 4.42Å; R347-Y363 PolarHBondContact NH1-OH 3.02Å; R347-Y363 VanDerWaalsContact NH1-OH 3.12Å; R347-V464 HydrophobicContact CG-CG2 4.35Å
348	L	94.6	Very high	92.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-52	170.5	175.9	57.1	0	0	0	110.5	D344 Y345 M350 S351 L352 V360 S364 L367 F376 L380	D344-L348 WeakPolarHBondContact O-CB 3.49Å; D344-L348 PolarHBondContact O-N 3.05Å; Y345-L348 PolarHBondContact O-N 3Å; L348-M350 VanDerWaalsContact C-N 3.33Å; L348-M350 PolarHBondContact O-N 2.79Å; L348-S351 PolarHBondContact O-N 3.35Å; L348-L352 HydrophobicContact CD1-CD1 4Å; L348-L352 HydrophobicContact CD1-CG 4.02Å; L348-L352 HydrophobicContact CG-CD1 3.8Å; L348-L352 HydrophobicContact CG-CG 4.31Å; L348-L352 WeakPolarHBondContact O-CG 3.34Å; L348-L352 PolarHBondContact O-N 3.18Å; L348-V360 HydrophobicContact CD1-CB 4.38Å; L348-V360 HydrophobicContact CD1-CG1 4.16Å; L348-V360 HydrophobicContact CD1-CG2 4.5Å; L348-S364 WeakPolarHBondContact CD1-OG 3.31Å; L348-L367 HydrophobicContact CB-CD1 4.2Å; L348-L367 HydrophobicContact CD2-CD1 3.57Å; L348-F376 HydrophobicContact CD2-CD1 4.33Å; L348-F376 HydrophobicContact CD2-CE1 3.54Å; L348-F376 HydrophobicContact CD2-CZ 4.31Å; L348-L380 HydrophobicContact CD2-CD2 3.57Å; L348-L380 HydrophobicContact CG-CD2 4.26Å
349	W	91.9	Very high	92.5	Very high	9 Å²	9	37.8 Å²	37.8	3%	0.034	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-42.7	177.4	-85.1	99.2	0	0	0	112.7	F299 Y345 C346 S351 L352 I353 L380 T381 I392 F453 M456	F299-W349 HydrophobicContact CE1-CB 4.38Å; F299-W349 AromaticContact CE1-CD1 3.59Å; F299-W349 HydrophobicContact CE1-CG 4.08Å; F299-W349 HydrophobicContact CZ-CB 4.47Å; F299-W349 AromaticContact CZ-CD1 3.62Å; F299-W349 HydrophobicContact CZ-CD2 4.45Å; F299-W349 AromaticContact CZ-CG 3.92Å; F299-W349 HydrophobicContact CZ-CG 3.92Å; F299-W349 AromaticContact CZ-NE1 3.96Å; Y345-W349 AromaticContact CD1-CD1 3.92Å; Y345-W349 AromaticContact CE1-CD1 3.59Å; Y345-W349 AromaticContact CE1-NE1 3.4Å; Y345-W349 AromaticContact CE2-CD1 3.87Å; Y345-W349 AromaticContact CE2-NE1 3.41Å; Y345-W349 AromaticContact CZ-CD1 3.61Å; Y345-W349 AromaticContact CZ-NE1 2.99Å; Y345-W349 PolarHBondContact O-N 3.5Å; Y345-W349 PolarHBondContact OH-NE1 3.21Å; C346-W349 PolarHBondContact O-N 2.81Å; W349-S351 VanDerWaalsContact C-N 3.28Å; W349-S351 PolarHBondContact O-N 3.47Å; W349-L352 HydrophobicContact CD2-CD1 4.41Å; W349-L352 HydrophobicContact CE3-CD1 4.44Å; W349-L352 PolarHBondContact O-N 3.39Å; W349-I353 WeakPolarHBondContact O-CB 3.45Å; W349-I353 VanDerWaalsContact O-CD1 3.27Å; W349-I353 WeakPolarHBondContact O-CD1 3.48Å; W349-I353 VanDerWaalsContact O-CG1 3.24Å; W349-I353 WeakPolarHBondContact O-CG1 3.27Å; W349-I353 PolarHBondContact O-N 3.33Å; W349-L380 HydrophobicContact CZ2-CD1 4.02Å; W349-L380 HydrophobicContact CZ2-CD2 4.31Å; W349-L380 HydrophobicContact CZ2-CG 3.81Å; W349-T381 HydrophobicContact CH2-CG2 4.12Å; W349-T381 HydrophobicContact CZ3-CG2 4.17Å; W349-I392 HydrophobicContact CE3-CD1 4.04Å; W349-I392 HydrophobicContact CZ3-CD1 3.62Å; W349-F453 HydrophobicContact CZ3-CD1 4.31Å; W349-F453 HydrophobicContact CZ3-CE1 4.2Å; W349-M456 HydrophobicContact CD2-CE 3.42Å; W349-M456 VanDerWaalsContact CD2-CE 3.42Å; W349-M456 HydrophobicContact CE3-CE 3.47Å; W349-M456 VanDerWaalsContact CE3-CE 3.47Å; W349-M456 HydrophobicContact CE3-SD 4.36Å; W349-M456 HydrophobicContact CG-CE 4.19Å; W349-M456 HydrophobicContact CH2-CE 3.51Å; W349-M456 HydrophobicContact CH2-SD 4.31Å; W349-M456 HydrophobicContact CZ2-CE 3.46Å; W349-M456 VanDerWaalsContact CZ2-CE 3.46Å; W349-M456 HydrophobicContact CZ3-CE 3.5Å; W349-M456 HydrophobicContact CZ3-SD 4.09Å
350	M	90.2	Very high	92.7	Very high	43 Å²	43	34.3 Å²	34.3	21%	0.212	18%	0.176	C	C	.	.	H	α-helix	trans	-60.1	-37	174.4	-71.5	-179.5	71.9	0	0	113.1	C346 R347 L348 K354 C460 V461 V464	C346-M350 VanDerWaalsContact O-CG 3.31Å; C346-M350 WeakPolarHBondContact O-CG 3.46Å; C346-M350 PolarHBondContact O-N 3.4Å; R347-M350 PolarHBondContact O-N 2.89Å; L348-M350 VanDerWaalsContact C-N 3.33Å; L348-M350 PolarHBondContact O-N 2.79Å; M350-K354 VanDerWaalsContact O-CG 3.31Å; M350-K354 WeakPolarHBondContact O-CG 3.35Å; M350-K354 PolarHBondContact O-N 3.2Å; M350-C460 HydrophobicContact CG-CB 3.68Å; M350-C460 HydrophobicContact SD-CB 4.18Å; M350-V461 HydrophobicContact CE-CG2 4.21Å; M350-V464 HydrophobicContact SD-CG2 3.97Å
351	S	92.6	Very high	92.9	Very high	8 Å²	8	32.4 Å²	32.4	6%	0.056	16%	0.164	C	C	.	.	H	α-helix	trans	-72.9	-40.9	176.7	-69.9	0	0	0	0	111.9	R347 L348 W349 I353 K354 G355 D356 G359	R347-S351 PolarHBondContact O-N 3.18Å; R347-S351 PolarHBondContact O-OG 3.34Å; L348-S351 PolarHBondContact O-N 3.35Å; W349-S351 VanDerWaalsContact C-N 3.28Å; W349-S351 PolarHBondContact O-N 3.47Å; S351-I353 PolarHBondContact O-N 2.94Å; S351-K354 PolarHBondContact O-N 3.26Å; S351-G355 PolarHBondContact O-N 3.3Å; S351-D356 PolarHBondContact O-N 3.4Å; S351-D356 PolarHBondContact OG-OD2 3.4Å; S351-D356 VanDerWaalsContact OG-OD2 3.07Å; S351-G359 WeakPolarHBondContact OG-CA 3.14Å
352	L	90.1	Very high	93	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-42.3	175.2	-70	165.6	0	0	0	112.3	L348 W349 K354 G355 V360 A377 L380 T381 V388 G391 I392	L348-L352 HydrophobicContact CD1-CD1 4Å; L348-L352 HydrophobicContact CD1-CG 4.02Å; L348-L352 HydrophobicContact CG-CD1 3.8Å; L348-L352 HydrophobicContact CG-CG 4.31Å; L348-L352 WeakPolarHBondContact O-CG 3.34Å; L348-L352 PolarHBondContact O-N 3.18Å; W349-L352 HydrophobicContact CD2-CD1 4.41Å; W349-L352 HydrophobicContact CE3-CD1 4.44Å; W349-L352 PolarHBondContact O-N 3.39Å; L352-K354 VanDerWaalsContact C-N 3.29Å; L352-K354 PolarHBondContact O-N 3.48Å; L352-G355 PolarHBondContact O-N 2.93Å; L352-V360 HydrophobicContact CD2-CG1 3.95Å; L352-V360 HydrophobicContact CD2-CG2 3.68Å; L352-V360 HydrophobicContact CG-CG2 4Å; L352-A377 HydrophobicContact CD2-CB 3.8Å; L352-L380 HydrophobicContact CD1-CD2 4.05Å; L352-T381 HydrophobicContact CB-CG2 4.47Å; L352-T381 HydrophobicContact CD1-CG2 3.64Å; L352-T381 HydrophobicContact CD2-CG2 4.1Å; L352-T381 HydrophobicContact CG-CG2 4.29Å; L352-V388 HydrophobicContact CD2-CG1 3.8Å; L352-G391 WeakPolarHBondContact O-CA 3.46Å; L352-I392 HydrophobicContact CB-CD1 4.16Å; L352-I392 PolarHBondContact O-N 3.47Å; L352-I392 VanDerWaalsContact O-N 3.14Å
353	I	84.9	Confident	93.1	Very high	20 Å²	20	37.2 Å²	37.2	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-36.4	177.5	-70.2	157.3	0	0	0	111.2	W349 S351 I392 S393 S457	W349-I353 WeakPolarHBondContact O-CB 3.45Å; W349-I353 VanDerWaalsContact O-CD1 3.27Å; W349-I353 WeakPolarHBondContact O-CD1 3.48Å; W349-I353 VanDerWaalsContact O-CG1 3.24Å; W349-I353 WeakPolarHBondContact O-CG1 3.27Å; W349-I353 PolarHBondContact O-N 3.33Å; S351-I353 PolarHBondContact O-N 2.94Å; I353-I392 HydrophobicContact CG1-CD1 4.1Å; I353-I392 HydrophobicContact CG1-CG1 4.15Å; I353-S393 PolarHBondContact O-OG 3.49Å; I353-S457 WeakPolarHBondContact CD1-OG 3.23Å
354	K	85.3	Confident	93.1	Very high	152 Å²	152	37 Å²	37	66%	0.661	18%	0.181	S	C	*	.	H	α-helix	trans	-87.8	-11	-177.9	-70.6	178.7	179.8	-175.4	0	114.8	M350 S351 L352 D356	M350-K354 VanDerWaalsContact O-CG 3.31Å; M350-K354 WeakPolarHBondContact O-CG 3.35Å; M350-K354 PolarHBondContact O-N 3.2Å; S351-K354 PolarHBondContact O-N 3.26Å; L352-K354 VanDerWaalsContact C-N 3.29Å; L352-K354 PolarHBondContact O-N 3.48Å; K354-D356 VanDerWaalsContact C-N 3.29Å
355	G	87.4	Confident	93.1	Very high	18 Å²	18	41.4 Å²	41.4	19%	0.186	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	24.9	-168.4	0	0	0	0	0	113.5	S351 L352 L357	S351-G355 PolarHBondContact O-N 3.3Å; L352-G355 PolarHBondContact O-N 2.93Å; G355-L357 PolarHBondContact O-N 3.47Å; G355-L357 VanDerWaalsContact O-N 3.09Å
356	D	92.3	Very high	93.1	Very high	61 Å²	61	47.5 Å²	47.5	33%	0.326	22%	0.219	S	C	.	.			trans	-80.1	87.6	177.3	166.9	25.1	0	0	0	110.4	S351 K354 S358 G359 V360	S351-D356 PolarHBondContact O-N 3.4Å; S351-D356 PolarHBondContact OG-OD2 3.4Å; S351-D356 VanDerWaalsContact OG-OD2 3.07Å; K354-D356 VanDerWaalsContact C-N 3.29Å; D356-S358 VanDerWaalsContact C-N 3.27Å; D356-S358 PolarHBondContact O-N 3.21Å; D356-S358 PolarHBondContact OD1-N 2.9Å; D356-S358 PolarHBondContact OD1-OG 2.9Å; D356-G359 PolarHBondContact O-N 3.25Å; D356-G359 VanDerWaalsContact O-N 3.11Å; D356-G359 PolarHBondContact OD1-N 3.44Å; D356-G359 VanDerWaalsContact OD1-N 3.08Å; D356-G359 WeakPolarHBondContact OD2-CA 3.4Å; D356-G359 PolarHBondContact OD2-N 3.45Å; D356-V360 WeakPolarHBondContact O-CG2 3.37Å; D356-V360 PolarHBondContact O-N 2.89Å
357	L	93.8	Very high	93.1	Very high	69 Å²	69	47.6 Å²	47.6	36%	0.361	22%	0.22	S	C	.	.	H	α-helix	trans	-58	-37.3	-177.1	-66.3	180	0	0	0	113.3	G355 G359 V360 E361 W385 T389	G355-L357 PolarHBondContact O-N 3.47Å; G355-L357 VanDerWaalsContact O-N 3.09Å; L357-G359 VanDerWaalsContact C-N 3.31Å; L357-G359 PolarHBondContact O-N 2.98Å; L357-V360 PolarHBondContact O-N 3.44Å; L357-E361 WeakPolarHBondContact O-CB 3.46Å; L357-E361 PolarHBondContact O-N 2.99Å; L357-W385 HydrophobicContact CD2-CH2 4.14Å; L357-W385 HydrophobicContact CD2-CZ2 4.22Å; L357-T389 HydrophobicContact CD1-CG2 4.27Å; L357-T389 HydrophobicContact CD2-CG2 3.93Å
358	S	96	Very high	93	Very high	82 Å²	82	45 Å²	45	57%	0.573	22%	0.217	S	C	*	.	H	α-helix	trans	-63.2	-40	178.1	76.8	0	0	0	0	111.7	D356 R362	D356-S358 VanDerWaalsContact C-N 3.27Å; D356-S358 PolarHBondContact O-N 3.21Å; D356-S358 PolarHBondContact OD1-N 2.9Å; D356-S358 PolarHBondContact OD1-OG 2.9Å; S358-R362 WeakPolarHBondContact O-CB 3.48Å; S358-R362 PolarHBondContact O-N 2.78Å
359	G	95.8	Very high	92.8	Very high	3 Å²	3	45 Å²	45	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-70.9	-41.5	173.9	0	0	0	0	0	112.5	S351 D356 L357 E361 R362 Y363	S351-G359 WeakPolarHBondContact OG-CA 3.14Å; D356-G359 PolarHBondContact O-N 3.25Å; D356-G359 VanDerWaalsContact O-N 3.11Å; D356-G359 PolarHBondContact OD1-N 3.44Å; D356-G359 VanDerWaalsContact OD1-N 3.08Å; D356-G359 WeakPolarHBondContact OD2-CA 3.4Å; D356-G359 PolarHBondContact OD2-N 3.45Å; L357-G359 VanDerWaalsContact C-N 3.31Å; L357-G359 PolarHBondContact O-N 2.98Å; G359-E361 PolarHBondContact O-N 3.18Å; G359-R362 PolarHBondContact O-N 3.02Å; G359-Y363 WeakPolarHBondContact O-CD2 3.45Å; G359-Y363 PolarHBondContact O-N 2.79Å
360	V	95.3	Very high	92.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.1	-51.6	176	173.4	0	0	0	0	110.2	L348 L352 D356 L357 S364 Y373 A377	L348-V360 HydrophobicContact CD1-CB 4.38Å; L348-V360 HydrophobicContact CD1-CG1 4.16Å; L348-V360 HydrophobicContact CD1-CG2 4.5Å; L352-V360 HydrophobicContact CD2-CG1 3.95Å; L352-V360 HydrophobicContact CD2-CG2 3.68Å; L352-V360 HydrophobicContact CG-CG2 4Å; D356-V360 WeakPolarHBondContact O-CG2 3.37Å; D356-V360 PolarHBondContact O-N 2.89Å; L357-V360 PolarHBondContact O-N 3.44Å; V360-S364 WeakPolarHBondContact O-CB 3.49Å; V360-S364 PolarHBondContact O-N 2.99Å; V360-S364 PolarHBondContact O-OG 3.45Å; V360-Y373 HydrophobicContact CG1-CD2 4.24Å; V360-A377 HydrophobicContact CG1-CB 3.92Å
361	E	96.6	Very high	92.8	Very high	58 Å²	58	49 Å²	49	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-59	-52.1	177.4	-179.7	179.5	-169.7	0	0	111.4	L357 G359 Y363 S364 R365 Y373	L357-E361 WeakPolarHBondContact O-CB 3.46Å; L357-E361 PolarHBondContact O-N 2.99Å; G359-E361 PolarHBondContact O-N 3.18Å; E361-Y363 PolarHBondContact O-N 3.47Å; E361-S364 PolarHBondContact O-N 3.28Å; E361-R365 VanDerWaalsContact CG-NH1 3.26Å; E361-R365 WeakPolarHBondContact O-CG 3.21Å; E361-R365 PolarHBondContact O-N 3.42Å; E361-R365 IonicContact OE1-CZ 2.72Å; E361-R365 IonicContact OE1-NH1 2.84Å; E361-R365 PolarHBondContact OE1-NH1 3.01Å; E361-R365 IonicContact OE1-NH2 3.15Å; E361-R365 PolarHBondContact OE1-NH2 3.1Å; E361-Y373 HydrophobicContact CB-CD1 4.31Å; E361-Y373 HydrophobicContact CB-CD2 3.9Å; E361-Y373 HydrophobicContact CB-CE1 4.22Å; E361-Y373 HydrophobicContact CB-CE2 3.75Å; E361-Y373 HydrophobicContact CB-CG 4.18Å; E361-Y373 HydrophobicContact CG-CD1 3.83Å; E361-Y373 HydrophobicContact CG-CD2 4.34Å; E361-Y373 HydrophobicContact CG-CE1 3.75Å; E361-Y373 HydrophobicContact CG-CE2 4.22Å; E361-Y373 HydrophobicContact CG-CG 4.16Å
362	R	97.1	Very high	92.7	Very high	142 Å²	142	50.3 Å²	50.3	54%	0.536	25%	0.251	S	S	.	.	H	α-helix	trans	-57.5	-51.1	-177.6	-179.8	-177.6	-178	177.2	4.7	112.9	S358 G359 R366	S358-R362 WeakPolarHBondContact O-CB 3.48Å; S358-R362 PolarHBondContact O-N 2.78Å; G359-R362 PolarHBondContact O-N 3.02Å; R362-R366 WeakPolarHBondContact O-CG 3.4Å; R362-R366 PolarHBondContact O-N 3.22Å
363	Y	96.5	Very high	92.8	Very high	22 Å²	22	52.4 Å²	52.4	9%	0.086	26%	0.26	C	S	.	.	H	α-helix	trans	-78.2	-30.5	-175	-64.7	-63.5	0	0	0	112	D344 R347 G359 E361 R366 L367	D344-Y363 HydrophobicContact CB-CD1 4.26Å; R347-Y363 HydrophobicContact CB-CD1 3.91Å; R347-Y363 HydrophobicContact CB-CD2 3.65Å; R347-Y363 HydrophobicContact CB-CE1 3.75Å; R347-Y363 HydrophobicContact CB-CE2 3.51Å; R347-Y363 HydrophobicContact CB-CG 3.9Å; R347-Y363 WeakPolarHBondContact CD-OH 3.32Å; R347-Y363 HydrophobicContact CG-CE1 4.24Å; R347-Y363 HydrophobicContact CG-CE2 4.42Å; R347-Y363 PolarHBondContact NH1-OH 3.02Å; R347-Y363 VanDerWaalsContact NH1-OH 3.12Å; G359-Y363 WeakPolarHBondContact O-CD2 3.45Å; G359-Y363 PolarHBondContact O-N 2.79Å; E361-Y363 PolarHBondContact O-N 3.47Å; Y363-R366 PolarHBondContact O-N 3.44Å; Y363-L367 WeakPolarHBondContact O-CB 3.41Å; Y363-L367 WeakPolarHBondContact O-CD1 3.48Å; Y363-L367 WeakPolarHBondContact O-CG 3.21Å; Y363-L367 PolarHBondContact O-N 2.87Å
364	S	95.6	Very high	93.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-44.1	171	-62.5	0	0	0	0	111.8	L348 V360 E361 R366 L367 G368 A369 Y373	L348-S364 WeakPolarHBondContact CD1-OG 3.31Å; V360-S364 WeakPolarHBondContact O-CB 3.49Å; V360-S364 PolarHBondContact O-N 2.99Å; V360-S364 PolarHBondContact O-OG 3.45Å; E361-S364 PolarHBondContact O-N 3.28Å; S364-R366 PolarHBondContact O-N 3.39Å; S364-L367 CarbonylContact O-C 3.59Å; S364-L367 WeakPolarHBondContact O-CA 3.44Å; S364-L367 PolarHBondContact O-N 3.06Å; S364-L367 VanDerWaalsContact O-N 3.1Å; S364-G368 PolarHBondContact O-N 3.04Å; S364-A369 VanDerWaalsContact O-CB 3.29Å; S364-A369 WeakPolarHBondContact O-CB 3.14Å; S364-A369 PolarHBondContact O-N 3.42Å; S364-Y373 VanDerWaalsContact CB-CB 3.45Å
