A0A087YN87_POEFO Loading...

GDNF family receptor alpha 3

AlphaFold DB , UniProt , Accession A0A087YN87, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 456 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.7	Very low	44	Very low	232 Å²	232	129.7 Å²	129.7	100%	1.143	68%	0.679	S	S	*	*				0	124.2	0	-78.8	148.5	73.1	0	0	107.2
2	S	37.7	Very low	43.7	Very low	76 Å²	76	129.2 Å²	129.2	53%	0.531	68%	0.676	S	S	.	*			trans	-64.6	152.3	-164.7	-155.1	0	0	0	0	113.8	D4	S2-D4 PolarHBondContact O-N 3.32Å; S2-D4 VanDerWaalsContact O-N 3.12Å; S2-D4 PolarHBondContact OG-OD2 3.21Å; S2-D4 VanDerWaalsContact OG-OD2 3.08Å
3	P	44	Very low	43.4	Very low	105 Å²	105	128.7 Å²	128.7	68%	0.682	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-62.9	-16.1	179.2	-13.9	28.7	0	0	0	113.8	R5 M6	P3-R5 PolarHBondContact O-N 3.33Å; P3-M6 PolarHBondContact O-N 3.29Å
4	D	45.2	Very low	42.8	Very low	115 Å²	115	129.1 Å²	129.1	62%	0.615	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-72.8	-8.7	-175.5	-54.9	-55.6	0	0	0	114.5	S2	S2-D4 PolarHBondContact O-N 3.32Å; S2-D4 VanDerWaalsContact O-N 3.12Å; S2-D4 PolarHBondContact OG-OD2 3.21Å; S2-D4 VanDerWaalsContact OG-OD2 3.08Å
5	R	44.3	Very low	42.4	Very low	197 Å²	197	128.1 Å²	128.1	74%	0.743	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-90.6	-12.5	176.5	-84.4	-172.8	161.7	-164.5	-4.7	114.9	P3	P3-R5 PolarHBondContact O-N 3.33Å
6	M	44.8	Very low	42.1	Very low	167 Å²	167	131.2 Å²	131.2	82%	0.823	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-17.4	175.6	-81.1	178.8	84.9	0	0	113.7	P3	P3-M6 PolarHBondContact O-N 3.29Å
7	M	45.7	Very low	41.5	Very low	143 Å²	143	129.2 Å²	129.2	70%	0.704	68%	0.684	S	S	*	*	H	α-helix	trans	-79.2	-21.7	176.3	-82.4	-82.1	-139.6	0	0	113.8
8	I	47.8	Very low	41.2	Very low	111 Å²	111	133.2 Å²	133.2	57%	0.569	70%	0.698	S	S	*	*	H	α-helix	trans	-83.3	-25.5	-179	-61.5	177.3	0	0	0	111.9	L12	I8-L12 HydrophobicContact CG2-CD1 4.35Å
9	I	47.1	Very low	40.7	Very low	112 Å²	112	129.2 Å²	129.2	57%	0.574	69%	0.692	S	S	*	*	H	α-helix	trans	-79.7	-29.4	176	-61	171.6	0	0	0	111	L13	I9-L13 HydrophobicContact CG2-CD1 4.15Å
10	G	40.6	Very low	40	Very low	40 Å²	40	126.1 Å²	126.1	41%	0.412	69%	0.693	S	S	.	*	H	α-helix	trans	-75	-20.5	176.1	0	0	0	0	0	115.3	N14	G10-N14 PolarHBondContact O-ND2 3.4Å
11	L	43.1	Very low	39.5	Very low	129 Å²	129	126.6 Å²	126.6	68%	0.675	70%	0.699	S	S	*	*	H	α-helix	trans	-93	-17.5	175.9	-87.9	158.8	0	0	0	113.6