365	R	95.4	Very high	93.2	Very high	105 Å²	105	47.6 Å²	47.6	40%	0.396	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-43.7	174.2	-77.4	-165.2	-179.5	115.9	5.8	112.4	E361 L367 G368 G370 D371	E361-R365 VanDerWaalsContact CG-NH1 3.26Å; E361-R365 WeakPolarHBondContact O-CG 3.21Å; E361-R365 PolarHBondContact O-N 3.42Å; E361-R365 IonicContact OE1-CZ 2.72Å; E361-R365 IonicContact OE1-NH1 2.84Å; E361-R365 PolarHBondContact OE1-NH1 3.01Å; E361-R365 IonicContact OE1-NH2 3.15Å; E361-R365 PolarHBondContact OE1-NH2 3.1Å; R365-L367 PolarHBondContact O-N 3.28Å; R365-G368 PolarHBondContact O-N 3.39Å; R365-G370 VanDerWaalsContact CG-O 3.31Å; R365-G370 WeakPolarHBondContact CG-O 3.45Å; R365-D371 IonicContact CZ-OD1 2.68Å; R365-D371 IonicContact NE-OD1 2.82Å; R365-D371 PolarHBondContact NE-OD1 2.98Å; R365-D371 IonicContact NH2-OD1 3.28Å; R365-D371 PolarHBondContact NH2-OD1 3.33Å; R365-D371 VanDerWaalsContact NH2-OD1 3.07Å
366	R	95.3	Very high	93.3	Very high	129 Å²	129	46.8 Å²	46.8	49%	0.487	23%	0.234	S	C	.	.	H	α-helix	trans	-63.5	-25.6	176	-72.4	178.7	61	143.2	0.1	113.4	D344 R362 Y363 S364 G368	D344-R366 VanDerWaalsContact CG-NH2 3.31Å; D344-R366 IonicContact OD1-CZ 3.84Å; D344-R366 IonicContact OD1-NE 3.19Å; D344-R366 PolarHBondContact OD1-NE 2.85Å; D344-R366 IonicContact OD1-NH1 3.34Å; D344-R366 IonicContact OD1-NH2 3.38Å; D344-R366 PolarHBondContact OD1-NH2 3.21Å; D344-R366 IonicContact OD2-CZ 3.62Å; D344-R366 IonicContact OD2-NE 2.67Å; D344-R366 PolarHBondContact OD2-NE 3.27Å; D344-R366 IonicContact OD2-NH2 2.68Å; D344-R366 PolarHBondContact OD2-NH2 3.46Å; R362-R366 WeakPolarHBondContact O-CG 3.4Å; R362-R366 PolarHBondContact O-N 3.22Å; Y363-R366 PolarHBondContact O-N 3.44Å; S364-R366 PolarHBondContact O-N 3.39Å; R366-G368 VanDerWaalsContact C-N 3.28Å
367	L	94.6	Very high	93.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	12.2	175	-66.6	165.4	0	0	0	112.8	F341 D344 Y345 L348 Y363 S364 R365 F376 P424 M427	F341-L367 HydrophobicContact CD2-CD2 3.48Å; F341-L367 VanDerWaalsContact CD2-CD2 3.48Å; F341-L367 HydrophobicContact CE2-CD2 3.46Å; F341-L367 VanDerWaalsContact CE2-CD2 3.46Å; F341-L367 HydrophobicContact CG-CD2 4.22Å; F341-L367 HydrophobicContact CZ-CD2 4.18Å; D344-L367 HydrophobicContact CB-CD2 4.06Å; D344-L367 HydrophobicContact CB-CG 4.21Å; Y345-L367 HydrophobicContact CD2-CD1 4.28Å; L348-L367 HydrophobicContact CB-CD1 4.2Å; L348-L367 HydrophobicContact CD2-CD1 3.57Å; Y363-L367 WeakPolarHBondContact O-CB 3.41Å; Y363-L367 WeakPolarHBondContact O-CD1 3.48Å; Y363-L367 WeakPolarHBondContact O-CG 3.21Å; Y363-L367 PolarHBondContact O-N 2.87Å; S364-L367 CarbonylContact O-C 3.59Å; S364-L367 WeakPolarHBondContact O-CA 3.44Å; S364-L367 PolarHBondContact O-N 3.06Å; S364-L367 VanDerWaalsContact O-N 3.1Å; R365-L367 PolarHBondContact O-N 3.28Å; L367-F376 HydrophobicContact CB-CE1 4.38Å; L367-F376 HydrophobicContact CD1-CE1 4.35Å; L367-P424 WeakPolarHBondContact O-CD 3.34Å; L367-M427 HydrophobicContact CB-CE 4.04Å; L367-M427 HydrophobicContact CD1-CE 3.9Å; L367-M427 HydrophobicContact CD2-CE 3.91Å; L367-M427 HydrophobicContact CG-CE 4.17Å
368	G	91.9	Very high	92.8	Very high	23 Å²	23	41.9 Å²	41.9	24%	0.237	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	2.2	173.3	0	0	0	0	0	115.2	S364 R365 R366 G370 R422	S364-G368 PolarHBondContact O-N 3.04Å; R365-G368 PolarHBondContact O-N 3.39Å; R366-G368 VanDerWaalsContact C-N 3.28Å; G368-G370 VanDerWaalsContact C-N 3.25Å; G368-G370 PolarHBondContact O-N 3.06Å; G368-R422 VanDerWaalsContact O-CB 3.25Å; G368-R422 WeakPolarHBondContact O-CB 3.28Å
369	A	91.1	Very high	92.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.			trans	-71.5	-19.1	-179.3	0	0	0	0	0	113.8	S364 D371 L372 F376 L419	S364-A369 VanDerWaalsContact O-CB 3.29Å; S364-A369 WeakPolarHBondContact O-CB 3.14Å; S364-A369 PolarHBondContact O-N 3.42Å; A369-D371 PolarHBondContact O-N 3Å; A369-L372 WeakPolarHBondContact O-CB 3.22Å; A369-L372 PolarHBondContact O-N 3.19Å; A369-F376 HydrophobicContact CB-CB 3.64Å; A369-F376 HydrophobicContact CB-CD1 3.65Å; A369-F376 HydrophobicContact CB-CD2 4.42Å; A369-F376 HydrophobicContact CB-CE1 4.43Å; A369-F376 HydrophobicContact CB-CG 3.64Å; A369-L419 HydrophobicContact CB-CD1 3.65Å
370	G	91.2	Very high	91.6	Very high	21 Å²	21	39.2 Å²	39.2	22%	0.216	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	53.8	-135.5	-176.7	0	0	0	0	0	112	R365 G368 L372 Y373	R365-G370 VanDerWaalsContact CG-O 3.31Å; R365-G370 WeakPolarHBondContact CG-O 3.45Å; G368-G370 VanDerWaalsContact C-N 3.25Å; G368-G370 PolarHBondContact O-N 3.06Å; G370-L372 PolarHBondContact O-N 2.97Å; G370-Y373 PolarHBondContact O-N 3.42Å
371	D	90	Very high	91.1	Very high	116 Å²	116	39.6 Å²	39.6	62%	0.62	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-77.3	-8.3	179	-57.9	-42.8	0	0	0	113.5	R365 A369 Y373 P374	R365-D371 IonicContact CZ-OD1 2.68Å; R365-D371 IonicContact NE-OD1 2.82Å; R365-D371 PolarHBondContact NE-OD1 2.98Å; R365-D371 IonicContact NH2-OD1 3.28Å; R365-D371 PolarHBondContact NH2-OD1 3.33Å; R365-D371 VanDerWaalsContact NH2-OD1 3.07Å; A369-D371 PolarHBondContact O-N 3Å; D371-Y373 PolarHBondContact O-N 3.06Å; D371-P374 WeakPolarHBondContact O-CD 3.29Å
372	L	90.3	Very high	90.3	Very high	34 Å²	34	37.1 Å²	37.1	18%	0.178	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-80.9	16.9	171.1	-57.3	176.4	0	0	0	112.3	A369 G370 P374 L375 F376 Q415 D418 L419	A369-L372 WeakPolarHBondContact O-CB 3.22Å; A369-L372 PolarHBondContact O-N 3.19Å; G370-L372 PolarHBondContact O-N 2.97Å; L372-P374 VanDerWaalsContact C-N 3.3Å; L372-L375 PolarHBondContact O-N 3.41Å; L372-F376 WeakPolarHBondContact O-CB 3.46Å; L372-F376 PolarHBondContact O-N 2.88Å; L372-Q415 HydrophobicContact CD2-CB 4.32Å; L372-Q415 HydrophobicContact CD2-CG 4.48Å; L372-D418 HydrophobicContact CD1-CB 4.32Å; L372-L419 HydrophobicContact CB-CB 4.49Å; L372-L419 HydrophobicContact CB-CD1 4.24Å; L372-L419 HydrophobicContact CD1-CB 3.9Å
373	Y	92.8	Very high	89.7	Confident	45 Å²	45	30.6 Å²	30.6	18%	0.176	16%	0.157	C	C	.	.	H	α-helix	trans	-54.3	-34.6	178.6	83.8	-92.3	0	0	0	114.9	V360 E361 S364 G370 D371 F376 A377 W385	V360-Y373 HydrophobicContact CG1-CD2 4.24Å; E361-Y373 HydrophobicContact CB-CD1 4.31Å; E361-Y373 HydrophobicContact CB-CD2 3.9Å; E361-Y373 HydrophobicContact CB-CE1 4.22Å; E361-Y373 HydrophobicContact CB-CE2 3.75Å; E361-Y373 HydrophobicContact CB-CG 4.18Å; E361-Y373 HydrophobicContact CG-CD1 3.83Å; E361-Y373 HydrophobicContact CG-CD2 4.34Å; E361-Y373 HydrophobicContact CG-CE1 3.75Å; E361-Y373 HydrophobicContact CG-CE2 4.22Å; E361-Y373 HydrophobicContact CG-CG 4.16Å; S364-Y373 VanDerWaalsContact CB-CB 3.45Å; G370-Y373 PolarHBondContact O-N 3.42Å; D371-Y373 PolarHBondContact O-N 3.06Å; Y373-F376 PolarHBondContact O-N 3.44Å; Y373-A377 WeakPolarHBondContact O-CB 3.37Å; Y373-A377 PolarHBondContact O-N 3.44Å; Y373-W385 HydrophobicContact CD2-CH2 4.46Å; Y373-W385 AromaticContact CE2-CH2 3.84Å; Y373-W385 HydrophobicContact CE2-CH2 3.84Å
374	P	90.4	Very high	89.2	Confident	40 Å²	40	30.1 Å²	30.1	26%	0.26	16%	0.157	S	C	.	.	H	α-helix	trans	-67.4	-46.3	179.2	-20.5	35.3	0	0	0	111	D371 L372 F376 A377 C378 W385	D371-P374 WeakPolarHBondContact O-CD 3.29Å; L372-P374 VanDerWaalsContact C-N 3.3Å; P374-F376 VanDerWaalsContact C-N 3.33Å; P374-F376 PolarHBondContact O-N 3.01Å; P374-A377 PolarHBondContact O-N 2.9Å; P374-C378 PolarHBondContact O-N 3.46Å; P374-C378 VanDerWaalsContact O-N 3.08Å; P374-C378 PolarHBondContact O-SG 3.45Å; P374-C378 VanDerWaalsContact O-SG 3.32Å; P374-W385 HydrophobicContact CB-CD2 4.28Å; P374-W385 HydrophobicContact CB-CE3 3.85Å; P374-W385 HydrophobicContact CB-CH2 3.73Å; P374-W385 HydrophobicContact CB-CZ2 4.14Å; P374-W385 HydrophobicContact CB-CZ3 3.59Å; P374-W385 HydrophobicContact CG-CH2 4.21Å
375	L	87.5	Confident	88.9	Confident	30 Å²	30	34.2 Å²	34.2	16%	0.157	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-43.7	176.1	-179.9	61.2	0	0	0	110.9	L372 A377 C378 V379 Y412 Q415 I416 L419	L372-L375 PolarHBondContact O-N 3.41Å; L375-A377 VanDerWaalsContact C-N 3.34Å; L375-A377 PolarHBondContact O-N 2.93Å; L375-C378 PolarHBondContact O-N 3.24Å; L375-V379 HydrophobicContact CD1-CG2 4.2Å; L375-V379 HydrophobicContact CG-CG2 4.4Å; L375-V379 WeakPolarHBondContact O-CG2 3.4Å; L375-V379 PolarHBondContact O-N 3.39Å; L375-Y412 HydrophobicContact CD1-CD2 4.41Å; L375-Y412 HydrophobicContact CD1-CG 4.19Å; L375-Q415 HydrophobicContact CD2-CB 3.48Å; L375-Q415 VanDerWaalsContact CD2-CB 3.48Å; L375-I416 HydrophobicContact CD1-CG1 4.05Å; L375-I416 HydrophobicContact CD2-CG1 3.91Å; L375-I416 HydrophobicContact CG-CG1 4.24Å; L375-L419 HydrophobicContact CG-CD2 4.31Å
376	F	89.1	Confident	88.5	Confident	1 Å²	1	34.4 Å²	34.4	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-43.1	176.7	179	-117.9	0	0	0	112.7	L348 L367 A369 L372 Y373 P374 V379 L380 L419 V423 M427	L348-F376 HydrophobicContact CD2-CD1 4.33Å; L348-F376 HydrophobicContact CD2-CE1 3.54Å; L348-F376 HydrophobicContact CD2-CZ 4.31Å; L367-F376 HydrophobicContact CB-CE1 4.38Å; L367-F376 HydrophobicContact CD1-CE1 4.35Å; A369-F376 HydrophobicContact CB-CB 3.64Å; A369-F376 HydrophobicContact CB-CD1 3.65Å; A369-F376 HydrophobicContact CB-CD2 4.42Å; A369-F376 HydrophobicContact CB-CE1 4.43Å; A369-F376 HydrophobicContact CB-CG 3.64Å; L372-F376 WeakPolarHBondContact O-CB 3.46Å; L372-F376 PolarHBondContact O-N 2.88Å; Y373-F376 PolarHBondContact O-N 3.44Å; P374-F376 VanDerWaalsContact C-N 3.33Å; P374-F376 PolarHBondContact O-N 3.01Å; F376-V379 PolarHBondContact O-N 2.7Å; F376-L380 HydrophobicContact CE1-CD2 4.39Å; F376-L380 HydrophobicContact CZ-CD2 4.27Å; F376-L380 WeakPolarHBondContact O-CB 3.46Å; F376-L380 PolarHBondContact O-N 3.39Å; F376-L419 HydrophobicContact CB-CD1 3.79Å; F376-L419 HydrophobicContact CB-CD2 3.75Å; F376-L419 HydrophobicContact CB-CG 4.4Å; F376-L419 HydrophobicContact CD2-CD1 4Å; F376-L419 HydrophobicContact CD2-CD2 4.02Å; F376-L419 HydrophobicContact CD2-CG 4.34Å; F376-L419 HydrophobicContact CG-CD1 4.12Å; F376-L419 HydrophobicContact CG-CD2 4.37Å; F376-V423 HydrophobicContact CD2-CG1 4.4Å; F376-V423 HydrophobicContact CE2-CG1 4.24Å; F376-M427 HydrophobicContact CE1-CE 4.49Å; F376-M427 HydrophobicContact CE2-CE 4.3Å; F376-M427 HydrophobicContact CE2-CG 3.93Å; F376-M427 HydrophobicContact CE2-SD 3.94Å; F376-M427 HydrophobicContact CZ-CE 3.55Å; F376-M427 HydrophobicContact CZ-CG 4.12Å; F376-M427 HydrophobicContact CZ-SD 3.71Å
377	A	89.4	Confident	88	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-43	175.7	0	0	0	0	0	112.1	L352 V360 Y373 P374 L375 T381 W385 V388	L352-A377 HydrophobicContact CD2-CB 3.8Å; V360-A377 HydrophobicContact CG1-CB 3.92Å; Y373-A377 WeakPolarHBondContact O-CB 3.37Å; Y373-A377 PolarHBondContact O-N 3.44Å; P374-A377 PolarHBondContact O-N 2.9Å; L375-A377 VanDerWaalsContact C-N 3.34Å; L375-A377 PolarHBondContact O-N 2.93Å; A377-T381 WeakPolarHBondContact O-CB 3.38Å; A377-T381 WeakPolarHBondContact O-CG2 3.29Å; A377-T381 PolarHBondContact O-N 3.23Å; A377-T381 PolarHBondContact O-OG1 2.94Å; A377-W385 HydrophobicContact CB-CZ3 4.22Å; A377-V388 HydrophobicContact CB-CG1 4.05Å; A377-V388 HydrophobicContact CB-CG2 4.41Å
378	C	86.1	Confident	87.7	Confident	27 Å²	27	28.2 Å²	28.2	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-47	176.7	-65	0	0	0	0	111.9	P374 L375 L380 T381 A382 R383	P374-C378 PolarHBondContact O-N 3.46Å; P374-C378 VanDerWaalsContact O-N 3.08Å; P374-C378 PolarHBondContact O-SG 3.45Å; P374-C378 VanDerWaalsContact O-SG 3.32Å; L375-C378 PolarHBondContact O-N 3.24Å; C378-L380 PolarHBondContact O-N 3.23Å; C378-T381 PolarHBondContact O-N 3.49Å; C378-A382 VanDerWaalsContact O-CA 3.3Å; C378-A382 WeakPolarHBondContact O-CA 3.27Å; C378-A382 PolarHBondContact O-N 2.9Å; C378-R383 WeakPolarHBondContact CA-O 3.15Å; C378-R383 WeakPolarHBondContact CB-O 3.29Å; C378-R383 PolarHBondContact O-N 3.39Å
379	V	82.4	Confident	87.5	Confident	27 Å²	27	29.6 Å²	29.6	16%	0.164	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-44.6	178.1	170.9	0	0	0	0	111.1	L375 F376 I416 L431	L375-V379 HydrophobicContact CD1-CG2 4.2Å; L375-V379 HydrophobicContact CG-CG2 4.4Å; L375-V379 WeakPolarHBondContact O-CG2 3.4Å; L375-V379 PolarHBondContact O-N 3.39Å; F376-V379 PolarHBondContact O-N 2.7Å; V379-I416 HydrophobicContact CG2-CG1 4.38Å; V379-L431 HydrophobicContact CG1-CD2 4.45Å
380	L	85.4	Confident	87.2	Confident	2 Å²	2	32 Å²	32	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-65.3	-40.5	-178.6	177.8	62.5	0	0	0	112.6	Y345 L348 W349 L352 F376 C378 L431	Y345-L380 HydrophobicContact CE2-CD1 3.79Å; Y345-L380 HydrophobicContact CE2-CD2 4.02Å; L348-L380 HydrophobicContact CD2-CD2 3.57Å; L348-L380 HydrophobicContact CG-CD2 4.26Å; W349-L380 HydrophobicContact CZ2-CD1 4.02Å; W349-L380 HydrophobicContact CZ2-CD2 4.31Å; W349-L380 HydrophobicContact CZ2-CG 3.81Å; L352-L380 HydrophobicContact CD1-CD2 4.05Å; F376-L380 HydrophobicContact CE1-CD2 4.39Å; F376-L380 HydrophobicContact CZ-CD2 4.27Å; F376-L380 WeakPolarHBondContact O-CB 3.46Å; F376-L380 PolarHBondContact O-N 3.39Å; C378-L380 PolarHBondContact O-N 3.23Å; L380-L431 HydrophobicContact CB-CD2 4.45Å; L380-L431 HydrophobicContact CD1-CD2 3.79Å
381	T	84	Confident	86.8	Confident	9 Å²	9	31 Å²	31	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-91.7	-17.2	-175.2	59	0	0	0	0	113.3	W349 L352 A377 C378 R383 I392	W349-T381 HydrophobicContact CH2-CG2 4.12Å; W349-T381 HydrophobicContact CZ3-CG2 4.17Å; L352-T381 HydrophobicContact CB-CG2 4.47Å; L352-T381 HydrophobicContact CD1-CG2 3.64Å; L352-T381 HydrophobicContact CD2-CG2 4.1Å; L352-T381 HydrophobicContact CG-CG2 4.29Å; A377-T381 WeakPolarHBondContact O-CB 3.38Å; A377-T381 WeakPolarHBondContact O-CG2 3.29Å; A377-T381 PolarHBondContact O-N 3.23Å; A377-T381 PolarHBondContact O-OG1 2.94Å; C378-T381 PolarHBondContact O-N 3.49Å; T381-R383 WeakPolarHBondContact O-CG 3.13Å; T381-R383 PolarHBondContact O-N 2.89Å; T381-R383 WeakPolarHBondContact OG1-CB 3.45Å; T381-R383 PolarHBondContact OG1-N 3.22Å; T381-I392 HydrophobicContact CG2-CD1 4.03Å; T381-I392 HydrophobicContact CG2-CG2 4.19Å
382	A	80.6	Confident	86.3	Confident	6 Å²	6	25.5 Å²	25.5	5%	0.05	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	39.7	-167.2	0	0	0	0	0	112.2	C378 I405 R447	C378-A382 VanDerWaalsContact O-CA 3.3Å; C378-A382 WeakPolarHBondContact O-CA 3.27Å; C378-A382 PolarHBondContact O-N 2.9Å; A382-I405 WeakPolarHBondContact O-CD1 3.47Å; A382-R447 PolarHBondContact O-NH2 2.95Å
383	R	84.5	Confident	85.7	Confident	5 Å²	5	25.4 Å²	25.4	2%	0.019	15%	0.145	C	C	.	.			trans	-125.3	156.3	-179.8	-58.2	-56.9	-60.7	-98.3	4.3	110.5	C378 T381 A387 V388 I392 V395 P396 E401	C378-R383 WeakPolarHBondContact CA-O 3.15Å; C378-R383 WeakPolarHBondContact CB-O 3.29Å; C378-R383 PolarHBondContact O-N 3.39Å; T381-R383 WeakPolarHBondContact O-CG 3.13Å; T381-R383 PolarHBondContact O-N 2.89Å; T381-R383 WeakPolarHBondContact OG1-CB 3.45Å; T381-R383 PolarHBondContact OG1-N 3.22Å; R383-A387 HydrophobicContact CB-CB 3.98Å; R383-V388 HydrophobicContact CB-CG2 4.46Å; R383-I392 HydrophobicContact CB-CG2 4.36Å; R383-I392 HydrophobicContact CG-CB 4.34Å; R383-I392 HydrophobicContact CG-CG2 4.07Å; R383-I392 PolarHBondContact NH1-O 2.94Å; R383-V395 PolarHBondContact NH1-O 2.58Å; R383-V395 PolarHBondContact NH2-O 3.45Å; R383-P396 PolarHBondContact NH2-O 3.28Å; R383-E401 WeakPolarHBondContact CA-OE1 3.23Å; R383-E401 IonicContact CZ-OE1 3.62Å; R383-E401 IonicContact CZ-OE2 3.48Å; R383-E401 IonicContact NE-OE1 2.83Å; R383-E401 PolarHBondContact NE-OE1 3.47Å; R383-E401 IonicContact NE-OE2 3.18Å; R383-E401 PolarHBondContact NE-OE2 3.5Å; R383-E401 IonicContact NH2-OE1 3.51Å; R383-E401 IonicContact NH2-OE2 3.02Å; R383-E401 PolarHBondContact NH2-OE2 2.95Å
384	S	86.4	Confident	84.8	Confident	12 Å²	12	27.2 Å²	27.2	8%	0.084	16%	0.164	C	C	.	.			trans	-68.6	159.2	173.5	69.6	0	0	0	0	111	N386 A387 V388 E401	S384-N386 PolarHBondContact O-N 3.34Å; S384-A387 PolarHBondContact O-N 2.92Å; S384-A387 VanDerWaalsContact O-N 3.08Å; S384-A387 PolarHBondContact OG-N 3.26Å; S384-V388 PolarHBondContact O-N 3.21Å; S384-E401 PolarHBondContact N-OE1 2.97Å
385	W	87.8	Confident	84.1	Confident	85 Å²	85	27.7 Å²	27.7	32%	0.322	17%	0.166	S	C	.	.	H	α-helix	trans	-58.8	-36.2	176.2	-175.5	-116.3	0	0	0	111.8	L357 Y373 P374 A377 A387 V388 T389	L357-W385 HydrophobicContact CD2-CH2 4.14Å; L357-W385 HydrophobicContact CD2-CZ2 4.22Å; Y373-W385 HydrophobicContact CD2-CH2 4.46Å; Y373-W385 AromaticContact CE2-CH2 3.84Å; Y373-W385 HydrophobicContact CE2-CH2 3.84Å; P374-W385 HydrophobicContact CB-CD2 4.28Å; P374-W385 HydrophobicContact CB-CE3 3.85Å; P374-W385 HydrophobicContact CB-CH2 3.73Å; P374-W385 HydrophobicContact CB-CZ2 4.14Å; P374-W385 HydrophobicContact CB-CZ3 3.59Å; P374-W385 HydrophobicContact CG-CH2 4.21Å; A377-W385 HydrophobicContact CB-CZ3 4.22Å; W385-A387 PolarHBondContact O-N 3.14Å; W385-V388 HydrophobicContact CE3-CB 4.07Å; W385-V388 HydrophobicContact CE3-CG1 3.99Å; W385-V388 HydrophobicContact CH2-CG1 4.45Å; W385-V388 HydrophobicContact CZ3-CB 4.31Å; W385-V388 HydrophobicContact CZ3-CG1 3.7Å; W385-V388 WeakPolarHBondContact O-CB 3.48Å; W385-V388 PolarHBondContact O-N 3.36Å; W385-T389 HydrophobicContact CD2-CG2 4.17Å; W385-T389 HydrophobicContact CG-CG2 4.37Å; W385-T389 HydrophobicContact CZ2-CG2 4.04Å; W385-T389 VanDerWaalsContact O-CG2 3.29Å; W385-T389 WeakPolarHBondContact O-CG2 3.33Å; W385-T389 PolarHBondContact O-N 3.28Å; W385-T389 PolarHBondContact O-OG1 2.86Å
386	N	87.4	Confident	83.5	Confident	109 Å²	109	31 Å²	31	58%	0.583	19%	0.189	S	C	*	.	H	α-helix	trans	-58.7	-46.6	174.5	-68.6	-21.1	0	0	0	111.6	S384 V388 T389 A390	S384-N386 PolarHBondContact O-N 3.34Å; N386-V388 VanDerWaalsContact C-N 3.34Å; N386-V388 PolarHBondContact O-N 3.36Å; N386-T389 PolarHBondContact O-N 3.04Å; N386-T389 PolarHBondContact O-OG1 2.76Å; N386-A390 WeakPolarHBondContact O-CB 3.44Å; N386-A390 PolarHBondContact O-N 2.86Å
387	A	86	Confident	82.9	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-36.4	176.3	0	0	0	0	0	112.6	R383 S384 W385 G391 I392 V395 E401	R383-A387 HydrophobicContact CB-CB 3.98Å; S384-A387 PolarHBondContact O-N 2.92Å; S384-A387 VanDerWaalsContact O-N 3.08Å; S384-A387 PolarHBondContact OG-N 3.26Å; W385-A387 PolarHBondContact O-N 3.14Å; A387-G391 CarbonylContact O-C 3.59Å; A387-G391 PolarHBondContact O-N 3.42Å; A387-G391 VanDerWaalsContact O-N 3.13Å; A387-I392 PolarHBondContact O-N 2.7Å; A387-V395 HydrophobicContact CB-CB 4.22Å; A387-V395 HydrophobicContact CB-CG1 4.37Å; A387-E401 WeakPolarHBondContact CB-OE1 3.39Å
388	V	86.6	Confident	82.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-45.6	174.1	171.4	0	0	0	0	111.3	L352 A377 R383 S384 W385 N386 G391 I392	L352-V388 HydrophobicContact CD2-CG1 3.8Å; A377-V388 HydrophobicContact CB-CG1 4.05Å; A377-V388 HydrophobicContact CB-CG2 4.41Å; R383-V388 HydrophobicContact CB-CG2 4.46Å; S384-V388 PolarHBondContact O-N 3.21Å; W385-V388 HydrophobicContact CE3-CB 4.07Å; W385-V388 HydrophobicContact CE3-CG1 3.99Å; W385-V388 HydrophobicContact CH2-CG1 4.45Å; W385-V388 HydrophobicContact CZ3-CB 4.31Å; W385-V388 HydrophobicContact CZ3-CG1 3.7Å; W385-V388 WeakPolarHBondContact O-CB 3.48Å; W385-V388 PolarHBondContact O-N 3.36Å; N386-V388 VanDerWaalsContact C-N 3.34Å; N386-V388 PolarHBondContact O-N 3.36Å; V388-G391 PolarHBondContact O-N 2.84Å; V388-I392 HydrophobicContact CG2-CG2 4.19Å
389	T	88.8	Confident	81.7	Confident	51 Å²	51	42.4 Å²	42.4	31%	0.313	25%	0.246	S	C	.	.	H	α-helix	trans	-67.3	-39	-179.6	61.8	0	0	0	0	113	L357 W385 N386 G391	L357-T389 HydrophobicContact CD1-CG2 4.27Å; L357-T389 HydrophobicContact CD2-CG2 3.93Å; W385-T389 HydrophobicContact CD2-CG2 4.17Å; W385-T389 HydrophobicContact CG-CG2 4.37Å; W385-T389 HydrophobicContact CZ2-CG2 4.04Å; W385-T389 VanDerWaalsContact O-CG2 3.29Å; W385-T389 WeakPolarHBondContact O-CG2 3.33Å; W385-T389 PolarHBondContact O-N 3.28Å; W385-T389 PolarHBondContact O-OG1 2.86Å; N386-T389 PolarHBondContact O-N 3.04Å; N386-T389 PolarHBondContact O-OG1 2.76Å; T389-G391 PolarHBondContact O-N 3.43Å
390	A	84.5	Confident	81.4	Confident	52 Å²	52	44.5 Å²	44.5	43%	0.43	27%	0.267	S	S	.	.	H	α-helix	trans	-75.6	-10.9	177	0	0	0	0	0	113.6	N386 S394 V395	N386-A390 WeakPolarHBondContact O-CB 3.44Å; N386-A390 PolarHBondContact O-N 2.86Å; A390-S394 WeakPolarHBondContact O-CB 3.25Å; A390-S394 PolarHBondContact O-OG 3.39Å; A390-V395 HydrophobicContact CB-CG2 3.65Å
391	G	83.2	Confident	81.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.268	C	S	.	.			trans	88.2	122.6	-167.8	0	0	0	0	0	111.2	L352 A387 V388 T389 S393 S394	L352-G391 WeakPolarHBondContact O-CA 3.46Å; A387-G391 CarbonylContact O-C 3.59Å; A387-G391 PolarHBondContact O-N 3.42Å; A387-G391 VanDerWaalsContact O-N 3.13Å; V388-G391 PolarHBondContact O-N 2.84Å; T389-G391 PolarHBondContact O-N 3.43Å; G391-S393 PolarHBondContact O-N 3.05Å; G391-S394 WeakPolarHBondContact O-CB 3.21Å; G391-S394 PolarHBondContact O-N 2.93Å; G391-S394 PolarHBondContact O-OG 3.19Å
392	I	79.9	Confident	80.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21	-168.8	62.1	177.3	0	0	0	114.3	W349 L352 I353 T381 R383 A387 V388 F453	W349-I392 HydrophobicContact CE3-CD1 4.04Å; W349-I392 HydrophobicContact CZ3-CD1 3.62Å; L352-I392 HydrophobicContact CB-CD1 4.16Å; L352-I392 PolarHBondContact O-N 3.47Å; L352-I392 VanDerWaalsContact O-N 3.14Å; I353-I392 HydrophobicContact CG1-CD1 4.1Å; I353-I392 HydrophobicContact CG1-CG1 4.15Å; T381-I392 HydrophobicContact CG2-CD1 4.03Å; T381-I392 HydrophobicContact CG2-CG2 4.19Å; R383-I392 HydrophobicContact CB-CG2 4.36Å; R383-I392 HydrophobicContact CG-CB 4.34Å; R383-I392 HydrophobicContact CG-CG2 4.07Å; R383-I392 PolarHBondContact NH1-O 2.94Å; A387-I392 PolarHBondContact O-N 2.7Å; V388-I392 HydrophobicContact CG2-CG2 4.19Å; I392-F453 HydrophobicContact CD1-CD1 3.75Å; I392-F453 HydrophobicContact CD1-CE1 3.63Å; I392-F453 HydrophobicContact CD1-CZ 4.5Å; I392-F453 HydrophobicContact CG1-CD1 4.28Å; I392-F453 HydrophobicContact CG1-CE1 4.29Å
393	S	76.3	Confident	79.9	Confident	32 Å²	32	49.1 Å²	49.1	22%	0.224	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-18.9	174.7	55.7	0	0	0	0	113.7	I353 G391 Y495	I353-S393 PolarHBondContact O-OG 3.49Å; G391-S393 PolarHBondContact O-N 3.05Å; S393-Y495 PolarHBondContact O-OH 3.38Å
394	S	74.4	Confident	79.4	Confident	82 Å²	82	52.7 Å²	52.7	57%	0.573	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-25.5	-175.6	-52.2	0	0	0	0	112.3	A390 G391	A390-S394 WeakPolarHBondContact O-CB 3.25Å; A390-S394 PolarHBondContact O-OG 3.39Å; G391-S394 WeakPolarHBondContact O-CB 3.21Å; G391-S394 PolarHBondContact O-N 2.93Å; G391-S394 PolarHBondContact O-OG 3.19Å
395	V	76.7	Confident	78.8	Confident	51 Å²	51	53.9 Å²	53.9	31%	0.309	31%	0.314	S	S	.	.	S	Bend	trans	-108.1	125.1	-176.4	-175.6	0	0	0	0	109.6	R383 A387 A390	R383-V395 PolarHBondContact NH1-O 2.58Å; R383-V395 PolarHBondContact NH2-O 3.45Å; A387-V395 HydrophobicContact CB-CB 4.22Å; A387-V395 HydrophobicContact CB-CG1 4.37Å; A390-V395 HydrophobicContact CB-CG2 3.65Å
396	P	74.5	Confident	77.8	Confident	98 Å²	98	57.3 Å²	57.3	64%	0.636	33%	0.327	S	S	*	.			trans	-65	147.3	176.5	28.5	-34.3	0	0	0	110.9	R383	R383-P396 PolarHBondContact NH2-O 3.28Å
397	V	76.1	Confident	76.8	Confident	34 Å²	34	56.4 Å²	56.4	21%	0.206	33%	0.326	C	S	.	.			trans	-72.6	128.3	172.8	-178.4	0	0	0	0	108.4
398	T	77.1	Confident	76	Confident	65 Å²	65	59 Å²	59	40%	0.399	34%	0.339	S	S	.	.			trans	-123.7	155.4	-180	67.8	0	0	0	0	111.8	A400 E401 D402	T398-A400 VanDerWaalsContact C-N 3.25Å; T398-A400 PolarHBondContact O-N 3.47Å; T398-E401 WeakPolarHBondContact O-CB 3.03Å; T398-E401 PolarHBondContact O-N 3.03Å; T398-E401 WeakPolarHBondContact OG1-CB 3.39Å; T398-E401 PolarHBondContact OG1-N 3.05Å; T398-D402 PolarHBondContact O-N 3.42Å
399	Q	72.3	Confident	74.9	Confident	169 Å²	169	60.3 Å²	60.3	79%	0.79	35%	0.35	S	S	*	.	H	α-helix	trans	-64.1	-32.1	175.3	-72.6	-176.6	-2.9	0	0	112.5	E401 D402 V403	Q399-E401 VanDerWaalsContact C-N 3.35Å; Q399-D402 WeakPolarHBondContact O-CB 3.3Å; Q399-D402 PolarHBondContact O-N 3.12Å; Q399-V403 WeakPolarHBondContact O-CG2 3.38Å; Q399-V403 PolarHBondContact O-N 3.29Å; Q399-V403 VanDerWaalsContact O-N 3.13Å
400	A	76.8	Confident	73.5	Confident	71 Å²	71	61 Å²	61	59%	0.587	36%	0.361	S	S	*	.	H	α-helix	trans	-64.1	-40.9	176.2	0	0	0	0	0	111.6	T398 D402 V403 E404	T398-A400 VanDerWaalsContact C-N 3.25Å; T398-A400 PolarHBondContact O-N 3.47Å; A400-D402 VanDerWaalsContact C-N 3.32Å; A400-D402 PolarHBondContact O-N 3.43Å; A400-V403 PolarHBondContact O-N 3.41Å; A400-E404 PolarHBondContact O-N 3.31Å
401	E	78.5	Confident	72.7	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-41.8	174.2	-174.3	-179.2	-167.7	0	0	111.4	R383 S384 A387 T398 Q399 V403 E404 I405	R383-E401 WeakPolarHBondContact CA-OE1 3.23Å; R383-E401 IonicContact CZ-OE1 3.62Å; R383-E401 IonicContact CZ-OE2 3.48Å; R383-E401 IonicContact NE-OE1 2.83Å; R383-E401 PolarHBondContact NE-OE1 3.47Å; R383-E401 IonicContact NE-OE2 3.18Å; R383-E401 PolarHBondContact NE-OE2 3.5Å; R383-E401 IonicContact NH2-OE1 3.51Å; R383-E401 IonicContact NH2-OE2 3.02Å; R383-E401 PolarHBondContact NH2-OE2 2.95Å; S384-E401 PolarHBondContact N-OE1 2.97Å; A387-E401 WeakPolarHBondContact CB-OE1 3.39Å; T398-E401 WeakPolarHBondContact O-CB 3.03Å; T398-E401 PolarHBondContact O-N 3.03Å; T398-E401 WeakPolarHBondContact OG1-CB 3.39Å; T398-E401 PolarHBondContact OG1-N 3.05Å; Q399-E401 VanDerWaalsContact C-N 3.35Å; E401-V403 VanDerWaalsContact C-N 3.34Å; E401-V403 PolarHBondContact O-N 3.2Å; E401-E404 PolarHBondContact O-N 3.41Å; E401-I405 HydrophobicContact CG-CD1 3.95Å; E401-I405 VanDerWaalsContact O-CG1 3.25Å; E401-I405 WeakPolarHBondContact O-CG1 3.34Å; E401-I405 PolarHBondContact O-N 3.12Å
402	D	68.8	Low	72	Confident	30 Å²	30	69.4 Å²	69.4	16%	0.16	39%	0.391	C	S	.	.	H	α-helix	trans	-64	-37.5	176.8	-82.5	-23.2	0	0	0	113.2	T398 Q399 A400 R406 R447	T398-D402 PolarHBondContact O-N 3.42Å; Q399-D402 WeakPolarHBondContact O-CB 3.3Å; Q399-D402 PolarHBondContact O-N 3.12Å; A400-D402 VanDerWaalsContact C-N 3.32Å; A400-D402 PolarHBondContact O-N 3.43Å; D402-R406 WeakPolarHBondContact O-CG 3.35Å; D402-R406 PolarHBondContact O-N 2.95Å; D402-R447 IonicContact OD1-CZ 3.78Å; D402-R447 IonicContact OD1-NH1 2.82Å; D402-R447 PolarHBondContact OD1-NH1 3.41Å; D402-R447 IonicContact OD1-NH2 2.71Å; D402-R447 PolarHBondContact OD1-NH2 3Å; D402-R447 IonicContact OD2-CZ 2.8Å; D402-R447 IonicContact OD2-NH1 3.31Å; D402-R447 PolarHBondContact OD2-NH1 2.93Å
403	V	70.9	Confident	71.3	Confident	74 Å²	74	73 Å²	73	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-66.9	-47	174.9	174.1	0	0	0	0	110.2	Q399 A400 E401 I405 R406 T407	Q399-V403 WeakPolarHBondContact O-CG2 3.38Å; Q399-V403 PolarHBondContact O-N 3.29Å; Q399-V403 VanDerWaalsContact O-N 3.13Å; A400-V403 PolarHBondContact O-N 3.41Å; E401-V403 VanDerWaalsContact C-N 3.34Å; E401-V403 PolarHBondContact O-N 3.2Å; V403-I405 PolarHBondContact O-N 3.44Å; V403-R406 PolarHBondContact O-N 3.29Å; V403-T407 WeakPolarHBondContact O-CB 3.36Å; V403-T407 PolarHBondContact O-N 3.35Å; V403-T407 PolarHBondContact O-OG1 2.87Å
404	E	74.9	Confident	70.9	Confident	80 Å²	80	75.7 Å²	75.7	37%	0.374	43%	0.427	S	S	.	.	H	α-helix	trans	-55.6	-49.6	177.3	-177	-168.2	158.5	0	0	111.4	A400 E401 R406 T407 N408	A400-E404 PolarHBondContact O-N 3.31Å; E401-E404 PolarHBondContact O-N 3.41Å; E404-R406 PolarHBondContact O-N 3.39Å; E404-T407 PolarHBondContact O-N 2.88Å; E404-N408 WeakPolarHBondContact CG-ND2 3.37Å; E404-N408 VanDerWaalsContact O-CB 3.23Å; E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 VanDerWaalsContact O-CG 3.25Å; E404-N408 PolarHBondContact O-N 2.94Å; E404-N408 PolarHBondContact O-ND2 3.46Å
405	I	72.9	Confident	71	Confident	37 Å²	37	75.4 Å²	75.4	19%	0.19	42%	0.416	C	S	.	.	H	α-helix	trans	-60.3	-45.6	179.9	-67.8	164.5	0	0	0	110.9	A382 E401 V403 N408 A409	A382-I405 WeakPolarHBondContact O-CD1 3.47Å; E401-I405 HydrophobicContact CG-CD1 3.95Å; E401-I405 VanDerWaalsContact O-CG1 3.25Å; E401-I405 WeakPolarHBondContact O-CG1 3.34Å; E401-I405 PolarHBondContact O-N 3.12Å; V403-I405 PolarHBondContact O-N 3.44Å; I405-N408 PolarHBondContact O-N 3.46Å; I405-A409 WeakPolarHBondContact O-CB 3.34Å; I405-A409 PolarHBondContact O-N 3.12Å
406	R	66.4	Low	70.9	Confident	157 Å²	157	73.3 Å²	73.3	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-64.7	-46.3	-179.8	-76.8	-169.6	-60.7	-100.4	-2.6	112.3	D402 V403 E404 N408 A409	D402-R406 WeakPolarHBondContact O-CG 3.35Å; D402-R406 PolarHBondContact O-N 2.95Å; V403-R406 PolarHBondContact O-N 3.29Å; E404-R406 PolarHBondContact O-N 3.39Å; R406-N408 VanDerWaalsContact C-N 3.33Å; R406-N408 PolarHBondContact O-N 2.77Å; R406-A409 PolarHBondContact O-N 2.93Å