12	L	40.6	Very low	39	Very low	123 Å²	123	120.5 Å²	120.5	64%	0.644	68%	0.679	S	S	*	*	H	α-helix	trans	-89.2	-11.5	174.3	-71.8	171.6	0	0	0	113.8	I8	I8-L12 HydrophobicContact CG2-CD1 4.35Å
13	L	40.4	Very low	39	Very low	123 Å²	123	122.8 Å²	122.8	64%	0.644	69%	0.69	S	S	*	*	S	Bend	trans	-99.1	-6	177.1	-69.8	171.7	0	0	0	114.2	I9	I9-L13 HydrophobicContact CG2-CD1 4.15Å
14	N	34.1	Very low	39	Very low	134 Å²	134	122.8 Å²	122.8	72%	0.717	69%	0.693	S	S	*	*	S	Bend	trans	-99.1	2.8	178.2	-92.7	-42.8	0	0	0	114.9	G10	G10-N14 PolarHBondContact O-ND2 3.4Å
15	V	37.4	Very low	39.5	Very low	114 Å²	114	121.6 Å²	121.6	69%	0.691	70%	0.698	S	S	*	*	S	Bend	trans	-98.5	-6.9	173.9	-177.5	0	0	0	0	112.2
16	F	37.3	Very low	40.8	Very low	178 Å²	178	114 Å²	114	78%	0.781	68%	0.676	S	S	*	*	S	Bend	trans	-112.3	20.2	-177.7	-76	-76.2	0	0	0	115
17	S	31.7	Very low	43	Very low	98 Å²	98	108.9 Å²	108.9	69%	0.685	65%	0.651	S	S	*	*	S	Bend	trans	-112.5	8.2	176.9	-58	0	0	0	0	114.9
18	Q	36.6	Very low	45.2	Very low	200 Å²	200	103.7 Å²	103.7	94%	0.935	63%	0.627	S	S	*	*	S	Bend	trans	-114.9	60	162.4	-70.5	-171.5	-1.9	0	0	109.9
19	G	30.6	Very low	47.6	Very low	57 Å²	57	98.4 Å²	98.4	59%	0.588	60%	0.599	S	S	*	*			trans	-135.3	52.3	171.2	0	0	0	0	0	108.5	V21	G19-V21 VanDerWaalsContact C-N 3.29Å; G19-V21 PolarHBondContact O-N 3.05Å
20	G	27.6	Very low	49.9	Very low	68 Å²	68	93.9 Å²	93.9	70%	0.701	58%	0.576	S	S	*	*			trans	-53.4	110.9	152.7	0	0	0	0	0	104.6	S22	G20-S22 PolarHBondContact O-N 3.49Å
21	V	29.4	Very low	52.6	Low	137 Å²	137	95.6 Å²	95.6	83%	0.83	58%	0.579	S	S	*	*			trans	-52.6	97.7	175.5	174.6	0	0	0	0	104.8	G19 V23	G19-V21 VanDerWaalsContact C-N 3.29Å; G19-V21 PolarHBondContact O-N 3.05Å; V21-V23 VanDerWaalsContact C-N 3.3Å; V21-V23 PolarHBondContact O-N 2.69Å
22	S	33.9	Very low	55.1	Low	103 Å²	103	89.6 Å²	89.6	72%	0.72	55%	0.547	S	S	*	.			trans	-57.7	111.5	161.7	-70.1	0	0	0	0	102.1	G20 S24	G20-S22 PolarHBondContact O-N 3.49Å; S22-S24 VanDerWaalsContact C-N 3.27Å; S22-S24 PolarHBondContact O-N 2.85Å
23	V	37.4	Very low	57.8	Low	124 Å²	124	85 Å²	85	75%	0.752	52%	0.523	S	S	*	.			trans	-38.2	108.7	154.9	174.9	0	0	0	0	103.6	V21 A25	V21-V23 VanDerWaalsContact C-N 3.3Å; V21-V23 PolarHBondContact O-N 2.69Å; V23-A25 VanDerWaalsContact C-N 3.28Å; V23-A25 PolarHBondContact O-N 3.27Å
24	S	42.7	Very low	60.5	Low	106 Å²	106	85 Å²	85	74%	0.741	52%	0.52	S	S	*	.			trans	-55.5	102.5	-172.3	176.9	0	0	0	0	105.3	S22 S26	S22-S24 VanDerWaalsContact C-N 3.27Å; S22-S24 PolarHBondContact O-N 2.85Å; S24-S26 PolarHBondContact O-N 3.19Å