407	T	67.3	Low	70.7	Confident	90 Å²	90	70.3 Å²	70.3	55%	0.552	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-43.5	179.3	-56.6	0	0	0	0	110.9	V403 E404	V403-T407 WeakPolarHBondContact O-CB 3.36Å; V403-T407 PolarHBondContact O-N 3.35Å; V403-T407 PolarHBondContact O-OG1 2.87Å; E404-T407 PolarHBondContact O-N 2.88Å
408	N	68.8	Low	70.7	Confident	55 Å²	55	71.4 Å²	71.4	29%	0.294	39%	0.389	S	S	.	.	H	α-helix	trans	-72.7	-32.5	179.7	-72.2	-18.6	0	0	0	112.7	E404 I405 R406 A410 L411 Y412	E404-N408 WeakPolarHBondContact CG-ND2 3.37Å; E404-N408 VanDerWaalsContact O-CB 3.23Å; E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 VanDerWaalsContact O-CG 3.25Å; E404-N408 PolarHBondContact O-N 2.94Å; E404-N408 PolarHBondContact O-ND2 3.46Å; I405-N408 PolarHBondContact O-N 3.46Å; R406-N408 VanDerWaalsContact C-N 3.33Å; R406-N408 PolarHBondContact O-N 2.77Å; N408-A410 VanDerWaalsContact C-N 3.26Å; N408-A410 PolarHBondContact O-N 3.28Å; N408-L411 WeakPolarHBondContact O-CB 3.41Å; N408-L411 PolarHBondContact O-N 2.95Å; N408-Y412 HydrophobicContact CB-CD2 4.28Å; N408-Y412 HydrophobicContact CB-CE2 4.01Å; N408-Y412 WeakPolarHBondContact O-CD2 3.47Å; N408-Y412 PolarHBondContact O-N 3.49Å
409	A	63.8	Low	70.9	Confident	28 Å²	28	68.4 Å²	68.4	23%	0.231	37%	0.371	C	S	.	.	H	α-helix	trans	-57.9	-38.4	179.4	0	0	0	0	0	112.4	I405 R406 L411 Y412 L413	I405-A409 WeakPolarHBondContact O-CB 3.34Å; I405-A409 PolarHBondContact O-N 3.12Å; R406-A409 PolarHBondContact O-N 2.93Å; A409-L411 VanDerWaalsContact C-N 3.27Å; A409-L411 PolarHBondContact O-N 3.35Å; A409-Y412 CarbonylContact O-C 3.11Å; A409-Y412 PolarHBondContact O-N 2.95Å; A409-Y412 VanDerWaalsContact O-N 3.14Å; A409-L413 PolarHBondContact O-N 2.82Å
410	A	60.3	Low	71.1	Confident	66 Å²	66	61 Å²	61	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-37	176.3	0	0	0	0	0	112.5	N408 Y412	N408-A410 VanDerWaalsContact C-N 3.26Å; N408-A410 PolarHBondContact O-N 3.28Å; A410-Y412 VanDerWaalsContact C-N 3.34Å
411	L	65.8	Low	71	Confident	121 Å²	121	60.7 Å²	60.7	63%	0.634	33%	0.325	S	S	*	.	H	α-helix	trans	-71	-29.5	177.5	-62.8	169.7	0	0	0	112.4	N408 A409	N408-L411 WeakPolarHBondContact O-CB 3.41Å; N408-L411 PolarHBondContact O-N 2.95Å; A409-L411 VanDerWaalsContact C-N 3.27Å; A409-L411 PolarHBondContact O-N 3.35Å
412	Y	69.4	Low	71.2	Confident	107 Å²	107	66.3 Å²	66.3	42%	0.42	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	6.5	-177.6	-63	-62.6	0	0	0	114.3	L375 N408 A409 A410 P414 Q415 I416	L375-Y412 HydrophobicContact CD1-CD2 4.41Å; L375-Y412 HydrophobicContact CD1-CG 4.19Å; N408-Y412 HydrophobicContact CB-CD2 4.28Å; N408-Y412 HydrophobicContact CB-CE2 4.01Å; N408-Y412 WeakPolarHBondContact O-CD2 3.47Å; N408-Y412 PolarHBondContact O-N 3.49Å; A409-Y412 CarbonylContact O-C 3.11Å; A409-Y412 PolarHBondContact O-N 2.95Å; A409-Y412 VanDerWaalsContact O-N 3.14Å; A410-Y412 VanDerWaalsContact C-N 3.34Å; Y412-P414 VanDerWaalsContact C-CD 3.46Å; Y412-P414 VanDerWaalsContact C-N 3.33Å; Y412-Q415 CarbonylContact O-C 3.6Å; Y412-Q415 PolarHBondContact O-N 3.26Å; Y412-Q415 PolarHBondContact O-OE1 2.84Å; Y412-I416 VanDerWaalsContact O-CG1 3.32Å; Y412-I416 WeakPolarHBondContact O-CG1 3.48Å; Y412-I416 PolarHBondContact O-N 3.07Å
413	L	66.1	Low	72	Confident	75 Å²	75	65.3 Å²	65.3	39%	0.393	34%	0.341	S	S	.	.	H	α-helix	trans	-49.2	-45	-178.2	-79.8	171.8	0	0	0	113.8	A409 Q415 I416 S417	A409-L413 PolarHBondContact O-N 2.82Å; L413-Q415 PolarHBondContact O-N 2.86Å; L413-I416 PolarHBondContact O-N 2.62Å; L413-S417 WeakPolarHBondContact O-CB 3.41Å; L413-S417 PolarHBondContact O-N 3.42Å
414	P	67.3	Low	72.8	Confident	90 Å²	90	64 Å²	64	58%	0.584	33%	0.334	S	S	*	.	H	α-helix	trans	-61.7	-43.5	176.5	-22.6	34.2	0	0	0	113	Y412 S417 D418	Y412-P414 VanDerWaalsContact C-CD 3.46Å; Y412-P414 VanDerWaalsContact C-N 3.33Å; P414-S417 PolarHBondContact O-N 2.68Å; P414-D418 PolarHBondContact O-N 2.93Å
415	Q	76.4	Confident	73	Confident	75 Å²	75	65.9 Å²	65.9	35%	0.35	34%	0.338	S	S	.	.	H	α-helix	trans	-70.5	-34.6	179.4	-62.8	85	-13.7	0	0	111.7	L372 L375 Y412 L413 D418 L419	L372-Q415 HydrophobicContact CD2-CB 4.32Å; L372-Q415 HydrophobicContact CD2-CG 4.48Å; L375-Q415 HydrophobicContact CD2-CB 3.48Å; L375-Q415 VanDerWaalsContact CD2-CB 3.48Å; Y412-Q415 CarbonylContact O-C 3.6Å; Y412-Q415 PolarHBondContact O-N 3.26Å; Y412-Q415 PolarHBondContact O-OE1 2.84Å; L413-Q415 PolarHBondContact O-N 2.86Å; Q415-D418 PolarHBondContact O-N 3.37Å; Q415-L419 WeakPolarHBondContact O-CB 3.33Å; Q415-L419 PolarHBondContact O-N 3.49Å
416	I	74.3	Confident	73.7	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-64.2	-44.3	173.1	-67.8	170.3	0	0	0	109.3	L375 V379 Y412 L413 L419 L420	L375-I416 HydrophobicContact CD1-CG1 4.05Å; L375-I416 HydrophobicContact CD2-CG1 3.91Å; L375-I416 HydrophobicContact CG-CG1 4.24Å; V379-I416 HydrophobicContact CG2-CG1 4.38Å; Y412-I416 VanDerWaalsContact O-CG1 3.32Å; Y412-I416 WeakPolarHBondContact O-CG1 3.48Å; Y412-I416 PolarHBondContact O-N 3.07Å; L413-I416 PolarHBondContact O-N 2.62Å; I416-L419 PolarHBondContact O-N 3.33Å; I416-L420 HydrophobicContact CG2-CD1 3.66Å; I416-L420 HydrophobicContact CG2-CG 4.28Å; I416-L420 WeakPolarHBondContact O-CB 3.43Å; I416-L420 WeakPolarHBondContact O-CG 3.33Å; I416-L420 PolarHBondContact O-N 3.33Å
417	S	70.4	Confident	74.8	Confident	34 Å²	34	58.2 Å²	58.2	24%	0.238	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-47.5	176.2	-176.7	0	0	0	0	111.8	L413 P414 L419 L420 N421	L413-S417 WeakPolarHBondContact O-CB 3.41Å; L413-S417 PolarHBondContact O-N 3.42Å; P414-S417 PolarHBondContact O-N 2.68Å; S417-L419 PolarHBondContact O-N 3.44Å; S417-L420 PolarHBondContact O-N 3.43Å; S417-N421 VanDerWaalsContact O-CG 3.31Å; S417-N421 PolarHBondContact O-N 2.96Å; S417-N421 PolarHBondContact O-ND2 3.49Å
418	D	75.8	Confident	75.4	Confident	57 Å²	57	55 Å²	55	31%	0.305	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-44.3	175.9	-179	37.5	0	0	0	112.2	L372 P414 Q415 L420 N421 R422	L372-D418 HydrophobicContact CD1-CB 4.32Å; P414-D418 PolarHBondContact O-N 2.93Å; Q415-D418 PolarHBondContact O-N 3.37Å; D418-L420 PolarHBondContact O-N 3.06Å; D418-N421 WeakPolarHBondContact O-CB 3.46Å; D418-N421 PolarHBondContact O-N 3.32Å; D418-R422 VanDerWaalsContact CG-NE 3.3Å; D418-R422 VanDerWaalsContact O-CG 3.32Å; D418-R422 WeakPolarHBondContact O-CG 3.21Å; D418-R422 PolarHBondContact O-N 3.36Å; D418-R422 VanDerWaalsContact O-N 3.13Å; D418-R422 IonicContact OD1-CZ 3.44Å; D418-R422 IonicContact OD1-NE 2.63Å; D418-R422 PolarHBondContact OD1-NE 2.96Å; D418-R422 IonicContact OD1-NH2 2.7Å; D418-R422 PolarHBondContact OD1-NH2 3.39Å; D418-R422 IonicContact OD2-CZ 3.06Å; D418-R422 IonicContact OD2-NE 3.96Å; D418-R422 PolarHBondContact OD2-NE 3.39Å; D418-R422 VanDerWaalsContact OD2-NE 3.11Å; D418-R422 IonicContact OD2-NH2 3.51Å; D418-R422 PolarHBondContact OD2-NH2 3.01Å
419	L	81.6	Confident	76	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-56.7	-48.9	174.4	170.9	64.1	0	0	0	111.7	A369 L372 L375 F376 Q415 I416 S417 N421 R422 V423	A369-L419 HydrophobicContact CB-CD1 3.65Å; L372-L419 HydrophobicContact CB-CB 4.49Å; L372-L419 HydrophobicContact CB-CD1 4.24Å; L372-L419 HydrophobicContact CD1-CB 3.9Å; L375-L419 HydrophobicContact CG-CD2 4.31Å; F376-L419 HydrophobicContact CB-CD1 3.79Å; F376-L419 HydrophobicContact CB-CD2 3.75Å; F376-L419 HydrophobicContact CB-CG 4.4Å; F376-L419 HydrophobicContact CD2-CD1 4Å; F376-L419 HydrophobicContact CD2-CD2 4.02Å; F376-L419 HydrophobicContact CD2-CG 4.34Å; F376-L419 HydrophobicContact CG-CD1 4.12Å; F376-L419 HydrophobicContact CG-CD2 4.37Å; Q415-L419 WeakPolarHBondContact O-CB 3.33Å; Q415-L419 PolarHBondContact O-N 3.49Å; I416-L419 PolarHBondContact O-N 3.33Å; S417-L419 PolarHBondContact O-N 3.44Å; L419-N421 PolarHBondContact O-N 3.33Å; L419-R422 PolarHBondContact O-N 2.86Å; L419-R422 VanDerWaalsContact O-N 3.09Å; L419-V423 HydrophobicContact CD1-CG1 3.88Å; L419-V423 HydrophobicContact CG-CG1 4.47Å; L419-V423 WeakPolarHBondContact O-CG1 3.08Å; L419-V423 PolarHBondContact O-N 2.64Å
420	L	75.9	Confident	77.1	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-28.6	-178.3	-67.8	171.8	0	0	0	112.1	L105 I416 S417 D418 L428 L431	L105-L420 HydrophobicContact CB-CD1 3.65Å; L105-L420 HydrophobicContact CD1-CB 4.26Å; L105-L420 HydrophobicContact CD1-CD1 3.32Å; L105-L420 HydrophobicContact CD1-CG 4.41Å; L105-L420 HydrophobicContact CD2-CD1 4.3Å; L105-L420 HydrophobicContact CG-CD1 3.88Å; I416-L420 HydrophobicContact CG2-CD1 3.66Å; I416-L420 HydrophobicContact CG2-CG 4.28Å; I416-L420 WeakPolarHBondContact O-CB 3.43Å; I416-L420 WeakPolarHBondContact O-CG 3.33Å; I416-L420 PolarHBondContact O-N 3.33Å; S417-L420 PolarHBondContact O-N 3.43Å; D418-L420 PolarHBondContact O-N 3.06Å; L420-L428 HydrophobicContact CB-CD2 4.07Å; L420-L428 HydrophobicContact CD2-CD2 3.54Å; L420-L428 HydrophobicContact CG-CD2 4.38Å; L420-L431 HydrophobicContact CD2-CD1 3.6Å
421	N	75.1	Confident	78.2	Confident	64 Å²	64	49.2 Å²	49.2	34%	0.342	24%	0.243	S	C	.	.	H	α-helix	trans	-71.6	-28.9	172.4	-74.1	-30.9	0	0	0	113.4	T207 S417 D418 L419	T207-N421 PolarHBondContact O-OD1 3.19Å; T207-N421 PolarHBondContact OG1-ND2 3.03Å; S417-N421 VanDerWaalsContact O-CG 3.31Å; S417-N421 PolarHBondContact O-N 2.96Å; S417-N421 PolarHBondContact O-ND2 3.49Å; D418-N421 WeakPolarHBondContact O-CB 3.46Å; D418-N421 PolarHBondContact O-N 3.32Å; L419-N421 PolarHBondContact O-N 3.33Å
422	R	83.3	Confident	78.8	Confident	129 Å²	129	44 Å²	44	49%	0.487	22%	0.215	S	C	.	.	H	α-helix	trans	-86.8	-33.1	-178.3	-66.1	172.1	-172.3	-150.4	5.4	113.6	G368 D418 L419	G368-R422 VanDerWaalsContact O-CB 3.25Å; G368-R422 WeakPolarHBondContact O-CB 3.28Å; D418-R422 VanDerWaalsContact CG-NE 3.3Å; D418-R422 VanDerWaalsContact O-CG 3.32Å; D418-R422 WeakPolarHBondContact O-CG 3.21Å; D418-R422 PolarHBondContact O-N 3.36Å; D418-R422 VanDerWaalsContact O-N 3.13Å; D418-R422 IonicContact OD1-CZ 3.44Å; D418-R422 IonicContact OD1-NE 2.63Å; D418-R422 PolarHBondContact OD1-NE 2.96Å; D418-R422 IonicContact OD1-NH2 2.7Å; D418-R422 PolarHBondContact OD1-NH2 3.39Å; D418-R422 IonicContact OD2-CZ 3.06Å; D418-R422 IonicContact OD2-NE 3.96Å; D418-R422 PolarHBondContact OD2-NE 3.39Å; D418-R422 VanDerWaalsContact OD2-NE 3.11Å; D418-R422 IonicContact OD2-NH2 3.51Å; D418-R422 PolarHBondContact OD2-NH2 3.01Å; L419-R422 PolarHBondContact O-N 2.86Å; L419-R422 VanDerWaalsContact O-N 3.09Å
423	V	85.9	Confident	79.5	Confident	8 Å²	8	39 Å²	39	5%	0.048	20%	0.195	C	C	.	.	S	Bend	trans	-69.8	147.3	-176.8	-63.8	0	0	0	0	111.8	F376 L419 M427 L428	F376-V423 HydrophobicContact CD2-CG1 4.4Å; F376-V423 HydrophobicContact CE2-CG1 4.24Å; L419-V423 HydrophobicContact CD1-CG1 3.88Å; L419-V423 HydrophobicContact CG-CG1 4.47Å; L419-V423 WeakPolarHBondContact O-CG1 3.08Å; L419-V423 PolarHBondContact O-N 2.64Å; V423-M427 HydrophobicContact CB-CB 3.99Å; V423-M427 HydrophobicContact CB-CG 4.02Å; V423-M427 HydrophobicContact CG1-CG 4.4Å; V423-M427 HydrophobicContact CG2-CB 4.08Å; V423-M427 HydrophobicContact CG2-CG 4.07Å; V423-L428 HydrophobicContact CG2-CD2 3.65Å; V423-L428 HydrophobicContact CG2-CG 4.2Å
424	P	87.3	Confident	80.4	Confident	48 Å²	48	36.3 Å²	36.3	31%	0.312	18%	0.181	S	C	.	.			trans	-58.7	148.7	176.2	-23.6	32.9	0	0	0	112.1	F341 L367 Q426 M427	F341-P424 HydrophobicContact CD2-CB 4.48Å; F341-P424 HydrophobicContact CD2-CG 4.32Å; F341-P424 HydrophobicContact CE2-CB 4.23Å; F341-P424 HydrophobicContact CE2-CG 4.19Å; L367-P424 WeakPolarHBondContact O-CD 3.34Å; P424-Q426 PolarHBondContact O-N 2.98Å; P424-M427 WeakPolarHBondContact O-CA 3.34Å; P424-M427 WeakPolarHBondContact O-CB 3.31Å; P424-M427 PolarHBondContact O-N 2.89Å
425	R	79.8	Confident	80.9	Confident	118 Å²	118	33.4 Å²	33.4	45%	0.445	16%	0.161	S	C	.	.	H	α-helix	trans	-52.6	-36.2	178.9	-61.5	-174.8	-174.2	178.8	0.4	114.1	M427 L428 L429	R425-M427 PolarHBondContact O-N 3.3Å; R425-L428 WeakPolarHBondContact O-CB 3.43Å; R425-L428 PolarHBondContact O-N 2.86Å; R425-L428 VanDerWaalsContact O-N 3.1Å; R425-L429 PolarHBondContact O-N 3.05Å
426	Q	87.8	Confident	81.1	Confident	34 Å²	34	31 Å²	31	16%	0.159	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-29.2	175.9	-66.7	170.5	80	0	0	112.6	Q335 V336 L337 F341 P424 L430	Q335-Q426 HydrophobicContact CG-CG 4.28Å; V336-Q426 PolarHBondContact O-OE1 2.96Å; L337-Q426 VanDerWaalsContact CA-OE1 3.25Å; L337-Q426 HydrophobicContact CD2-CB 4.17Å; F341-Q426 HydrophobicContact CD1-CB 4.3Å; F341-Q426 HydrophobicContact CE1-CB 3.9Å; F341-Q426 HydrophobicContact CE2-CB 4.36Å; F341-Q426 HydrophobicContact CZ-CB 3.92Å; P424-Q426 PolarHBondContact O-N 2.98Å; Q426-L430 WeakPolarHBondContact O-CG 3.09Å; Q426-L430 PolarHBondContact O-N 3.38Å
427	M	87.9	Confident	81.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70	-44	173.6	-175.6	57.1	68.3	0	0	111.6	F341 Y345 L367 F376 V423 P424 R425 L429 L430 L431	F341-M427 HydrophobicContact CE2-CB 4.16Å; F341-M427 HydrophobicContact CE2-CE 3.9Å; F341-M427 HydrophobicContact CZ-CB 4.01Å; F341-M427 HydrophobicContact CZ-CE 3.7Å; Y345-M427 HydrophobicContact CD2-CE 3.76Å; Y345-M427 HydrophobicContact CD2-SD 4.41Å; Y345-M427 HydrophobicContact CE2-CE 4.01Å; Y345-M427 HydrophobicContact CE2-SD 4.06Å; L367-M427 HydrophobicContact CB-CE 4.04Å; L367-M427 HydrophobicContact CD1-CE 3.9Å; L367-M427 HydrophobicContact CD2-CE 3.91Å; L367-M427 HydrophobicContact CG-CE 4.17Å; F376-M427 HydrophobicContact CE1-CE 4.49Å; F376-M427 HydrophobicContact CE2-CE 4.3Å; F376-M427 HydrophobicContact CE2-CG 3.93Å; F376-M427 HydrophobicContact CE2-SD 3.94Å; F376-M427 HydrophobicContact CZ-CE 3.55Å; F376-M427 HydrophobicContact CZ-CG 4.12Å; F376-M427 HydrophobicContact CZ-SD 3.71Å; V423-M427 HydrophobicContact CB-CB 3.99Å; V423-M427 HydrophobicContact CB-CG 4.02Å; V423-M427 HydrophobicContact CG1-CG 4.4Å; V423-M427 HydrophobicContact CG2-CB 4.08Å; V423-M427 HydrophobicContact CG2-CG 4.07Å; P424-M427 WeakPolarHBondContact O-CA 3.34Å; P424-M427 WeakPolarHBondContact O-CB 3.31Å; P424-M427 PolarHBondContact O-N 2.89Å; R425-M427 PolarHBondContact O-N 3.3Å; M427-L429 VanDerWaalsContact C-N 3.27Å; M427-L429 PolarHBondContact O-N 3.37Å; M427-L430 CarbonylContact O-C 3.52Å; M427-L430 WeakPolarHBondContact O-CB 3.33Å; M427-L430 PolarHBondContact O-N 3.45Å; M427-L431 HydrophobicContact CG-CD1 4.16Å; M427-L431 HydrophobicContact CG-CG 4.24Å; M427-L431 WeakPolarHBondContact O-CG 3.47Å; M427-L431 PolarHBondContact O-N 3.48Å; M427-L431 HydrophobicContact SD-CG 4.3Å
428	L	81.1	Confident	82.1	Confident	22 Å²	22	31.4 Å²	31.4	12%	0.115	15%	0.148	C	C	.	.	H	α-helix	trans	-57.7	-42.7	-179.9	-59.6	178.5	0	0	0	111.5	W210 L420 V423 R425 L431 K432	W210-L428 HydrophobicContact CD2-CD1 4.1Å; W210-L428 HydrophobicContact CE3-CD1 3.68Å; W210-L428 HydrophobicContact CH2-CD1 4.16Å; W210-L428 HydrophobicContact CZ3-CD1 3.73Å; L420-L428 HydrophobicContact CB-CD2 4.07Å; L420-L428 HydrophobicContact CD2-CD2 3.54Å; L420-L428 HydrophobicContact CG-CD2 4.38Å; V423-L428 HydrophobicContact CG2-CD2 3.65Å; V423-L428 HydrophobicContact CG2-CG 4.2Å; R425-L428 WeakPolarHBondContact O-CB 3.43Å; R425-L428 PolarHBondContact O-N 2.86Å; R425-L428 VanDerWaalsContact O-N 3.1Å; L428-L431 PolarHBondContact O-N 3.35Å; L428-K432 PolarHBondContact O-N 3.22Å
429	L	80.9	Confident	82.3	Confident	16 Å²	16	30.4 Å²	30.4	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-37.2	175.8	-66.9	175.3	0	0	0	112.8	C306 Q335 R425 M427 T433	C306-L429 HydrophobicContact CB-CB 4.34Å; C306-L429 HydrophobicContact CB-CD2 4.31Å; Q335-L429 HydrophobicContact CB-CD1 3.89Å; Q335-L429 HydrophobicContact CG-CD1 3.87Å; R425-L429 PolarHBondContact O-N 3.05Å; M427-L429 VanDerWaalsContact C-N 3.27Å; M427-L429 PolarHBondContact O-N 3.37Å; L429-T433 WeakPolarHBondContact O-CB 3.45Å; L429-T433 PolarHBondContact O-N 2.87Å; L429-T433 PolarHBondContact O-OG1 2.95Å
430	L	86.8	Confident	82.4	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-40.7	173.9	-73.6	-176.3	0	0	0	111.8	I298 V304 L337 F341 Y345 Q426 M427 T433 N434	I298-L430 HydrophobicContact CD1-CD2 4.15Å; I298-L430 HydrophobicContact CG1-CD2 3.9Å; I298-L430 HydrophobicContact CG2-CD1 4.47Å; I298-L430 HydrophobicContact CG2-CD2 4.08Å; V304-L430 HydrophobicContact CG1-CD2 3.97Å; V304-L430 HydrophobicContact CG2-CD2 4.24Å; L337-L430 HydrophobicContact CD1-CD1 4.06Å; L337-L430 HydrophobicContact CD1-CD2 4.31Å; L337-L430 HydrophobicContact CD2-CD1 4.2Å; L337-L430 HydrophobicContact CD2-CD2 4.4Å; L337-L430 HydrophobicContact CD2-CG 4.3Å; F341-L430 HydrophobicContact CE1-CD1 3.73Å; F341-L430 HydrophobicContact CZ-CD1 4.14Å; Y345-L430 HydrophobicContact CD1-CD1 4.08Å; Y345-L430 HydrophobicContact CD2-CD1 4.44Å; Y345-L430 HydrophobicContact CE1-CD1 3.91Å; Y345-L430 HydrophobicContact CE2-CD1 4.25Å; Y345-L430 HydrophobicContact CG-CD1 4.33Å; Q426-L430 WeakPolarHBondContact O-CG 3.09Å; Q426-L430 PolarHBondContact O-N 3.38Å; M427-L430 CarbonylContact O-C 3.52Å; M427-L430 WeakPolarHBondContact O-CB 3.33Å; M427-L430 PolarHBondContact O-N 3.45Å; L430-T433 PolarHBondContact O-N 2.97Å; L430-N434 WeakPolarHBondContact O-CB 3.27Å; L430-N434 PolarHBondContact O-N 3.31Å; L430-N434 PolarHBondContact O-ND2 3.49Å; L430-N434 PolarHBondContact O-OD1 3Å
431	L	82.9	Confident	82.8	Confident	11 Å²	11	31 Å²	31	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-47.9	174.7	-69.9	174.6	0	0	0	110.8	V379 L380 L420 M427 L428 T433 N434 D435	V379-L431 HydrophobicContact CG1-CD2 4.45Å; L380-L431 HydrophobicContact CB-CD2 4.45Å; L380-L431 HydrophobicContact CD1-CD2 3.79Å; L420-L431 HydrophobicContact CD2-CD1 3.6Å; M427-L431 HydrophobicContact CG-CD1 4.16Å; M427-L431 HydrophobicContact CG-CG 4.24Å; M427-L431 WeakPolarHBondContact O-CG 3.47Å; M427-L431 PolarHBondContact O-N 3.48Å; M427-L431 HydrophobicContact SD-CG 4.3Å; L428-L431 PolarHBondContact O-N 3.35Å; L431-T433 VanDerWaalsContact C-N 3.32Å; L431-T433 PolarHBondContact O-N 3.32Å; L431-N434 PolarHBondContact O-N 2.88Å; L431-D435 WeakPolarHBondContact O-CB 3.24Å; L431-D435 PolarHBondContact O-N 3.27Å
432	K	79.9	Confident	83.1	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.052	16%	0.159	C	C	.	.	H	α-helix	trans	-56.9	-45.4	173.8	-176.5	-168.9	173.8	-139.1	0	111.8	C306 D307 L428 D435 L436	C306-K432 PolarHBondContact O-NZ 3.05Å; D307-K432 IonicContact OD1-NZ 2.89Å; D307-K432 PolarHBondContact OD1-NZ 3.2Å; L428-K432 PolarHBondContact O-N 3.22Å; K432-D435 WeakPolarHBondContact O-CB 3.48Å; K432-D435 PolarHBondContact O-N 3.44Å; K432-L436 HydrophobicContact CG-CD1 4.3Å; K432-L436 WeakPolarHBondContact O-CG 3.43Å; K432-L436 PolarHBondContact O-N 3.25Å
433	T	83.9	Confident	83.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-47.6	179.7	-55.3	0	0	0	0	110.5	Y294 V304 H305 P308 L429 L430 L431 D435 L436 L437	Y294-T433 HydrophobicContact CD1-CG2 3.63Å; Y294-T433 HydrophobicContact CE1-CG2 3.71Å; V304-T433 HydrophobicContact CG1-CG2 4.42Å; H305-T433 WeakPolarHBondContact O-CG2 3.34Å; P308-T433 HydrophobicContact CG-CG2 4.06Å; L429-T433 WeakPolarHBondContact O-CB 3.45Å; L429-T433 PolarHBondContact O-N 2.87Å; L429-T433 PolarHBondContact O-OG1 2.95Å; L430-T433 PolarHBondContact O-N 2.97Å; L431-T433 VanDerWaalsContact C-N 3.32Å; L431-T433 PolarHBondContact O-N 3.32Å; T433-D435 VanDerWaalsContact C-N 3.33Å; T433-D435 PolarHBondContact O-N 2.71Å; T433-L436 PolarHBondContact O-N 3.08Å; T433-L437 HydrophobicContact CG2-CD1 4.32Å; T433-L437 VanDerWaalsContact O-CG 3.32Å; T433-L437 WeakPolarHBondContact O-CG 3.4Å; T433-L437 PolarHBondContact O-N 3.27Å; T433-L437 VanDerWaalsContact O-N 3.1Å
434	N	84.4	Confident	83.1	Confident	19 Å²	19	28.3 Å²	28.3	10%	0.102	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-36.8	177	-64.3	-18	0	0	0	112	Y345 L430 L431 R438	Y345-N434 PolarHBondContact OH-ND2 3.43Å; Y345-N434 VanDerWaalsContact OH-ND2 3.13Å; L430-N434 WeakPolarHBondContact O-CB 3.27Å; L430-N434 PolarHBondContact O-N 3.31Å; L430-N434 PolarHBondContact O-ND2 3.49Å; L430-N434 PolarHBondContact O-OD1 3Å; L431-N434 PolarHBondContact O-N 2.88Å; N434-R438 WeakPolarHBondContact O-CB 3.28Å; N434-R438 VanDerWaalsContact O-CG 3.25Å; N434-R438 WeakPolarHBondContact O-CG 3.5Å; N434-R438 PolarHBondContact O-N 2.7Å; N434-R438 PolarHBondContact O-NE 3.04Å; N434-R438 VanDerWaalsContact O-NE 3.16Å
435	D	78.5	Confident	82.9	Confident	29 Å²	29	32.7 Å²	32.7	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-49.1	176.3	-81.6	-26.5	0	0	0	111.7	Y104 L431 K432 T433 L437 R438 G439	Y104-D435 VanDerWaalsContact CD2-OD1 3.28Å; Y104-D435 WeakPolarHBondContact CD2-OD1 3.49Å; Y104-D435 WeakPolarHBondContact CD2-OD2 3.3Å; Y104-D435 WeakPolarHBondContact CE2-OD1 3.48Å; L431-D435 WeakPolarHBondContact O-CB 3.24Å; L431-D435 PolarHBondContact O-N 3.27Å; K432-D435 WeakPolarHBondContact O-CB 3.48Å; K432-D435 PolarHBondContact O-N 3.44Å; T433-D435 VanDerWaalsContact C-N 3.33Å; T433-D435 PolarHBondContact O-N 2.71Å; D435-L437 VanDerWaalsContact C-N 3.33Å; D435-L437 PolarHBondContact O-N 3.39Å; D435-R438 WeakPolarHBondContact O-CB 3.12Å; D435-R438 PolarHBondContact O-N 2.84Å; D435-R438 IonicContact OD1-CZ 3.61Å; D435-R438 IonicContact OD1-NE 3.1Å; D435-R438 IonicContact OD1-NH1 3.82Å; D435-R438 PolarHBondContact OD1-NH1 3.28Å; D435-R438 VanDerWaalsContact OD1-NH1 3.09Å; D435-R438 IonicContact OD1-NH2 3.7Å; D435-R438 PolarHBondContact OD1-NH2 3.37Å; D435-G439 PolarHBondContact O-N 3.29Å
436	L	79.9	Confident	83	Confident	26 Å²	26	27.2 Å²	27.2	14%	0.136	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-40.9	178.5	-73.6	172.2	0	0	0	111.7	P308 K432 T433 G439 I440	P308-L436 HydrophobicContact CG-CB 3.76Å; P308-L436 HydrophobicContact CG-CD1 3.99Å; K432-L436 HydrophobicContact CG-CD1 4.3Å; K432-L436 WeakPolarHBondContact O-CG 3.43Å; K432-L436 PolarHBondContact O-N 3.25Å; T433-L436 PolarHBondContact O-N 3.08Å; L436-G439 PolarHBondContact O-N 2.66Å; L436-I440 WeakPolarHBondContact O-CG1 3.35Å; L436-I440 PolarHBondContact O-N 3.08Å
437	L	84.3	Confident	82.1	Confident	21 Å²	21	28.1 Å²	28.1	11%	0.11	15%	0.152	C	C	.	.	H	α-helix	trans	-63.4	-43.9	174.4	-67.9	172	0	0	0	112	Y294 P308 T433 D435 G439 I440 E441	Y294-L437 HydrophobicContact CD1-CD1 3.91Å; Y294-L437 HydrophobicContact CD2-CD1 4.02Å; Y294-L437 HydrophobicContact CD2-CD2 3.59Å; Y294-L437 HydrophobicContact CD2-CG 4.39Å; Y294-L437 HydrophobicContact CE2-CD2 3.79Å; Y294-L437 HydrophobicContact CG-CD1 3.58Å; Y294-L437 HydrophobicContact CG-CD2 4.05Å; Y294-L437 HydrophobicContact CG-CG 4.37Å; P308-L437 HydrophobicContact CB-CD2 4.34Å; P308-L437 HydrophobicContact CG-CD2 4.48Å; P308-L437 HydrophobicContact CG-CG 4.4Å; T433-L437 HydrophobicContact CG2-CD1 4.32Å; T433-L437 VanDerWaalsContact O-CG 3.32Å; T433-L437 WeakPolarHBondContact O-CG 3.4Å; T433-L437 PolarHBondContact O-N 3.27Å; T433-L437 VanDerWaalsContact O-N 3.1Å; D435-L437 VanDerWaalsContact C-N 3.33Å; D435-L437 PolarHBondContact O-N 3.39Å; L437-G439 VanDerWaalsContact C-N 3.27Å; L437-G439 PolarHBondContact O-N 3.35Å; L437-I440 WeakPolarHBondContact O-CB 3.34Å; L437-I440 PolarHBondContact O-N 3.02Å; L437-I440 VanDerWaalsContact O-N 3.15Å; L437-E441 WeakPolarHBondContact O-CG 3.47Å; L437-E441 PolarHBondContact O-N 3.46Å
438	R	80.5	Confident	80.7	Confident	29 Å²	29	32.1 Å²	32.1	11%	0.109	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-37	173.5	-77.2	179.4	-78.7	164.7	-25.6	112.1	Y104 N434 D435 I440 E441 T442	Y104-R438 PolarHBondContact OH-NH1 3.5Å; N434-R438 WeakPolarHBondContact O-CB 3.28Å; N434-R438 VanDerWaalsContact O-CG 3.25Å; N434-R438 WeakPolarHBondContact O-CG 3.5Å; N434-R438 PolarHBondContact O-N 2.7Å; N434-R438 PolarHBondContact O-NE 3.04Å; N434-R438 VanDerWaalsContact O-NE 3.16Å; D435-R438 WeakPolarHBondContact O-CB 3.12Å; D435-R438 PolarHBondContact O-N 2.84Å; D435-R438 IonicContact OD1-CZ 3.61Å; D435-R438 IonicContact OD1-NE 3.1Å; D435-R438 IonicContact OD1-NH1 3.82Å; D435-R438 PolarHBondContact OD1-NH1 3.28Å; D435-R438 VanDerWaalsContact OD1-NH1 3.09Å; D435-R438 IonicContact OD1-NH2 3.7Å; D435-R438 PolarHBondContact OD1-NH2 3.37Å; R438-I440 VanDerWaalsContact C-N 3.35Å; R438-E441 PolarHBondContact O-N 3.4Å; R438-T442 VanDerWaalsContact O-CB 3.3Å; R438-T442 WeakPolarHBondContact O-CB 3.44Å; R438-T442 PolarHBondContact O-N 3.41Å; R438-T442 PolarHBondContact O-OG1 3.4Å
439	G	79.8	Confident	79.7	Confident	35 Å²	35	32.6 Å²	32.6	36%	0.361	19%	0.19	S	C	.	.	H	α-helix	trans	-60.6	-42.7	173.7	0	0	0	0	0	112.3	D435 L436 L437 T443	D435-G439 PolarHBondContact O-N 3.29Å; L436-G439 PolarHBondContact O-N 2.66Å; L437-G439 VanDerWaalsContact C-N 3.27Å; L437-G439 PolarHBondContact O-N 3.35Å; G439-T443 WeakPolarHBondContact O-CB 3.37Å; G439-T443 PolarHBondContact O-N 3.27Å; G439-T443 PolarHBondContact O-OG1 3.07Å
440	I	83.8	Confident	78.6	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-49.9	174.2	-65.4	165.6	0	0	0	110.6	V270 L290 P310 L436 L437 R438 T442 T443 L444	V270-I440 HydrophobicContact CG1-CD1 3.88Å; V270-I440 HydrophobicContact CG1-CG1 4.03Å; V270-I440 HydrophobicContact CG1-CG2 4.19Å; V270-I440 HydrophobicContact CG2-CG2 3.92Å; L290-I440 HydrophobicContact CD1-CG2 3.88Å; P310-I440 HydrophobicContact CG-CG1 4.06Å; L436-I440 WeakPolarHBondContact O-CG1 3.35Å; L436-I440 PolarHBondContact O-N 3.08Å; L437-I440 WeakPolarHBondContact O-CB 3.34Å; L437-I440 PolarHBondContact O-N 3.02Å; L437-I440 VanDerWaalsContact O-N 3.15Å; R438-I440 VanDerWaalsContact C-N 3.35Å; I440-T442 VanDerWaalsContact C-N 3.29Å; I440-T442 PolarHBondContact O-N 2.8Å; I440-T443 PolarHBondContact O-N 3.33Å; I440-L444 HydrophobicContact CG2-CD1 3.72Å; I440-L444 HydrophobicContact CG2-CG 4.34Å; I440-L444 WeakPolarHBondContact O-CB 3.47Å; I440-L444 WeakPolarHBondContact O-CG 3.23Å; I440-L444 PolarHBondContact O-N 2.94Å
441	E	84.6	Confident	77.7	Confident	28 Å²	28	35.3 Å²	35.3	13%	0.131	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-39.3	178.3	-70.6	176.8	169.3	0	0	112.6	L437 R438 L444 Q445 T446 R447	L437-E441 WeakPolarHBondContact O-CG 3.47Å; L437-E441 PolarHBondContact O-N 3.46Å; R438-E441 PolarHBondContact O-N 3.4Å; E441-L444 PolarHBondContact O-N 2.94Å; E441-Q445 PolarHBondContact O-N 2.96Å; E441-T446 WeakPolarHBondContact CA-OG1 3.25Å; E441-T446 PolarHBondContact O-N 3.07Å; E441-T446 PolarHBondContact O-OG1 2.78Å; E441-R447 HydrophobicContact CB-CB 4.44Å
442	T	82.9	Confident	77.1	Confident	77 Å²	77	35.9 Å²	35.9	47%	0.472	22%	0.215	S	C	.	.	H	α-helix	trans	-65.6	-45.9	176.9	-60.1	0	0	0	0	110.6	R438 I440 L444 Q445	R438-T442 VanDerWaalsContact O-CB 3.3Å; R438-T442 WeakPolarHBondContact O-CB 3.44Å; R438-T442 PolarHBondContact O-N 3.41Å; R438-T442 PolarHBondContact O-OG1 3.4Å; I440-T442 VanDerWaalsContact C-N 3.29Å; I440-T442 PolarHBondContact O-N 2.8Å; T442-L444 VanDerWaalsContact C-N 3.29Å; T442-L444 PolarHBondContact O-N 3.43Å; T442-Q445 PolarHBondContact O-N 3.44Å; T442-Q445 VanDerWaalsContact O-N 3.12Å
443	T	83.6	Confident	76.9	Confident	65 Å²	65	36.8 Å²	36.8	40%	0.399	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-40.5	177.5	-54	0	0	0	0	111	N271 R273 G439 I440 Q445	N271-T443 HydrophobicContact CB-CG2 3.87Å; R273-T443 WeakPolarHBondContact CD-O 3.33Å; G439-T443 WeakPolarHBondContact O-CB 3.37Å; G439-T443 PolarHBondContact O-N 3.27Å; G439-T443 PolarHBondContact O-OG1 3.07Å; I440-T443 PolarHBondContact O-N 3.33Å; T443-Q445 VanDerWaalsContact C-N 3.28Å; T443-Q445 PolarHBondContact O-N 3.27Å
444	L	85	Confident	76.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-76.9	-10.1	177.8	-66.2	175.2	0	0	0	114.4	V270 R273 M276 V283 I286 S287 I440 E441 T442 T446	V270-L444 WeakPolarHBondContact O-CD2 3.38Å; R273-L444 HydrophobicContact CG-CD2 4.12Å; M276-L444 HydrophobicContact CE-CD2 3.31Å; M276-L444 HydrophobicContact SD-CD2 4.02Å; V283-L444 HydrophobicContact CB-CB 4.35Å; V283-L444 HydrophobicContact CB-CD2 4.12Å; V283-L444 HydrophobicContact CG1-CD2 3.93Å; I286-L444 HydrophobicContact CG2-CD1 4.34Å; S287-L444 WeakPolarHBondContact OG-CD1 3.23Å; I440-L444 HydrophobicContact CG2-CD1 3.72Å; I440-L444 HydrophobicContact CG2-CG 4.34Å; I440-L444 WeakPolarHBondContact O-CB 3.47Å; I440-L444 WeakPolarHBondContact O-CG 3.23Å; I440-L444 PolarHBondContact O-N 2.94Å; E441-L444 PolarHBondContact O-N 2.94Å; T442-L444 VanDerWaalsContact C-N 3.29Å; T442-L444 PolarHBondContact O-N 3.43Å; L444-T446 VanDerWaalsContact C-N 3.33Å; L444-T446 HydrophobicContact CB-CG2 3.89Å
445	Q	83.6	Confident	76.4	Confident	141 Å²	141	36.7 Å²	36.7	66%	0.659	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	38	-174	-60.3	176.5	-22.3	0	0	113.5	E441 T442 T443	E441-Q445 PolarHBondContact O-N 2.96Å; T442-Q445 PolarHBondContact O-N 3.44Å; T442-Q445 VanDerWaalsContact O-N 3.12Å; T443-Q445 VanDerWaalsContact C-N 3.28Å; T443-Q445 PolarHBondContact O-N 3.27Å