25	A	56.7	Low	63.5	Low	89 Å²	89	80.2 Å²	80.2	74%	0.736	50%	0.501	S	S	*	.			trans	-58.2	114.6	179	0	0	0	0	0	104.1	V23 L27	V23-A25 VanDerWaalsContact C-N 3.28Å; V23-A25 PolarHBondContact O-N 3.27Å; A25-L27 PolarHBondContact O-N 3.09Å
26	S	72.3	Confident	66.3	Low	38 Å²	38	74.8 Å²	74.8	27%	0.266	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-54.5	135.6	177	38.7	0	0	0	0	107.9	S24 K86 E118	S24-S26 PolarHBondContact O-N 3.19Å; S26-K86 VanDerWaalsContact CB-CG 3.49Å; S26-E118 VanDerWaalsContact OG-CG 3.24Å; S26-E118 WeakPolarHBondContact OG-CG 3.42Å; S26-E118 PolarHBondContact OG-OE1 3.5Å
27	L	89.4	Confident	69.1	Low	60 Å²	60	68 Å²	68	31%	0.314	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-75.2	132.7	178.7	-176.3	65.1	0	0	0	108.7	A25 C29 V31 A32 P81 C85 K86	A25-L27 PolarHBondContact O-N 3.09Å; L27-C29 PolarHBondContact O-N 3.49Å; L27-V31 HydrophobicContact CD1-CB 4.32Å; L27-V31 HydrophobicContact CD1-CG1 4.01Å; L27-A32 HydrophobicContact CD2-CB 3.77Å; L27-A32 HydrophobicContact CG-CB 4.27Å; L27-P81 HydrophobicContact CD2-CB 3.51Å; L27-C85 CarbonylContact O-C 3.52Å; L27-C85 WeakPolarHBondContact O-CA 3.23Å; L27-C85 VanDerWaalsContact O-CB 3.29Å; L27-C85 WeakPolarHBondContact O-CB 3.3Å; L27-K86 PolarHBondContact O-N 3.34Å
28	D	93.8	Very high	72.2	Confident	34 Å²	34	70.5 Å²	70.5	18%	0.182	44%	0.442	C	S	.	.	B	Isolated β-bridge	trans	-65.7	132.6	174.2	178.4	-85.5	0	0	0	110.4	L30 V31 A32 K86	D28-L30 VanDerWaalsContact C-N 3.25Å; D28-L30 PolarHBondContact O-N 3.46Å; D28-L30 WeakPolarHBondContact OD1-CA 3.25Å; D28-L30 WeakPolarHBondContact OD1-CB 3.18Å; D28-L30 PolarHBondContact OD1-N 3.21Å; D28-V31 HydrophobicContact CB-CB 4.41Å; D28-V31 HydrophobicContact CB-CG2 4.04Å; D28-V31 WeakPolarHBondContact O-CB 3.39Å; D28-V31 PolarHBondContact O-N 3.49Å; D28-V31 VanDerWaalsContact O-N 3.11Å; D28-V31 PolarHBondContact OD1-N 3.2Å; D28-A32 PolarHBondContact O-N 3Å; D28-K86 WeakPolarHBondContact CA-O 3.42Å
29	C	96.5	Very high	75	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-28.9	-175.6	-65.4	0	0	0	0	113.7	L27 V31 A32 E33 C85 K86 C97 V100	L27-C29 PolarHBondContact O-N 3.49Å; C29-V31 VanDerWaalsContact C-N 3.35Å; C29-A32 PolarHBondContact O-N 3.49Å; C29-E33 WeakPolarHBondContact O-CB 3.33Å; C29-E33 PolarHBondContact O-N 3.17Å; C29-C85 WeakPolarHBondContact CA-SG 3.48Å; C29-C85 HydrophobicContact CB-CB 3.79Å; C29-C85 WeakPolarHBondContact CB-SG 3.46Å; C29-C85 WeakPolarHBondContact SG-CB 3.23Å; C29-C85 CovalentContact SG-SG 2.05Å; C29-C85 PolarHBondContact SG-SG 3.48Å; C29-K86 PolarHBondContact N-O 3.14Å; C29-K86 PolarHBondContact SG-N 3.22Å; C29-C97 VanDerWaalsContact CB-SG 3.59Å; C29-V100 HydrophobicContact CB-CB 4.11Å; C29-V100 HydrophobicContact CB-CG1 3.92Å