446	T	80.6	Confident	76.7	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	22%	0.215	C	C	.	.			trans	-110.2	-1.8	-175.9	55.6	0	0	0	0	114	V283 N284 S287 E441 L444 A448 S449	V283-T446 HydrophobicContact CB-CG2 4.27Å; V283-T446 HydrophobicContact CG2-CG2 3.9Å; N284-T446 WeakPolarHBondContact OD1-CG2 3.5Å; S287-T446 WeakPolarHBondContact CB-OG1 3.15Å; S287-T446 WeakPolarHBondContact OG-CB 3.17Å; S287-T446 WeakPolarHBondContact OG-CG2 3.32Å; S287-T446 PolarHBondContact OG-OG1 3.46Å; E441-T446 WeakPolarHBondContact CA-OG1 3.25Å; E441-T446 PolarHBondContact O-N 3.07Å; E441-T446 PolarHBondContact O-OG1 2.78Å; L444-T446 VanDerWaalsContact C-N 3.33Å; L444-T446 HydrophobicContact CB-CG2 3.89Å; T446-A448 PolarHBondContact O-N 3.17Å; T446-A448 VanDerWaalsContact O-N 3.07Å; T446-S449 WeakPolarHBondContact O-CB 3.5Å; T446-S449 PolarHBondContact O-N 3.43Å; T446-S449 PolarHBondContact O-OG 2.95Å
447	R	68.9	Low	76.9	Confident	53 Å²	53	35.3 Å²	35.3	20%	0.2	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.8	-176.1	-169.4	173.2	175.2	-154.3	-10.2	114.8	A382 D402 E441 S449	A382-R447 PolarHBondContact O-NH2 2.95Å; D402-R447 IonicContact OD1-CZ 3.78Å; D402-R447 IonicContact OD1-NH1 2.82Å; D402-R447 PolarHBondContact OD1-NH1 3.41Å; D402-R447 IonicContact OD1-NH2 2.71Å; D402-R447 PolarHBondContact OD1-NH2 3Å; D402-R447 IonicContact OD2-CZ 2.8Å; D402-R447 IonicContact OD2-NH1 3.31Å; D402-R447 PolarHBondContact OD2-NH1 2.93Å; E441-R447 HydrophobicContact CB-CB 4.44Å; R447-S449 PolarHBondContact O-N 3.33Å
448	A	58.3	Low	77.1	Confident	83 Å²	83	35.7 Å²	35.7	69%	0.686	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.7	177	0	0	0	0	0	113.6	T446	T446-A448 PolarHBondContact O-N 3.17Å; T446-A448 VanDerWaalsContact O-N 3.07Å
449	S	61.3	Low	77.5	Confident	33 Å²	33	34.6 Å²	34.6	23%	0.231	21%	0.208	C	C	.	.			trans	-76.3	125	-179.3	67.7	0	0	0	0	111.5	T446 R447 S451	T446-S449 WeakPolarHBondContact O-CB 3.5Å; T446-S449 PolarHBondContact O-N 3.43Å; T446-S449 PolarHBondContact O-OG 2.95Å; R447-S449 PolarHBondContact O-N 3.33Å; S449-S451 PolarHBondContact O-N 3.45Å; S449-S451 VanDerWaalsContact O-N 3.1Å; S449-S451 PolarHBondContact OG-OG 3.23Å
450	S	57.9	Low	78	Confident	53 Å²	53	33 Å²	33	37%	0.371	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-5.6	177.9	-48.6	0	0	0	0	113.8	S452 F453 I454	S450-S452 VanDerWaalsContact C-N 3.33Å; S450-S452 PolarHBondContact O-N 3.13Å; S450-F453 PolarHBondContact O-N 3.29Å; S450-I454 WeakPolarHBondContact O-CG1 3.42Å; S450-I454 PolarHBondContact O-N 3.39Å
451	S	66.4	Low	78.3	Confident	21 Å²	21	33.9 Å²	33.9	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-35.8	-172	59.7	0	0	0	0	112.8	S449 F453 I454 N455	S449-S451 PolarHBondContact O-N 3.45Å; S449-S451 VanDerWaalsContact O-N 3.1Å; S449-S451 PolarHBondContact OG-OG 3.23Å; S451-F453 PolarHBondContact O-N 3.29Å; S451-I454 PolarHBondContact O-N 2.98Å; S451-N455 WeakPolarHBondContact O-CB 3.47Å; S451-N455 PolarHBondContact O-N 3.48Å; S451-N455 PolarHBondContact O-ND2 3.42Å; S451-N455 VanDerWaalsContact O-ND2 3.08Å
452	S	71.5	Confident	78.6	Confident	23 Å²	23	37.6 Å²	37.6	16%	0.161	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-50.8	178.6	-167.1	0	0	0	0	111.2	S450 I454 N455 M456	S450-S452 VanDerWaalsContact C-N 3.33Å; S450-S452 PolarHBondContact O-N 3.13Å; S452-I454 PolarHBondContact O-N 2.99Å; S452-N455 PolarHBondContact O-N 2.74Å; S452-M456 VanDerWaalsContact O-CG 3.28Å; S452-M456 WeakPolarHBondContact O-CG 3.24Å; S452-M456 PolarHBondContact O-N 3.36Å
453	F	75	Confident	78.9	Confident	31 Å²	31	34.1 Å²	34.1	14%	0.136	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-37	179.2	-61.7	-60.6	0	0	0	113.6	W349 I392 S450 S451 M456 S457	W349-F453 HydrophobicContact CZ3-CD1 4.31Å; W349-F453 HydrophobicContact CZ3-CE1 4.2Å; I392-F453 HydrophobicContact CD1-CD1 3.75Å; I392-F453 HydrophobicContact CD1-CE1 3.63Å; I392-F453 HydrophobicContact CD1-CZ 4.5Å; I392-F453 HydrophobicContact CG1-CD1 4.28Å; I392-F453 HydrophobicContact CG1-CE1 4.29Å; S450-F453 PolarHBondContact O-N 3.29Å; S451-F453 PolarHBondContact O-N 3.29Å; F453-M456 PolarHBondContact O-N 2.95Å; F453-S457 WeakPolarHBondContact O-CB 3.39Å; F453-S457 PolarHBondContact O-N 2.92Å; F453-S457 PolarHBondContact O-OG 3.44Å
454	I	76.6	Confident	79.3	Confident	9 Å²	9	31.7 Å²	31.7	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-42.6	178.7	-61	171	0	0	0	109.8	S450 S451 S452 S457 R458 Y495 E496 L499	S450-I454 WeakPolarHBondContact O-CG1 3.42Å; S450-I454 PolarHBondContact O-N 3.39Å; S451-I454 PolarHBondContact O-N 2.98Å; S452-I454 PolarHBondContact O-N 2.99Å; I454-S457 WeakPolarHBondContact O-CB 3.4Å; I454-S457 PolarHBondContact O-N 3.3Å; I454-R458 VanDerWaalsContact CG2-CZ 3.43Å; I454-R458 VanDerWaalsContact CG2-NH1 3.26Å; I454-R458 WeakPolarHBondContact O-CG 3.4Å; I454-R458 PolarHBondContact O-N 2.88Å; I454-Y495 HydrophobicContact CD1-CD1 4.32Å; I454-Y495 HydrophobicContact CD1-CE1 4.43Å; I454-E496 HydrophobicContact CD1-CB 4Å; I454-E496 HydrophobicContact CD1-CG 4.01Å; I454-L499 HydrophobicContact CD1-CD1 4Å
455	N	81.7	Confident	79.5	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.043	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-43.6	177.2	-71.1	-36.2	0	0	0	112	K292 S451 S452 S457 R458 C459	K292-N455 HydrophobicContact CG-CB 4.12Å; K292-N455 WeakPolarHBondContact CG-ND2 3.35Å; S451-N455 WeakPolarHBondContact O-CB 3.47Å; S451-N455 PolarHBondContact O-N 3.48Å; S451-N455 PolarHBondContact O-ND2 3.42Å; S451-N455 VanDerWaalsContact O-ND2 3.08Å; S452-N455 PolarHBondContact O-N 2.74Å; N455-S457 VanDerWaalsContact C-N 3.33Å; N455-S457 PolarHBondContact O-N 2.98Å; N455-R458 PolarHBondContact O-N 3.46Å; N455-C459 PolarHBondContact O-N 3.25Å; N455-C459 PolarHBondContact O-SG 3.11Å
456	M	84.5	Confident	79.8	Confident	16 Å²	16	32.6 Å²	32.6	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-44	172.7	-66.4	175.1	76.7	0	0	111.7	S295 F299 W349 S452 F453 R458 C459 C460	S295-M456 VanDerWaalsContact OG-CG 3.29Å; S295-M456 WeakPolarHBondContact OG-CG 3.49Å; F299-M456 HydrophobicContact CE2-CB 4.11Å; F299-M456 HydrophobicContact CE2-CE 3.82Å; F299-M456 HydrophobicContact CE2-CG 4.06Å; F299-M456 HydrophobicContact CZ-CE 3.68Å; W349-M456 HydrophobicContact CD2-CE 3.42Å; W349-M456 VanDerWaalsContact CD2-CE 3.42Å; W349-M456 HydrophobicContact CE3-CE 3.47Å; W349-M456 VanDerWaalsContact CE3-CE 3.47Å; W349-M456 HydrophobicContact CE3-SD 4.36Å; W349-M456 HydrophobicContact CG-CE 4.19Å; W349-M456 HydrophobicContact CH2-CE 3.51Å; W349-M456 HydrophobicContact CH2-SD 4.31Å; W349-M456 HydrophobicContact CZ2-CE 3.46Å; W349-M456 VanDerWaalsContact CZ2-CE 3.46Å; W349-M456 HydrophobicContact CZ3-CE 3.5Å; W349-M456 HydrophobicContact CZ3-SD 4.09Å; S452-M456 VanDerWaalsContact O-CG 3.28Å; S452-M456 WeakPolarHBondContact O-CG 3.24Å; S452-M456 PolarHBondContact O-N 3.36Å; F453-M456 PolarHBondContact O-N 2.95Å; M456-R458 PolarHBondContact O-N 3.22Å; M456-C459 PolarHBondContact O-N 3.31Å; M456-C460 WeakPolarHBondContact O-CB 3.49Å; M456-C460 PolarHBondContact O-N 2.91Å; M456-C460 PolarHBondContact O-SG 3.35Å
457	S	84.1	Confident	80.3	Confident	10 Å²	10	34.2 Å²	34.2	7%	0.07	18%	0.179	C	C	.	.	H	α-helix	trans	-58.2	-47.1	177.6	-60.5	0	0	0	0	111.6	I353 F453 I454 N455 C459 C460 V461	I353-S457 WeakPolarHBondContact CD1-OG 3.23Å; F453-S457 WeakPolarHBondContact O-CB 3.39Å; F453-S457 PolarHBondContact O-N 2.92Å; F453-S457 PolarHBondContact O-OG 3.44Å; I454-S457 WeakPolarHBondContact O-CB 3.4Å; I454-S457 PolarHBondContact O-N 3.3Å; N455-S457 VanDerWaalsContact C-N 3.33Å; N455-S457 PolarHBondContact O-N 2.98Å; S457-C459 PolarHBondContact O-N 3.46Å; S457-C460 PolarHBondContact O-N 3.39Å; S457-V461 VanDerWaalsContact O-CG2 3.29Å; S457-V461 WeakPolarHBondContact O-CG2 3.39Å; S457-V461 PolarHBondContact O-N 2.88Å
458	R	87.9	Confident	81.2	Confident	29 Å²	29	36.8 Å²	36.8	11%	0.109	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-46.5	177.3	-72.1	172.5	173.4	133.3	1.5	111.2	I454 N455 M456 V461 R462 L489 L492 E496	I454-R458 VanDerWaalsContact CG2-CZ 3.43Å; I454-R458 VanDerWaalsContact CG2-NH1 3.26Å; I454-R458 WeakPolarHBondContact O-CG 3.4Å; I454-R458 PolarHBondContact O-N 2.88Å; N455-R458 PolarHBondContact O-N 3.46Å; M456-R458 PolarHBondContact O-N 3.22Å; R458-V461 PolarHBondContact O-N 3.48Å; R458-R462 WeakPolarHBondContact O-CG 3.49Å; R458-R462 PolarHBondContact O-N 3.12Å; R458-L489 HydrophobicContact CB-CD2 4.05Å; R458-L489 HydrophobicContact CG-CD2 4.01Å; R458-L492 HydrophobicContact CG-CD1 3.85Å; R458-E496 IonicContact CZ-OE1 3.54Å; R458-E496 IonicContact CZ-OE2 3.12Å; R458-E496 IonicContact NH1-OE1 3.33Å; R458-E496 PolarHBondContact NH1-OE1 2.96Å; R458-E496 IonicContact NH1-OE2 2.69Å; R458-E496 PolarHBondContact NH1-OE2 3.38Å; R458-E496 VanDerWaalsContact NH2-CD 3.3Å; R458-E496 IonicContact NH2-OE1 3.53Å; R458-E496 IonicContact NH2-OE2 2.66Å; R458-E496 PolarHBondContact NH2-OE2 3.24Å
459	C	89.6	Confident	82.8	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-42.7	179.8	-63.2	0	0	0	0	111.7	S295 F299 V300 N455 M456 S457 R462 A463	S295-C459 VanDerWaalsContact CB-SG 3.52Å; F299-C459 HydrophobicContact CB-CB 3.89Å; F299-C459 HydrophobicContact CD2-CB 4.02Å; F299-C459 HydrophobicContact CG-CB 4.34Å; V300-C459 HydrophobicContact CG2-CB 4.04Å; N455-C459 PolarHBondContact O-N 3.25Å; N455-C459 PolarHBondContact O-SG 3.11Å; M456-C459 PolarHBondContact O-N 3.31Å; S457-C459 PolarHBondContact O-N 3.46Å; C459-R462 PolarHBondContact O-N 3.16Å; C459-A463 WeakPolarHBondContact O-CB 3.29Å; C459-A463 PolarHBondContact O-N 3.35Å
460	C	90.8	Very high	84.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-45.9	175.6	-69.3	0	0	0	0	112.1	F299 C346 M350 M456 S457 A463 V464	F299-C460 VanDerWaalsContact CD1-SG 3.56Å; F299-C460 VanDerWaalsContact CE1-SG 3.59Å; C346-C460 HydrophobicContact CB-CB 4.45Å; M350-C460 HydrophobicContact CG-CB 3.68Å; M350-C460 HydrophobicContact SD-CB 4.18Å; M456-C460 WeakPolarHBondContact O-CB 3.49Å; M456-C460 PolarHBondContact O-N 2.91Å; M456-C460 PolarHBondContact O-SG 3.35Å; S457-C460 PolarHBondContact O-N 3.39Å; C460-A463 PolarHBondContact O-N 3.08Å; C460-V464 WeakPolarHBondContact O-CB 3.39Å; C460-V464 WeakPolarHBondContact O-CG2 3.41Å; C460-V464 PolarHBondContact O-N 3.11Å
461	V	89	Confident	85.6	Confident	20 Å²	20	43 Å²	43	12%	0.121	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-49.1	177.4	168.2	0	0	0	0	110.7	M350 S457 R458 V464 A465 E485 L489 L492	M350-V461 HydrophobicContact CE-CG2 4.21Å; S457-V461 VanDerWaalsContact O-CG2 3.29Å; S457-V461 WeakPolarHBondContact O-CG2 3.39Å; S457-V461 PolarHBondContact O-N 2.88Å; R458-V461 PolarHBondContact O-N 3.48Å; V461-V464 PolarHBondContact O-N 3.48Å; V461-A465 VanDerWaalsContact O-CB 3.28Å; V461-A465 WeakPolarHBondContact O-CB 3.36Å; V461-A465 PolarHBondContact O-N 3.36Å; V461-E485 HydrophobicContact CG1-CG 4.32Å; V461-L489 HydrophobicContact CB-CD2 4.39Å; V461-L489 HydrophobicContact CG1-CD2 4.15Å; V461-L489 HydrophobicContact CG1-CG 4.21Å; V461-L492 HydrophobicContact CG2-CD1 4.44Å
462	R	90.8	Very high	86.7	Confident	106 Å²	106	43.3 Å²	43.3	40%	0.4	20%	0.203	S	C	.	.	H	α-helix	trans	-60.4	-46.4	177.4	-72.8	174.2	-179	173.2	-0.2	112	R458 C459 A465 R466 L489	R458-R462 WeakPolarHBondContact O-CG 3.49Å; R458-R462 PolarHBondContact O-N 3.12Å; C459-R462 PolarHBondContact O-N 3.16Å; R462-A465 PolarHBondContact O-N 3.29Å; R462-R466 WeakPolarHBondContact O-CB 3.35Å; R462-R466 PolarHBondContact O-N 2.89Å; R462-L489 HydrophobicContact CG-CD1 4.27Å; R462-L489 HydrophobicContact CG-CD2 4.41Å
463	A	90.6	Very high	87.5	Confident	5 Å²	5	51 Å²	51	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-48.6	-179.5	0	0	0	0	0	111.7	F299 M343 C459 C460 R466 H467	F299-A463 HydrophobicContact CB-CB 4.47Å; F299-A463 WeakPolarHBondContact O-CB 3.41Å; M343-A463 HydrophobicContact CE-CB 4.24Å; C459-A463 WeakPolarHBondContact O-CB 3.29Å; C459-A463 PolarHBondContact O-N 3.35Å; C460-A463 PolarHBondContact O-N 3.08Å; A463-R466 PolarHBondContact O-N 3.43Å; A463-H467 WeakPolarHBondContact O-CB 3.38Å; A463-H467 PolarHBondContact O-N 3.12Å
464	V	90.5	Very high	88.4	Confident	13 Å²	13	52.5 Å²	52.5	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-40.1	178.3	172.5	0	0	0	0	111.4	C346 R347 M350 C460 V461 H467 K468	C346-V464 HydrophobicContact CB-CG2 4.05Å; R347-V464 HydrophobicContact CG-CG2 4.35Å; M350-V464 HydrophobicContact SD-CG2 3.97Å; C460-V464 WeakPolarHBondContact O-CB 3.39Å; C460-V464 WeakPolarHBondContact O-CG2 3.41Å; C460-V464 PolarHBondContact O-N 3.11Å; V461-V464 PolarHBondContact O-N 3.48Å; V464-H467 PolarHBondContact O-N 3.25Å; V464-K468 HydrophobicContact CG1-CD 4.15Å; V464-K468 WeakPolarHBondContact O-CG 3.36Å; V464-K468 PolarHBondContact O-N 2.93Å
465	A	90.1	Very high	89	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-45.6	176.5	0	0	0	0	0	111.8	V461 R462 H467 K468 R469 I481 E485	V461-A465 VanDerWaalsContact O-CB 3.28Å; V461-A465 WeakPolarHBondContact O-CB 3.36Å; V461-A465 PolarHBondContact O-N 3.36Å; R462-A465 PolarHBondContact O-N 3.29Å; A465-H467 PolarHBondContact O-N 3.07Å; A465-K468 PolarHBondContact O-N 2.95Å; A465-R469 WeakPolarHBondContact O-CG 3.31Å; A465-R469 PolarHBondContact O-N 3.45Å; A465-I481 HydrophobicContact CB-CG2 4.08Å; A465-E485 HydrophobicContact CB-CB 3.81Å; A465-E485 HydrophobicContact CB-CG 3.85Å
466	R	90.1	Very high	89.6	Confident	157 Å²	157	71.7 Å²	71.7	59%	0.592	32%	0.322	S	S	*	.	H	α-helix	trans	-59	-44.8	175.4	-172.4	174.4	-177.9	163.8	1.4	111.8	R462 A463 R469 S470	R462-R466 WeakPolarHBondContact O-CB 3.35Å; R462-R466 PolarHBondContact O-N 2.89Å; A463-R466 PolarHBondContact O-N 3.43Å; R466-R469 PolarHBondContact O-N 3.44Å; R466-S470 PolarHBondContact O-N 3.34Å
467	H	89.9	Confident	89.9	Confident	36 Å²	36	77.4 Å²	77.4	17%	0.167	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-41.8	176.3	-171.5	65.9	0	0	0	113	M343 A463 V464 A465 R469 S470 K471	M343-H467 HydrophobicContact SD-CB 3.65Å; A463-H467 WeakPolarHBondContact O-CB 3.38Å; A463-H467 PolarHBondContact O-N 3.12Å; V464-H467 PolarHBondContact O-N 3.25Å; A465-H467 PolarHBondContact O-N 3.07Å; H467-R469 VanDerWaalsContact C-N 3.33Å; H467-R469 PolarHBondContact O-N 2.89Å; H467-S470 PolarHBondContact O-N 3.44Å; H467-S470 PolarHBondContact O-OG 3.14Å; H467-K471 VanDerWaalsContact CE1-CE 3.48Å; H467-K471 WeakPolarHBondContact CE1-CE 3.49Å; H467-K471 WeakPolarHBondContact NE2-CE 3.43Å; H467-K471 PolarHBondContact O-N 3.29Å
468	K	89.6	Confident	90.3	Very high	107 Å²	107	82.4 Å²	82.4	47%	0.465	36%	0.36	S	S	.	.	H	α-helix	trans	-64.1	-38.8	175.3	-73.9	175.2	179.1	177.7	0	111.7	V464 A465 T472 I481	V464-K468 HydrophobicContact CG1-CD 4.15Å; V464-K468 WeakPolarHBondContact O-CG 3.36Å; V464-K468 PolarHBondContact O-N 2.93Å; A465-K468 PolarHBondContact O-N 2.95Å; K468-T472 WeakPolarHBondContact O-CB 3.07Å; K468-T472 PolarHBondContact O-N 3.35Å; K468-T472 PolarHBondContact O-OG1 3.31Å; K468-I481 HydrophobicContact CB-CD1 3.78Å; K468-I481 HydrophobicContact CB-CG1 4.26Å; K468-I481 HydrophobicContact CB-CG2 4.16Å
469	R	91.7	Very high	90.5	Very high	63 Å²	63	86 Å²	86	24%	0.238	38%	0.381	C	S	.	.	H	α-helix	trans	-65.8	-42.3	177	-76.8	-173	-71.1	-134.2	-6.6	112.3	A465 R466 H467 K471 T472 I481 T482 E485	A465-R469 WeakPolarHBondContact O-CG 3.31Å; A465-R469 PolarHBondContact O-N 3.45Å; R466-R469 PolarHBondContact O-N 3.44Å; H467-R469 VanDerWaalsContact C-N 3.33Å; H467-R469 PolarHBondContact O-N 2.89Å; R469-K471 VanDerWaalsContact C-N 3.31Å; R469-K471 PolarHBondContact O-N 3.34Å; R469-T472 PolarHBondContact O-N 3.19Å; R469-T472 VanDerWaalsContact O-O 3.12Å; R469-I481 HydrophobicContact CG-CB 4.12Å; R469-I481 HydrophobicContact CG-CD1 4.33Å; R469-I481 HydrophobicContact CG-CG2 3.76Å; R469-T482 PolarHBondContact NH1-OG1 2.9Å; R469-T482 VanDerWaalsContact NH1-OG1 3.11Å; R469-E485 IonicContact CZ-OE2 2.99Å; R469-E485 IonicContact NH1-OE2 3.42Å; R469-E485 PolarHBondContact NH1-OE2 3.48Å; R469-E485 IonicContact NH2-OE1 3.63Å; R469-E485 PolarHBondContact NH2-OE1 3.4Å; R469-E485 IonicContact NH2-OE2 2.74Å; R469-E485 PolarHBondContact NH2-OE2 2.98Å
470	S	88.8	Confident	90.7	Very high	87 Å²	87	89.6 Å²	89.6	61%	0.608	40%	0.397	S	S	*	.	H	α-helix	trans	-65	-34.4	179.4	63.5	0	0	0	0	112.4	R466 H467 T472	R466-S470 PolarHBondContact O-N 3.34Å; H467-S470 PolarHBondContact O-N 3.44Å; H467-S470 PolarHBondContact O-OG 3.14Å; S470-T472 VanDerWaalsContact C-N 3.3Å; S470-T472 PolarHBondContact O-N 3.27Å
471	K	89.6	Confident	90.8	Very high	150 Å²	150	90.3 Å²	90.3	65%	0.652	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.9	175.6	-67.3	-164.3	174.8	-168.3	0	114.9	H467 R469	H467-K471 VanDerWaalsContact CE1-CE 3.48Å; H467-K471 WeakPolarHBondContact CE1-CE 3.49Å; H467-K471 WeakPolarHBondContact NE2-CE 3.43Å; H467-K471 PolarHBondContact O-N 3.29Å; R469-K471 VanDerWaalsContact C-N 3.31Å; R469-K471 PolarHBondContact O-N 3.34Å
472	T	89.4	Confident	90.9	Very high	27 Å²	27	91.7 Å²	91.7	17%	0.166	41%	0.41	C	S	.	.			trans	-109.5	128.4	-174.5	-62.1	0	0	0	0	110.9	K468 R469 S470 R477 R478	K468-T472 WeakPolarHBondContact O-CB 3.07Å; K468-T472 PolarHBondContact O-N 3.35Å; K468-T472 PolarHBondContact O-OG1 3.31Å; R469-T472 PolarHBondContact O-N 3.19Å; R469-T472 VanDerWaalsContact O-O 3.12Å; S470-T472 VanDerWaalsContact C-N 3.3Å; S470-T472 PolarHBondContact O-N 3.27Å; T472-R477 HydrophobicContact CG2-CB 3.5Å; T472-R477 VanDerWaalsContact CG2-CB 3.5Å; T472-R477 HydrophobicContact CG2-CG 3.48Å; T472-R477 VanDerWaalsContact CG2-CG 3.48Å; T472-R478 HydrophobicContact CG2-CG 4.17Å; T472-R478 PolarHBondContact O-NE 3.05Å; T472-R478 PolarHBondContact O-NH2 2.89Å
473	Q	87.5	Confident	91	Very high	184 Å²	184	91.8 Å²	91.8	86%	0.86	42%	0.418	S	S	*	.			trans	-93.6	-24.6	172.5	-62.6	-163.7	-3.8	0	0	113.7	R475	Q473-R475 PolarHBondContact O-N 3.47Å
474	S	93.4	Very high	91.1	Very high	64 Å²	64	94 Å²	94	45%	0.448	44%	0.436	S	S	.	.			trans	-69.3	125.5	179.3	172.1	0	0	0	0	113.1	R476 R477 R478	S474-R476 PolarHBondContact O-N 2.82Å; S474-R476 PolarHBondContact OG-N 3.44Å; S474-R477 PolarHBondContact O-N 2.66Å; S474-R477 PolarHBondContact OG-N 2.99Å; S474-R478 WeakPolarHBondContact O-CG 3.4Å; S474-R478 PolarHBondContact O-N 3.18Å
475	R	90.6	Very high	91.2	Very high	227 Å²	227	94.5 Å²	94.5	86%	0.857	44%	0.438	S	S	*	.	H	α-helix	trans	-60.3	-41.6	175.2	-68.6	-173.4	178.1	-172.1	0	112.4	Q473 R477 R478 L479	Q473-R475 PolarHBondContact O-N 3.47Å; R475-R477 PolarHBondContact O-N 3.08Å; R475-R478 PolarHBondContact O-N 3.26Å; R475-L479 PolarHBondContact O-N 3.28Å
476	R	93.3	Very high	91.3	Very high	192 Å²	192	97.4 Å²	97.4	73%	0.725	46%	0.457	S	S	*	.	H	α-helix	trans	-60.6	-45.2	177.1	-175.7	179.9	-179.8	-171.9	0.7	111.1	S474 L479 Q480	S474-R476 PolarHBondContact O-N 2.82Å; S474-R476 PolarHBondContact OG-N 3.44Å; R476-L479 PolarHBondContact O-N 3.1Å; R476-Q480 WeakPolarHBondContact O-CG 3.42Å; R476-Q480 PolarHBondContact O-N 2.89Å
477	R	91.3	Very high	91.3	Very high	136 Å²	136	94.3 Å²	94.3	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-69.3	-36.9	179.3	-176.2	61.2	171	-170.6	-3.6	111.9	T472 S474 R475 Q480 I481	T472-R477 HydrophobicContact CG2-CB 3.5Å; T472-R477 VanDerWaalsContact CG2-CB 3.5Å; T472-R477 HydrophobicContact CG2-CG 3.48Å; T472-R477 VanDerWaalsContact CG2-CG 3.48Å; S474-R477 PolarHBondContact O-N 2.66Å; S474-R477 PolarHBondContact OG-N 2.99Å; R475-R477 PolarHBondContact O-N 3.08Å; R477-Q480 VanDerWaalsContact NH1-OE1 3.14Å; R477-Q480 PolarHBondContact O-N 3.02Å; R477-I481 HydrophobicContact CG-CD1 4.14Å; R477-I481 WeakPolarHBondContact O-CD1 3.44Å; R477-I481 VanDerWaalsContact O-CG1 3.24Å; R477-I481 WeakPolarHBondContact O-CG1 3.44Å; R477-I481 PolarHBondContact O-N 3.31Å
478	R	91.4	Very high	91.2	Very high	115 Å²	115	95 Å²	95	43%	0.434	46%	0.461	S	S	.	.	H	α-helix	trans	-60	-44.6	170.7	-74.7	-177.4	-178.5	-178	3	111.8	T472 S474 R475 I481 T482	T472-R478 HydrophobicContact CG2-CG 4.17Å; T472-R478 PolarHBondContact O-NE 3.05Å; T472-R478 PolarHBondContact O-NH2 2.89Å; S474-R478 WeakPolarHBondContact O-CG 3.4Å; S474-R478 PolarHBondContact O-N 3.18Å; R475-R478 PolarHBondContact O-N 3.26Å; R478-I481 PolarHBondContact O-N 2.83Å; R478-T482 PolarHBondContact O-N 3.24Å; R478-T482 PolarHBondContact O-OG1 3.38Å
479	L	93.1	Very high	91.2	Very high	106 Å²	106	91.5 Å²	91.5	56%	0.555	45%	0.447	S	S	*	.	H	α-helix	trans	-60.9	-46	175.9	-177.8	64.6	0	0	0	111.5	R475 R476 I481 T482 L483	R475-L479 PolarHBondContact O-N 3.28Å; R476-L479 PolarHBondContact O-N 3.1Å; L479-I481 VanDerWaalsContact C-N 3.32Å; L479-I481 PolarHBondContact O-N 3.26Å; L479-T482 PolarHBondContact O-N 3.28Å; L479-L483 HydrophobicContact CD1-CD1 4.49Å; L479-L483 HydrophobicContact CD1-CG 4.44Å; L479-L483 HydrophobicContact CG-CD1 4.14Å; L479-L483 WeakPolarHBondContact O-CG 3.34Å; L479-L483 PolarHBondContact O-N 3.37Å
480	Q	93.9	Very high	91.1	Very high	80 Å²	80	96 Å²	96	37%	0.374	46%	0.464	S	S	.	.	H	α-helix	trans	-57.2	-43.3	174.9	-74	176.5	-11.4	0	0	112.4	R476 R477 L483 A484	R476-Q480 WeakPolarHBondContact O-CG 3.42Å; R476-Q480 PolarHBondContact O-N 2.89Å; R477-Q480 VanDerWaalsContact NH1-OE1 3.14Å; R477-Q480 PolarHBondContact O-N 3.02Å; Q480-L483 PolarHBondContact O-N 3.01Å; Q480-A484 WeakPolarHBondContact O-CB 3.38Å; Q480-A484 PolarHBondContact O-N 3.18Å
481	I	92.4	Very high	91	Very high	15 Å²	15	97.9 Å²	97.9	8%	0.077	46%	0.461	C	S	.	.	H	α-helix	trans	-64.7	-44.1	178.2	-65.8	157.8	0	0	0	110.6	A465 K468 R469 R477 R478 L479 A484 E485	A465-I481 HydrophobicContact CB-CG2 4.08Å; K468-I481 HydrophobicContact CB-CD1 3.78Å; K468-I481 HydrophobicContact CB-CG1 4.26Å; K468-I481 HydrophobicContact CB-CG2 4.16Å; R469-I481 HydrophobicContact CG-CB 4.12Å; R469-I481 HydrophobicContact CG-CD1 4.33Å; R469-I481 HydrophobicContact CG-CG2 3.76Å; R477-I481 HydrophobicContact CG-CD1 4.14Å; R477-I481 WeakPolarHBondContact O-CD1 3.44Å; R477-I481 VanDerWaalsContact O-CG1 3.24Å; R477-I481 WeakPolarHBondContact O-CG1 3.44Å; R477-I481 PolarHBondContact O-N 3.31Å; R478-I481 PolarHBondContact O-N 2.83Å; L479-I481 VanDerWaalsContact C-N 3.32Å; L479-I481 PolarHBondContact O-N 3.26Å; I481-A484 PolarHBondContact O-N 2.83Å; I481-E485 WeakPolarHBondContact O-CB 3.46Å; I481-E485 PolarHBondContact O-N 3.44Å
482	T	91.9	Very high	90.8	Very high	50 Å²	50	92.2 Å²	92.2	31%	0.307	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-43.3	177.3	-60.5	0	0	0	0	111.5	R469 R478 L479 A484 E485 S486	R469-T482 PolarHBondContact NH1-OG1 2.9Å; R469-T482 VanDerWaalsContact NH1-OG1 3.11Å; R478-T482 PolarHBondContact O-N 3.24Å; R478-T482 PolarHBondContact O-OG1 3.38Å; L479-T482 PolarHBondContact O-N 3.28Å; T482-A484 PolarHBondContact O-N 3.39Å; T482-E485 WeakPolarHBondContact O-CB 3.36Å; T482-E485 PolarHBondContact O-N 2.85Å; T482-S486 PolarHBondContact O-N 3.09Å; T482-S486 PolarHBondContact O-OG 2.95Å; T482-S486 VanDerWaalsContact O-OG 3.12Å
483	L	92.9	Very high	90.6	Very high	108 Å²	108	93.6 Å²	93.6	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-62.7	-42.6	175.8	-72	171.7	0	0	0	111.8	L479 Q480 S486 L487	L479-L483 HydrophobicContact CD1-CD1 4.49Å; L479-L483 HydrophobicContact CD1-CG 4.44Å; L479-L483 HydrophobicContact CG-CD1 4.14Å; L479-L483 WeakPolarHBondContact O-CG 3.34Å; L479-L483 PolarHBondContact O-N 3.37Å; Q480-L483 PolarHBondContact O-N 3.01Å; L483-S486 PolarHBondContact O-N 3.46Å; L483-L487 WeakPolarHBondContact O-CB 3.26Å; L483-L487 PolarHBondContact O-N 2.98Å
484	A	91.6	Very high	90.5	Very high	52 Å²	52	87.4 Å²	87.4	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-37.7	177.3	0	0	0	0	0	112.8	Q480 I481 T482 S488	Q480-A484 WeakPolarHBondContact O-CB 3.38Å; Q480-A484 PolarHBondContact O-N 3.18Å; I481-A484 PolarHBondContact O-N 2.83Å; T482-A484 PolarHBondContact O-N 3.39Å; A484-S488 WeakPolarHBondContact O-CB 3.37Å; A484-S488 PolarHBondContact O-N 2.75Å; A484-S488 PolarHBondContact O-OG 2.69Å
485	E	92.6	Very high	90	Very high	23 Å²	23	88 Å²	88	11%	0.107	42%	0.417	C	S	.	.	H	α-helix	trans	-60.3	-53.5	171.3	177.9	-177.3	-148.7	0	0	110.5	V461 A465 R469 I481 T482 L487 S488 L489	V461-E485 HydrophobicContact CG1-CG 4.32Å; A465-E485 HydrophobicContact CB-CB 3.81Å; A465-E485 HydrophobicContact CB-CG 3.85Å; R469-E485 IonicContact CZ-OE2 2.99Å; R469-E485 IonicContact NH1-OE2 3.42Å; R469-E485 PolarHBondContact NH1-OE2 3.48Å; R469-E485 IonicContact NH2-OE1 3.63Å; R469-E485 PolarHBondContact NH2-OE1 3.4Å; R469-E485 IonicContact NH2-OE2 2.74Å; R469-E485 PolarHBondContact NH2-OE2 2.98Å; I481-E485 WeakPolarHBondContact O-CB 3.46Å; I481-E485 PolarHBondContact O-N 3.44Å; T482-E485 WeakPolarHBondContact O-CB 3.36Å; T482-E485 PolarHBondContact O-N 2.85Å; E485-L487 VanDerWaalsContact C-N 3.33Å; E485-L487 PolarHBondContact O-N 3.12Å; E485-S488 PolarHBondContact O-N 3.13Å; E485-S488 VanDerWaalsContact O-N 3.12Å; E485-L489 HydrophobicContact CG-CD1 3.98Å; E485-L489 HydrophobicContact CG-CG 4.45Å; E485-L489 WeakPolarHBondContact O-CG 3.29Å; E485-L489 PolarHBondContact O-N 3.24Å
486	S	91.6	Very high	89.5	Confident	66 Å²	66	80 Å²	80	46%	0.462	39%	0.389	S	S	.	.	H	α-helix	trans	-57.8	-43.9	179.1	-63.7	0	0	0	0	112.1	T482 L483 S488 L489 W490	T482-S486 PolarHBondContact O-N 3.09Å; T482-S486 PolarHBondContact O-OG 2.95Å; T482-S486 VanDerWaalsContact O-OG 3.12Å; L483-S486 PolarHBondContact O-N 3.46Å; S486-S488 PolarHBondContact O-N 3.34Å; S486-L489 PolarHBondContact O-N 2.9Å; S486-W490 VanDerWaalsContact O-CB 3.26Å; S486-W490 WeakPolarHBondContact O-CB 3.47Å; S486-W490 PolarHBondContact O-N 3.38Å
487	L	91.7	Very high	88.9	Confident	93 Å²	93	75.8 Å²	75.8	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-41.7	176.6	-177.1	67.7	0	0	0	112	L483 E485 W490 K491	L483-L487 WeakPolarHBondContact O-CB 3.26Å; L483-L487 PolarHBondContact O-N 2.98Å; E485-L487 VanDerWaalsContact C-N 3.33Å; E485-L487 PolarHBondContact O-N 3.12Å; L487-W490 HydrophobicContact CD1-CE3 4.25Å; L487-W490 PolarHBondContact O-N 3.33Å; L487-K491 WeakPolarHBondContact O-CG 3.43Å; L487-K491 PolarHBondContact O-N 3.26Å
488	S	87.9	Confident	88.4	Confident	50 Å²	50	74.1 Å²	74.1	35%	0.35	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-43	179.4	-58.7	0	0	0	0	111.5	A484 E485 S486 W490 K491 L492	A484-S488 WeakPolarHBondContact O-CB 3.37Å; A484-S488 PolarHBondContact O-N 2.75Å; A484-S488 PolarHBondContact O-OG 2.69Å; E485-S488 PolarHBondContact O-N 3.13Å; E485-S488 VanDerWaalsContact O-N 3.12Å; S486-S488 PolarHBondContact O-N 3.34Å; S488-W490 VanDerWaalsContact C-N 3.35Å; S488-K491 PolarHBondContact O-N 2.95Å; S488-L492 WeakPolarHBondContact O-CG 3.42Å; S488-L492 PolarHBondContact O-N 3.41Å; S488-L492 VanDerWaalsContact O-N 3.13Å
489	L	89.4	Confident	87.5	Confident	33 Å²	33	71.2 Å²	71.2	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-39.8	175.3	-68.1	176.6	0	0	0	111.5	R458 V461 R462 E485 S486 L492 S493	R458-L489 HydrophobicContact CB-CD2 4.05Å; R458-L489 HydrophobicContact CG-CD2 4.01Å; V461-L489 HydrophobicContact CB-CD2 4.39Å; V461-L489 HydrophobicContact CG1-CD2 4.15Å; V461-L489 HydrophobicContact CG1-CG 4.21Å; R462-L489 HydrophobicContact CG-CD1 4.27Å; R462-L489 HydrophobicContact CG-CD2 4.41Å; E485-L489 HydrophobicContact CG-CD1 3.98Å; E485-L489 HydrophobicContact CG-CG 4.45Å; E485-L489 WeakPolarHBondContact O-CG 3.29Å; E485-L489 PolarHBondContact O-N 3.24Å; S486-L489 PolarHBondContact O-N 2.9Å; L489-L492 PolarHBondContact O-N 3.2Å; L489-S493 PolarHBondContact O-N 3.31Å; L489-S493 PolarHBondContact O-OG 3.03Å
490	W	89.8	Confident	86.5	Confident	159 Å²	159	74.9 Å²	74.9	60%	0.602	38%	0.38	S	S	*	.	H	α-helix	trans	-61.3	-45.9	175.1	178.7	80.1	0	0	0	111.8	S486 L487 S488 L492 S493 V494	S486-W490 VanDerWaalsContact O-CB 3.26Å; S486-W490 WeakPolarHBondContact O-CB 3.47Å; S486-W490 PolarHBondContact O-N 3.38Å; L487-W490 HydrophobicContact CD1-CE3 4.25Å; L487-W490 PolarHBondContact O-N 3.33Å; S488-W490 VanDerWaalsContact C-N 3.35Å; W490-L492 VanDerWaalsContact C-N 3.29Å; W490-L492 PolarHBondContact O-N 3.49Å; W490-S493 PolarHBondContact O-N 2.93Å; W490-S493 VanDerWaalsContact O-N 3.12Å; W490-V494 HydrophobicContact CD2-CG2 4.04Å; W490-V494 HydrophobicContact CE3-CG2 4.4Å; W490-V494 HydrophobicContact CH2-CG2 4.16Å; W490-V494 HydrophobicContact CZ2-CG2 3.76Å; W490-V494 HydrophobicContact CZ3-CG2 4.46Å; W490-V494 WeakPolarHBondContact O-CG2 3.48Å; W490-V494 PolarHBondContact O-N 3.47Å
491	K	86.3	Confident	85.7	Confident	125 Å²	125	74.1 Å²	74.1	54%	0.543	38%	0.381	S	S	.	.	H	α-helix	trans	-57.2	-41.8	174.6	-74.8	178.5	-179.6	-173.3	0	112.4	L487 S488 V494 Y495	L487-K491 WeakPolarHBondContact O-CG 3.43Å; L487-K491 PolarHBondContact O-N 3.26Å; S488-K491 PolarHBondContact O-N 2.95Å; K491-V494 PolarHBondContact O-N 2.89Å; K491-Y495 WeakPolarHBondContact O-CB 3.49Å; K491-Y495 PolarHBondContact O-N 3.13Å