30	L	96.7	Very high	78.1	Confident	16 Å²	16	67.7 Å²	67.7	8%	0.084	42%	0.423	C	S	.	.	H	α-helix	trans	-72	-34	177.3	-53.5	177.9	0	0	0	111.2	D28 Q34 R93 H96 C97 V100	D28-L30 VanDerWaalsContact C-N 3.25Å; D28-L30 PolarHBondContact O-N 3.46Å; D28-L30 WeakPolarHBondContact OD1-CA 3.25Å; D28-L30 WeakPolarHBondContact OD1-CB 3.18Å; D28-L30 PolarHBondContact OD1-N 3.21Å; L30-Q34 WeakPolarHBondContact O-CB 3.43Å; L30-Q34 PolarHBondContact O-N 3.13Å; L30-R93 HydrophobicContact CD1-CB 3.68Å; L30-R93 HydrophobicContact CD1-CG 4.34Å; L30-H96 HydrophobicContact CD2-CB 4.17Å; L30-C97 HydrophobicContact CD2-CB 4.32Å; L30-C97 HydrophobicContact CG-CB 4.24Å; L30-V100 HydrophobicContact CD2-CG2 4.01Å
31	V	96.4	Very high	81.1	Confident	77 Å²	77	67.8 Å²	67.8	47%	0.467	41%	0.414	S	S	.	.	H	α-helix	trans	-67.5	-41.8	172.1	179.4	0	0	0	0	110.5	L27 D28 C29 Q34 G35	L27-V31 HydrophobicContact CD1-CB 4.32Å; L27-V31 HydrophobicContact CD1-CG1 4.01Å; D28-V31 HydrophobicContact CB-CB 4.41Å; D28-V31 HydrophobicContact CB-CG2 4.04Å; D28-V31 WeakPolarHBondContact O-CB 3.39Å; D28-V31 PolarHBondContact O-N 3.49Å; D28-V31 VanDerWaalsContact O-N 3.11Å; D28-V31 PolarHBondContact OD1-N 3.2Å; C29-V31 VanDerWaalsContact C-N 3.35Å; V31-Q34 PolarHBondContact O-N 2.89Å; V31-G35 PolarHBondContact O-N 3.48Å
32	A	96.6	Very high	84.3	Confident	2 Å²	2	61.5 Å²	61.5	2%	0.017	38%	0.376	C	S	.	.	H	α-helix	trans	-63.6	-42.3	176.4	0	0	0	0	0	112.4	L27 D28 C29 G35 C36 P81 L82 C85	L27-A32 HydrophobicContact CD2-CB 3.77Å; L27-A32 HydrophobicContact CG-CB 4.27Å; D28-A32 PolarHBondContact O-N 3Å; C29-A32 PolarHBondContact O-N 3.49Å; A32-G35 PolarHBondContact O-N 2.95Å; A32-C36 PolarHBondContact O-N 3.29Å; A32-P81 HydrophobicContact CB-CB 4.07Å; A32-L82 HydrophobicContact CB-CD2 3.82Å; A32-L82 HydrophobicContact CB-CG 4.22Å; A32-C85 HydrophobicContact CB-CB 4.04Å
33	E	97.3	Very high	87.3	Confident	27 Å²	27	61.3 Å²	61.3	13%	0.126	36%	0.362	C	S	.	.	H	α-helix	trans	-59.8	-49.7	173.3	-175	-163.6	-169.3	0	0	110.7	C29 G35 C36 V37 Y46 H96 V100	C29-E33 WeakPolarHBondContact O-CB 3.33Å; C29-E33 PolarHBondContact O-N 3.17Å; E33-G35 PolarHBondContact O-N 3.49Å; E33-C36 WeakPolarHBondContact O-CB 3.4Å; E33-C36 PolarHBondContact O-N 2.96Å; E33-V37 HydrophobicContact CG-CG1 4.27Å; E33-V37 WeakPolarHBondContact O-CG1 3.43Å; E33-V37 WeakPolarHBondContact O-CG2 3.49Å; E33-V37 PolarHBondContact O-N 3.04Å; E33-Y46 HydrophobicContact CG-CE1 3.89Å; E33-H96 IonicContact OE2-CE1 3.83Å; E33-H96 IonicContact OE2-NE2 3.53Å; E33-V100 HydrophobicContact CB-CG1 3.97Å; E33-V100 HydrophobicContact CB-CG2 4.19Å; E33-V100 HydrophobicContact CG-CG2 4.26Å