492	L	85.8	Confident	84.5	Confident	31 Å²	31	81.2 Å²	81.2	16%	0.162	41%	0.411	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.2	-71	171	0	0	0	111.9	R458 V461 S488 L489 W490 Y495 E496	R458-L492 HydrophobicContact CG-CD1 3.85Å; V461-L492 HydrophobicContact CG2-CD1 4.44Å; S488-L492 WeakPolarHBondContact O-CG 3.42Å; S488-L492 PolarHBondContact O-N 3.41Å; S488-L492 VanDerWaalsContact O-N 3.13Å; L489-L492 PolarHBondContact O-N 3.2Å; W490-L492 VanDerWaalsContact C-N 3.29Å; W490-L492 PolarHBondContact O-N 3.49Å; L492-Y495 PolarHBondContact O-N 3.24Å; L492-E496 WeakPolarHBondContact O-CB 3.46Å; L492-E496 PolarHBondContact O-N 3.31Å
493	S	85.1	Confident	83.1	Confident	57 Å²	57	80.4 Å²	80.4	40%	0.399	41%	0.413	S	S	.	.	H	α-helix	trans	-65.8	-38.7	175.8	-61.5	0	0	0	0	112.8	L489 W490 E496 L497	L489-S493 PolarHBondContact O-N 3.31Å; L489-S493 PolarHBondContact O-OG 3.03Å; W490-S493 PolarHBondContact O-N 2.93Å; W490-S493 VanDerWaalsContact O-N 3.12Å; S493-E496 PolarHBondContact O-N 2.81Å; S493-L497 WeakPolarHBondContact O-CB 3.44Å; S493-L497 PolarHBondContact O-N 2.89Å
494	V	84.9	Confident	81.8	Confident	53 Å²	53	76.8 Å²	76.8	32%	0.321	40%	0.396	S	S	.	.	H	α-helix	trans	-63.6	-43.7	173.3	172.5	0	0	0	0	110.7	W490 K491 L497 L498	W490-V494 HydrophobicContact CD2-CG2 4.04Å; W490-V494 HydrophobicContact CE3-CG2 4.4Å; W490-V494 HydrophobicContact CH2-CG2 4.16Å; W490-V494 HydrophobicContact CZ2-CG2 3.76Å; W490-V494 HydrophobicContact CZ3-CG2 4.46Å; W490-V494 WeakPolarHBondContact O-CG2 3.48Å; W490-V494 PolarHBondContact O-N 3.47Å; K491-V494 PolarHBondContact O-N 2.89Å; V494-L497 WeakPolarHBondContact O-CB 3.46Å; V494-L497 PolarHBondContact O-N 3.48Å; V494-L498 HydrophobicContact CG1-CD1 4.17Å; V494-L498 HydrophobicContact CG1-CG 4.49Å; V494-L498 WeakPolarHBondContact O-CG 3.5Å; V494-L498 PolarHBondContact O-N 2.94Å
495	Y	81.8	Confident	80	Confident	78 Å²	78	81 Å²	81	31%	0.306	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-43.7	177.3	178.2	-104.4	0	0	0	112.5	S393 I454 K491 L492 L497 L498 L499	S393-Y495 PolarHBondContact O-OH 3.38Å; I454-Y495 HydrophobicContact CD1-CD1 4.32Å; I454-Y495 HydrophobicContact CD1-CE1 4.43Å; K491-Y495 WeakPolarHBondContact O-CB 3.49Å; K491-Y495 PolarHBondContact O-N 3.13Å; L492-Y495 PolarHBondContact O-N 3.24Å; Y495-L497 VanDerWaalsContact C-N 3.35Å; Y495-L497 PolarHBondContact O-N 3.49Å; Y495-L498 PolarHBondContact O-N 3.34Å; Y495-L499 HydrophobicContact CD1-CD1 3.91Å; Y495-L499 HydrophobicContact CD1-CG 4.47Å; Y495-L499 HydrophobicContact CE1-CD1 3.33Å; Y495-L499 HydrophobicContact CE1-CG 4.07Å; Y495-L499 HydrophobicContact CE2-CD1 4.5Å; Y495-L499 HydrophobicContact CE2-CG 4.41Å; Y495-L499 WeakPolarHBondContact O-CG 3.32Å; Y495-L499 PolarHBondContact O-N 2.98Å
496	E	80.4	Confident	78.1	Confident	58 Å²	58	86.6 Å²	86.6	27%	0.271	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-42.8	174.7	-172.2	177.2	-115.3	0	0	111.8	I454 R458 L492 S493 L498 L499 W500	I454-E496 HydrophobicContact CD1-CB 4Å; I454-E496 HydrophobicContact CD1-CG 4.01Å; R458-E496 IonicContact CZ-OE1 3.54Å; R458-E496 IonicContact CZ-OE2 3.12Å; R458-E496 IonicContact NH1-OE1 3.33Å; R458-E496 PolarHBondContact NH1-OE1 2.96Å; R458-E496 IonicContact NH1-OE2 2.69Å; R458-E496 PolarHBondContact NH1-OE2 3.38Å; R458-E496 VanDerWaalsContact NH2-CD 3.3Å; R458-E496 IonicContact NH2-OE1 3.53Å; R458-E496 IonicContact NH2-OE2 2.66Å; R458-E496 PolarHBondContact NH2-OE2 3.24Å; L492-E496 WeakPolarHBondContact O-CB 3.46Å; L492-E496 PolarHBondContact O-N 3.31Å; S493-E496 PolarHBondContact O-N 2.81Å; E496-L498 VanDerWaalsContact C-N 3.35Å; E496-L498 PolarHBondContact O-N 2.88Å; E496-L499 PolarHBondContact O-N 3.29Å; E496-W500 WeakPolarHBondContact O-CB 3.42Å; E496-W500 PolarHBondContact O-N 2.92Å
497	L	81.6	Confident	76.3	Confident	104 Å²	104	85.7 Å²	85.7	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-60.9	-43.7	174.5	-176.3	70.3	0	0	0	111.4	S493 V494 Y495 L499 W500 V501	S493-L497 WeakPolarHBondContact O-CB 3.44Å; S493-L497 PolarHBondContact O-N 2.89Å; V494-L497 WeakPolarHBondContact O-CB 3.46Å; V494-L497 PolarHBondContact O-N 3.48Å; Y495-L497 VanDerWaalsContact C-N 3.35Å; Y495-L497 PolarHBondContact O-N 3.49Å; L497-L499 PolarHBondContact O-N 3.39Å; L497-W500 HydrophobicContact CD1-CE3 4.27Å; L497-W500 WeakPolarHBondContact O-CB 3.44Å; L497-W500 PolarHBondContact O-N 3.49Å; L497-V501 VanDerWaalsContact O-CG2 3.31Å; L497-V501 WeakPolarHBondContact O-CG2 3.31Å; L497-V501 PolarHBondContact O-N 2.94Å
498	L	80.3	Confident	74.6	Confident	100 Å²	100	89 Å²	89	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-41.5	177	-73	171.4	0	0	0	112.1	V494 Y495 E496 V501 K502	V494-L498 HydrophobicContact CG1-CD1 4.17Å; V494-L498 HydrophobicContact CG1-CG 4.49Å; V494-L498 WeakPolarHBondContact O-CG 3.5Å; V494-L498 PolarHBondContact O-N 2.94Å; Y495-L498 PolarHBondContact O-N 3.34Å; E496-L498 VanDerWaalsContact C-N 3.35Å; E496-L498 PolarHBondContact O-N 2.88Å; L498-V501 PolarHBondContact O-N 3.3Å; L498-K502 WeakPolarHBondContact O-CB 3.5Å; L498-K502 WeakPolarHBondContact O-CG 3.33Å; L498-K502 PolarHBondContact O-N 2.85Å
499	L	72.1	Confident	73.2	Confident	55 Å²	55	94.6 Å²	94.6	29%	0.288	45%	0.448	S	S	.	.	H	α-helix	trans	-63.5	-42.3	174.1	-74.3	176.9	0	0	0	111.5	I454 Y495 E496 L497 K502 G503	I454-L499 HydrophobicContact CD1-CD1 4Å; Y495-L499 HydrophobicContact CD1-CD1 3.91Å; Y495-L499 HydrophobicContact CD1-CG 4.47Å; Y495-L499 HydrophobicContact CE1-CD1 3.33Å; Y495-L499 HydrophobicContact CE1-CG 4.07Å; Y495-L499 HydrophobicContact CE2-CD1 4.5Å; Y495-L499 HydrophobicContact CE2-CG 4.41Å; Y495-L499 WeakPolarHBondContact O-CG 3.32Å; Y495-L499 PolarHBondContact O-N 2.98Å; E496-L499 PolarHBondContact O-N 3.29Å; L497-L499 PolarHBondContact O-N 3.39Å; L499-K502 PolarHBondContact O-N 2.91Å; L499-G503 PolarHBondContact O-N 3.11Å
500	W	72.5	Confident	71.7	Confident	182 Å²	182	97.3 Å²	97.3	69%	0.689	46%	0.462	S	S	*	.	H	α-helix	trans	-62.1	-45.4	176.1	-178.4	81.4	0	0	0	111.9	E496 L497 G503 S504	E496-W500 WeakPolarHBondContact O-CB 3.42Å; E496-W500 PolarHBondContact O-N 2.92Å; L497-W500 HydrophobicContact CD1-CE3 4.27Å; L497-W500 WeakPolarHBondContact O-CB 3.44Å; L497-W500 PolarHBondContact O-N 3.49Å; W500-G503 CarbonylContact O-C 3.51Å; W500-G503 PolarHBondContact O-N 3.41Å; W500-S504 PolarHBondContact O-N 2.85Å
501	V	76.3	Confident	70.2	Confident	65 Å²	65	93.1 Å²	93.1	39%	0.394	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-46.1	175.7	171.4	0	0	0	0	111.1	L497 L498 G503 S504 T507	L497-V501 VanDerWaalsContact O-CG2 3.31Å; L497-V501 WeakPolarHBondContact O-CG2 3.31Å; L497-V501 PolarHBondContact O-N 2.94Å; L498-V501 PolarHBondContact O-N 3.3Å; V501-G503 VanDerWaalsContact C-N 3.29Å; V501-G503 PolarHBondContact O-N 3.2Å; V501-S504 PolarHBondContact O-N 3.22Å; V501-S504 PolarHBondContact O-OG 2.7Å; V501-T507 PolarHBondContact O-OG1 3.46Å
502	K	68.1	Low	68.8	Low	164 Å²	164	90 Å²	90	71%	0.713	46%	0.455	S	S	*	.	H	α-helix	trans	-63.5	-33.2	175.6	-77.9	-174.3	176.4	-173.2	0	113	L498 L499 T507	L498-K502 WeakPolarHBondContact O-CB 3.5Å; L498-K502 WeakPolarHBondContact O-CG 3.33Å; L498-K502 PolarHBondContact O-N 2.85Å; L499-K502 PolarHBondContact O-N 2.91Å; K502-T507 PolarHBondContact O-OG1 2.86Å; K502-T507 VanDerWaalsContact O-OG1 3.13Å
503	G	61.8	Low	67.5	Low	33 Å²	33	92.6 Å²	92.6	34%	0.34	47%	0.469	S	S	.	.	H	α-helix	trans	-82.6	-15.1	179.7	0	0	0	0	0	114.7	L499 W500 V501 R508	L499-G503 PolarHBondContact O-N 3.11Å; W500-G503 CarbonylContact O-C 3.51Å; W500-G503 PolarHBondContact O-N 3.41Å; V501-G503 VanDerWaalsContact C-N 3.29Å; V501-G503 PolarHBondContact O-N 3.2Å; G503-R508 PolarHBondContact O-NE 3.13Å; G503-R508 VanDerWaalsContact O-NE 3.11Å; G503-R508 PolarHBondContact O-NH2 2.94Å
504	S	65.7	Low	66.3	Low	31 Å²	31	95 Å²	95	22%	0.217	48%	0.476	C	S	.	.	S	Bend	trans	-65.1	155.3	-175.5	76.7	0	0	0	0	113.2	W500 V501 M506 T507 R508	W500-S504 PolarHBondContact O-N 2.85Å; V501-S504 PolarHBondContact O-N 3.22Å; V501-S504 PolarHBondContact O-OG 2.7Å; S504-M506 PolarHBondContact O-N 2.8Å; S504-T507 PolarHBondContact O-N 3.34Å; S504-T507 PolarHBondContact O-OG1 3.46Å; S504-T507 PolarHBondContact OG-OG1 2.99Å; S504-R508 PolarHBondContact O-N 2.93Å
505	M	54.7	Low	64.9	Low	140 Å²	140	95.8 Å²	95.8	69%	0.69	49%	0.489	S	S	*	.	H	α-helix	trans	-58.4	-29	177.9	-106.1	-174.7	79.8	0	0	112.6	R508 W509	M505-R508 PolarHBondContact O-N 3.18Å; M505-W509 VanDerWaalsContact O-CB 3.26Å; M505-W509 WeakPolarHBondContact O-CB 3.31Å; M505-W509 PolarHBondContact O-N 3.42Å
506	M	52.4	Low	63.5	Low	141 Å²	141	101 Å²	101	70%	0.695	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-42.3	-176.3	-133.8	-176.7	90.9	0	0	112.1	S504 L510	S504-M506 PolarHBondContact O-N 2.8Å; M506-L510 HydrophobicContact CE-CD1 4.3Å; M506-L510 WeakPolarHBondContact O-CB 3.26Å; M506-L510 WeakPolarHBondContact O-CD1 3.45Å; M506-L510 WeakPolarHBondContact O-CG 3.4Å; M506-L510 PolarHBondContact O-N 3.31Å
507	T	54.4	Low	62.1	Low	47 Å²	47	104.4 Å²	104.4	29%	0.288	53%	0.533	S	S	.	.	H	α-helix	trans	-72.3	-36.2	175.6	27.9	0	0	0	0	111.8	V501 K502 S504 L510 S511	V501-T507 PolarHBondContact O-OG1 3.46Å; K502-T507 PolarHBondContact O-OG1 2.86Å; K502-T507 VanDerWaalsContact O-OG1 3.13Å; S504-T507 PolarHBondContact O-N 3.34Å; S504-T507 PolarHBondContact O-OG1 3.46Å; S504-T507 PolarHBondContact OG-OG1 2.99Å; T507-L510 PolarHBondContact O-N 3.38Å; T507-S511 WeakPolarHBondContact O-CB 3.21Å; T507-S511 PolarHBondContact O-N 2.88Å; T507-S511 PolarHBondContact O-OG 2.86Å
508	R	56.1	Low	60.3	Low	164 Å²	164	110.2 Å²	110.2	62%	0.619	56%	0.557	S	S	*	*	H	α-helix	trans	-65.5	-40.7	171.9	-65.4	-173.3	-148.7	-170.3	4	112.4	G503 S504 M505 S511 A512	G503-R508 PolarHBondContact O-NE 3.13Å; G503-R508 VanDerWaalsContact O-NE 3.11Å; G503-R508 PolarHBondContact O-NH2 2.94Å; S504-R508 PolarHBondContact O-N 2.93Å; M505-R508 PolarHBondContact O-N 3.18Å; R508-S511 VanDerWaalsContact CA-OG 3.31Å; R508-S511 WeakPolarHBondContact CA-OG 3.47Å; R508-S511 PolarHBondContact O-OG 2.89Å; R508-A512 WeakPolarHBondContact O-CB 3.18Å; R508-A512 PolarHBondContact O-N 2.79Å
509	W	58.2	Low	59.3	Low	166 Å²	166	110.8 Å²	110.8	63%	0.629	56%	0.558	S	S	*	*	H	α-helix	trans	-63.8	-47.8	173.1	-105.4	79.4	0	0	0	111.3	M505 S511 A512 L513	M505-W509 VanDerWaalsContact O-CB 3.26Å; M505-W509 WeakPolarHBondContact O-CB 3.31Å; M505-W509 PolarHBondContact O-N 3.42Å; W509-S511 PolarHBondContact O-N 3.24Å; W509-A512 PolarHBondContact O-N 2.96Å; W509-L513 HydrophobicContact CE3-CD1 4.3Å; W509-L513 HydrophobicContact CZ3-CD1 4.37Å; W509-L513 WeakPolarHBondContact O-CB 3.32Å; W509-L513 PolarHBondContact O-N 3.45Å
510	L	57	Low	58.6	Low	91 Å²	91	113.7 Å²	113.7	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-60.9	-42.3	176.4	-88.3	154.9	0	0	0	112.2	M506 T507 L513 L514	M506-L510 HydrophobicContact CE-CD1 4.3Å; M506-L510 WeakPolarHBondContact O-CB 3.26Å; M506-L510 WeakPolarHBondContact O-CD1 3.45Å; M506-L510 WeakPolarHBondContact O-CG 3.4Å; M506-L510 PolarHBondContact O-N 3.31Å; T507-L510 PolarHBondContact O-N 3.38Å; L510-L513 PolarHBondContact O-N 2.86Å; L510-L514 VanDerWaalsContact O-CB 3.31Å; L510-L514 WeakPolarHBondContact O-CB 3.23Å; L510-L514 WeakPolarHBondContact O-CD1 3.5Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.31Å; L510-L514 PolarHBondContact O-N 3.21Å
511	S	59.2	Low	57.8	Low	70 Å²	70	109.9 Å²	109.9	49%	0.49	57%	0.566	S	S	.	*	H	α-helix	trans	-68.2	-37.1	175.3	55.8	0	0	0	0	112.7	T507 R508 W509 A515	T507-S511 WeakPolarHBondContact O-CB 3.21Å; T507-S511 PolarHBondContact O-N 2.88Å; T507-S511 PolarHBondContact O-OG 2.86Å; R508-S511 VanDerWaalsContact CA-OG 3.31Å; R508-S511 WeakPolarHBondContact CA-OG 3.47Å; R508-S511 PolarHBondContact O-OG 2.89Å; W509-S511 PolarHBondContact O-N 3.24Å; S511-A515 VanDerWaalsContact O-CB 3.23Å; S511-A515 WeakPolarHBondContact O-CB 3.37Å; S511-A515 PolarHBondContact O-N 3.49Å
512	A	56.2	Low	56.7	Low	61 Å²	61	112.5 Å²	112.5	50%	0.504	58%	0.576	S	S	.	*	H	α-helix	trans	-69.2	-36.4	175.5	0	0	0	0	0	111.8	R508 W509 A515 F516	R508-A512 WeakPolarHBondContact O-CB 3.18Å; R508-A512 PolarHBondContact O-N 2.79Å; W509-A512 PolarHBondContact O-N 2.96Å; A512-A515 PolarHBondContact O-N 3.39Å; A512-F516 WeakPolarHBondContact O-CB 3.41Å; A512-F516 PolarHBondContact O-N 3.49Å
513	L	59.6	Low	56	Low	85 Å²	85	109.3 Å²	109.3	45%	0.445	57%	0.568	S	S	.	*	H	α-helix	trans	-74.1	-37.1	178.8	-159.5	142.1	0	0	0	111.4	W509 L510 F516 L517	W509-L513 HydrophobicContact CE3-CD1 4.3Å; W509-L513 HydrophobicContact CZ3-CD1 4.37Å; W509-L513 WeakPolarHBondContact O-CB 3.32Å; W509-L513 PolarHBondContact O-N 3.45Å; L510-L513 PolarHBondContact O-N 2.86Å; L513-F516 PolarHBondContact O-N 3.47Å; L513-L517 HydrophobicContact CD2-CD1 3.75Å; L513-L517 WeakPolarHBondContact O-CD1 3.28Å; L513-L517 WeakPolarHBondContact O-CG 3.47Å; L513-L517 PolarHBondContact O-N 2.89Å
514	L	58.9	Low	55.7	Low	106 Å²	106	114.4 Å²	114.4	56%	0.555	58%	0.583	S	S	*	*	H	α-helix	trans	-68.6	-35.3	170.9	-76.7	164.7	0	0	0	112.7	L510 F516 L517 H518	L510-L514 VanDerWaalsContact O-CB 3.31Å; L510-L514 WeakPolarHBondContact O-CB 3.23Å; L510-L514 WeakPolarHBondContact O-CD1 3.5Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.31Å; L510-L514 PolarHBondContact O-N 3.21Å; L514-F516 VanDerWaalsContact C-N 3.27Å; L514-F516 PolarHBondContact O-N 3.32Å; L514-L517 PolarHBondContact O-N 3.44Å; L514-H518 PolarHBondContact O-N 3.06Å
515	A	56.1	Low	54.9	Low	71 Å²	71	120.4 Å²	120.4	59%	0.587	61%	0.609	S	S	*	*	H	α-helix	trans	-74.7	-14.8	173.8	0	0	0	0	0	113.5	S511 A512	S511-A515 VanDerWaalsContact O-CB 3.23Å; S511-A515 WeakPolarHBondContact O-CB 3.37Å; S511-A515 PolarHBondContact O-N 3.49Å; A512-A515 PolarHBondContact O-N 3.39Å
516	F	52.7	Low	55	Low	188 Å²	188	118.8 Å²	118.8	83%	0.825	60%	0.603	S	S	*	*	H	α-helix	trans	-91.6	-15.6	173.4	-157.9	-92	0	0	0	112.4	A512 L513 L514	A512-F516 WeakPolarHBondContact O-CB 3.41Å; A512-F516 PolarHBondContact O-N 3.49Å; L513-F516 PolarHBondContact O-N 3.47Å; L514-F516 VanDerWaalsContact C-N 3.27Å; L514-F516 PolarHBondContact O-N 3.32Å
517	L	50.4	Low	55.2	Low	129 Å²	129	117 Å²	117	68%	0.675	60%	0.595	S	S	*	*			trans	-95.9	-2.1	177.9	-76.9	166.4	0	0	0	113.3	L513 L514	L513-L517 HydrophobicContact CD2-CD1 3.75Å; L513-L517 WeakPolarHBondContact O-CD1 3.28Å; L513-L517 WeakPolarHBondContact O-CG 3.47Å; L513-L517 PolarHBondContact O-N 2.89Å; L514-L517 PolarHBondContact O-N 3.44Å
518	H	43.1	Very low	55.2	Low	226 Å²	226	123.4 Å²	123.4	100%	1.046	62%	0.623	S	S	*	*			trans	-112.6	0	168.9	-96.3	-58	0	0	0	109.1	L514	L514-H518 PolarHBondContact O-N 3.06Å

Retrieved 518 of 518 residues in 2546.3 ms (Link to these results)

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