34	Q	97	Very high	90.1	Very high	124 Å²	124	57.7 Å²	57.7	58%	0.579	35%	0.349	S	S	*	.	H	α-helix	trans	-56.8	-40.2	178.9	-170.9	176.6	18.6	0	0	111.6	L30 V31 V37 Q38	L30-Q34 WeakPolarHBondContact O-CB 3.43Å; L30-Q34 PolarHBondContact O-N 3.13Å; V31-Q34 PolarHBondContact O-N 2.89Å; Q34-V37 VanDerWaalsContact O-CG2 3.3Å; Q34-V37 WeakPolarHBondContact O-CG2 3.47Å; Q34-Q38 VanDerWaalsContact O-CG 3.23Å; Q34-Q38 WeakPolarHBondContact O-CG 3.34Å
35	G	96.3	Very high	92.6	Very high	32 Å²	32	55 Å²	55	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-45.3	173.1	0	0	0	0	0	112.6	V31 A32 E33 Q38	V31-G35 PolarHBondContact O-N 3.48Å; A32-G35 PolarHBondContact O-N 2.95Å; E33-G35 PolarHBondContact O-N 3.49Å; G35-Q38 PolarHBondContact O-N 3.11Å
36	C	96.6	Very high	94.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-43.2	-179	179.3	0	0	0	0	112.5	A32 E33 Q38 E39 C42 K43 Y79 L82	A32-C36 PolarHBondContact O-N 3.29Å; E33-C36 WeakPolarHBondContact O-CB 3.4Å; E33-C36 PolarHBondContact O-N 2.96Å; C36-Q38 PolarHBondContact O-N 3.26Å; C36-E39 PolarHBondContact O-N 3.35Å; C36-C42 VanDerWaalsContact CA-SG 3.54Å; C36-C42 HydrophobicContact CB-CB 4.03Å; C36-C42 WeakPolarHBondContact CB-SG 3.41Å; C36-C42 WeakPolarHBondContact O-CB 3.39Å; C36-C42 WeakPolarHBondContact SG-CB 3.41Å; C36-C42 PolarHBondContact SG-O 2.03Å; C36-C42 CovalentContact SG-SG 2.03Å; C36-C42 PolarHBondContact SG-SG 3.29Å; C36-K43 PolarHBondContact O-N 2.98Å; C36-Y79 HydrophobicContact CB-CD1 4.44Å; C36-Y79 HydrophobicContact CB-CE1 3.82Å; C36-Y79 PolarHBondContact N-OH 2.9Å; C36-Y79 VanDerWaalsContact N-OH 3.11Å; C36-L82 HydrophobicContact CB-CD1 3.71Å; C36-L82 HydrophobicContact CB-CG 4.47Å
37	V	96.3	Very high	95.7	Very high	37 Å²	37	55.2 Å²	55.2	22%	0.224	30%	0.302	C	S	.	.	H	α-helix	trans	-70	-15.7	-177.3	-60.7	0	0	0	0	113.5	E33 Q34 K43 Y46	E33-V37 HydrophobicContact CG-CG1 4.27Å; E33-V37 WeakPolarHBondContact O-CG1 3.43Å; E33-V37 WeakPolarHBondContact O-CG2 3.49Å; E33-V37 PolarHBondContact O-N 3.04Å; Q34-V37 VanDerWaalsContact O-CG2 3.3Å; Q34-V37 WeakPolarHBondContact O-CG2 3.47Å; V37-K43 WeakPolarHBondContact O-CD 3.42Å; V37-Y46 HydrophobicContact CG1-CD1 4.4Å
38	Q	96.5	Very high	96	Very high	150 Å²	150	54.9 Å²	54.9	70%	0.701	30%	0.3	S	S	*	.	H	α-helix	trans	-83.4	-19.2	172.8	-63.8	-69.6	5.3	0	0	112.6	Q34 G35 C36	Q34-Q38 VanDerWaalsContact O-CG 3.23Å; Q34-Q38 WeakPolarHBondContact O-CG 3.34Å; G35-Q38 PolarHBondContact O-N 3.11Å; C36-Q38 PolarHBondContact O-N 3.26Å
39	E	96	Very high	96.1	Very high	86 Å²	86	53.3 Å²	53.3	40%	0.402	29%	0.292	S	S	.	.	S	Bend	trans	-97.7	115.6	178.4	-161.3	-170.2	144.6	0	0	109.9	C36 S41 C42 K43	C36-E39 PolarHBondContact O-N 3.35Å; E39-S41 VanDerWaalsContact C-N 3.28Å; E39-S41 WeakPolarHBondContact CG-OG 3.02Å; E39-S41 PolarHBondContact O-N 3.03Å; E39-S41 PolarHBondContact OE1-OG 3.35Å; E39-C42 HydrophobicContact CB-CB 4.08Å; E39-C42 PolarHBondContact O-N 3.36Å; E39-C42 VanDerWaalsContact O-N 3.09Å; E39-K43 WeakPolarHBondContact O-CB 3.13Å; E39-K43 PolarHBondContact O-N 2.67Å
40	P	94.4	Very high	96	Very high	111 Å²	111	55 Å²	55	72%	0.721	30%	0.3	S	S	*	.	H	α-helix	trans	-57.1	-37.2	-173.3	-27.3	35	0	0	0	114.7	G44	P40-G44 PolarHBondContact O-N 2.71Å
41	S	91.5	Very high	96	Very high	71 Å²	71	61.1 Å²	61.1	50%	0.497	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-47.9	174.9	32.7	0	0	0	0	112.1	E39 I45	E39-S41 VanDerWaalsContact C-N 3.28Å; E39-S41 WeakPolarHBondContact CG-OG 3.02Å; E39-S41 PolarHBondContact O-N 3.03Å; E39-S41 PolarHBondContact OE1-OG 3.35Å; S41-I45 WeakPolarHBondContact O-CD1 3.39Å
42	C	96	Very high	95.9	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.034	30%	0.301	C	S	.	.	H	α-helix	trans	-72.1	-44.6	179.8	-167.2	0	0	0	0	111.4	C36 E39 G44 I45 Y46 Y79	C36-C42 VanDerWaalsContact CA-SG 3.54Å; C36-C42 HydrophobicContact CB-CB 4.03Å; C36-C42 WeakPolarHBondContact CB-SG 3.41Å; C36-C42 WeakPolarHBondContact O-CB 3.39Å; C36-C42 WeakPolarHBondContact SG-CB 3.41Å; C36-C42 PolarHBondContact SG-O 2.03Å; C36-C42 CovalentContact SG-SG 2.03Å; C36-C42 PolarHBondContact SG-SG 3.29Å; E39-C42 HydrophobicContact CB-CB 4.08Å; E39-C42 PolarHBondContact O-N 3.36Å; E39-C42 VanDerWaalsContact O-N 3.09Å; C42-G44 VanDerWaalsContact C-N 3.32Å; C42-G44 PolarHBondContact O-N 3.49Å; C42-I45 PolarHBondContact O-N 2.88Å; C42-Y46 WeakPolarHBondContact O-CB 3.09Å; C42-Y46 PolarHBondContact O-N 3.22Å; C42-Y79 HydrophobicContact CB-CD2 4.23Å; C42-Y79 HydrophobicContact CB-CE2 4.29Å
43	K	96.4	Very high	95.7	Very high	99 Å²	99	58.6 Å²	58.6	43%	0.43	31%	0.31	S	S	.	.	H	α-helix	trans	-53.6	-45.6	-179.3	-175.3	-174	-175.9	172.6	0	112.7	C36 V37 E39 R47	C36-K43 PolarHBondContact O-N 2.98Å; V37-K43 WeakPolarHBondContact O-CD 3.42Å; E39-K43 WeakPolarHBondContact O-CB 3.13Å; E39-K43 PolarHBondContact O-N 2.67Å; K43-R47 HydrophobicContact CG-CG 4.4Å; K43-R47 WeakPolarHBondContact O-CB 3.45Å; K43-R47 WeakPolarHBondContact O-CG 3.35Å; K43-R47 PolarHBondContact O-N 3.17Å
44	G	96.1	Very high	95.5	Very high	47 Å²	47	60 Å²	60	49%	0.485	33%	0.326	S	S	.	.	H	α-helix	trans	-61.3	-48.1	-179.6	0	0	0	0	0	112.2	P40 C42 R47 L48	P40-G44 PolarHBondContact O-N 2.71Å; C42-G44 VanDerWaalsContact C-N 3.32Å; C42-G44 PolarHBondContact O-N 3.49Å; G44-R47 PolarHBondContact O-N 2.88Å; G44-L48 PolarHBondContact O-N 2.88Å; G44-L48 VanDerWaalsContact O-N 3.17Å
45	I	95.9	Very high	95.3	Very high	49 Å²	49	57.5 Å²	57.5	25%	0.251	31%	0.314	S	S	.	.	H	α-helix	trans	-66.1	-43.5	179.7	-60.1	166	0	0	0	110.8	S41 C42 R47 L48 L49 A72 L76	S41-I45 WeakPolarHBondContact O-CD1 3.39Å; C42-I45 PolarHBondContact O-N 2.88Å; I45-R47 PolarHBondContact O-N 3.36Å; I45-L48 WeakPolarHBondContact O-CB 3.49Å; I45-L48 PolarHBondContact O-N 3.14Å; I45-L49 PolarHBondContact O-N 3.41Å; I45-A72 HydrophobicContact CG2-CB 4.15Å; I45-A72 WeakPolarHBondContact CG2-O 3.46Å; I45-L76 HydrophobicContact CB-CD1 4.2Å; I45-L76 HydrophobicContact CG2-CB 4Å; I45-L76 HydrophobicContact CG2-CD1 3.96Å; I45-L76 HydrophobicContact CG2-CG 4.46Å
46	Y	96.9	Very high	95	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-43.8	179	-177	-102.2	0	0	0	112.2	E33 V37 C42 L48 L49 E50 L76 L82 V100 T103 V104	E33-Y46 HydrophobicContact CG-CE1 3.89Å; V37-Y46 HydrophobicContact CG1-CD1 4.4Å; C42-Y46 WeakPolarHBondContact O-CB 3.09Å; C42-Y46 PolarHBondContact O-N 3.22Å; Y46-L48 VanDerWaalsContact C-N 3.31Å; Y46-L48 PolarHBondContact O-N 3.03Å; Y46-L49 PolarHBondContact O-N 3.29Å; Y46-L49 VanDerWaalsContact O-N 3.14Å; Y46-E50 HydrophobicContact CD1-CG 4.15Å; Y46-E50 VanDerWaalsContact CE1-CD 3.46Å; Y46-E50 HydrophobicContact CE1-CG 3.7Å; Y46-E50 PolarHBondContact O-N 3.06Å; Y46-L76 HydrophobicContact CD2-CD2 4.28Å; Y46-L82 HydrophobicContact CD2-CD1 4.13Å; Y46-V100 HydrophobicContact CE2-CG1 4.44Å; Y46-T103 HydrophobicContact CE2-CG2 3.95Å; Y46-V104 HydrophobicContact CD2-CG1 4.04Å; Y46-V104 HydrophobicContact CE2-CG1 3.87Å
47	R	96.6	Very high	94.5	Very high	131 Å²	131	61.4 Å²	61.4	49%	0.494	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-36.6	176.9	-72.5	-78.4	173	-153.7	5.5	112.4	K43 G44 I45 E50 Y51	K43-R47 HydrophobicContact CG-CG 4.4Å; K43-R47 WeakPolarHBondContact O-CB 3.45Å; K43-R47 WeakPolarHBondContact O-CG 3.35Å; K43-R47 PolarHBondContact O-N 3.17Å; G44-R47 PolarHBondContact O-N 2.88Å; I45-R47 PolarHBondContact O-N 3.36Å; R47-E50 VanDerWaalsContact CD-OE2 3.25Å; R47-E50 WeakPolarHBondContact CD-OE2 3.32Å; R47-E50 IonicContact CZ-OE2 3.36Å; R47-E50 IonicContact NE-OE2 3.55Å; R47-E50 IonicContact NH1-OE1 3.49Å; R47-E50 PolarHBondContact NH1-OE1 3.46Å; R47-E50 IonicContact NH1-OE2 2.69Å; R47-E50 PolarHBondContact NH1-OE2 2.94Å; R47-E50 PolarHBondContact O-N 3.32Å; R47-Y51 PolarHBondContact O-N 3.24Å; R47-Y51 VanDerWaalsContact O-N 3.13Å
48	L	95.9	Very high	94.1	Very high	53 Å²	53	65.6 Å²	65.6	28%	0.277	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-45	172.6	175.6	57.5	0	0	0	111	G44 I45 Y46 E50 Y51 C52 E68 A72	G44-L48 PolarHBondContact O-N 2.88Å; G44-L48 VanDerWaalsContact O-N 3.17Å; I45-L48 WeakPolarHBondContact O-CB 3.49Å; I45-L48 PolarHBondContact O-N 3.14Å; Y46-L48 VanDerWaalsContact C-N 3.31Å; Y46-L48 PolarHBondContact O-N 3.03Å; L48-E50 PolarHBondContact O-N 2.92Å; L48-Y51 WeakPolarHBondContact O-CB 3.37Å; L48-Y51 PolarHBondContact O-N 3.23Å; L48-C52 PolarHBondContact O-N 3.4Å; L48-C52 PolarHBondContact O-SG 3.14Å; L48-E68 HydrophobicContact CD2-CG 4.31Å; L48-A72 HydrophobicContact CD2-CB 3.68Å; L48-A72 HydrophobicContact CG-CB 4.06Å
49	L	95.9	Very high	93.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.1	-37	176.3	-73.2	175.5	0	0	0	113.4	I45 Y46 Y51 C52 A53 C69 A72 Q73 L76 T103 F106	I45-L49 PolarHBondContact O-N 3.41Å; Y46-L49 PolarHBondContact O-N 3.29Å; Y46-L49 VanDerWaalsContact O-N 3.14Å; L49-Y51 VanDerWaalsContact C-N 3.29Å; L49-Y51 PolarHBondContact O-N 3.04Å; L49-C52 WeakPolarHBondContact O-CB 3.01Å; L49-C52 PolarHBondContact O-N 3.4Å; L49-A53 WeakPolarHBondContact O-CB 2.93Å; L49-A53 PolarHBondContact O-N 3.29Å; L49-C69 WeakPolarHBondContact CD2-O 3.3Å; L49-A72 HydrophobicContact CD2-CB 3.84Å; L49-A72 HydrophobicContact CG-CB 3.97Å; L49-Q73 HydrophobicContact CD2-CB 4.08Å; L49-L76 HydrophobicContact CD1-CB 4.28Å; L49-L76 HydrophobicContact CD1-CD2 3.65Å; L49-T103 HydrophobicContact CB-CG2 3.87Å; L49-F106 HydrophobicContact CD2-CB 4.32Å
50	E	95.7	Very high	93.4	Very high	36 Å²	36	62.7 Å²	62.7	17%	0.168	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-43.2	172.6	-78.1	-174.8	106.9	0	0	111.3	Y46 R47 L48 A54 T103	Y46-E50 HydrophobicContact CD1-CG 4.15Å; Y46-E50 VanDerWaalsContact CE1-CD 3.46Å; Y46-E50 HydrophobicContact CE1-CG 3.7Å; Y46-E50 PolarHBondContact O-N 3.06Å; R47-E50 VanDerWaalsContact CD-OE2 3.25Å; R47-E50 WeakPolarHBondContact CD-OE2 3.32Å; R47-E50 IonicContact CZ-OE2 3.36Å; R47-E50 IonicContact NE-OE2 3.55Å; R47-E50 IonicContact NH1-OE1 3.49Å; R47-E50 PolarHBondContact NH1-OE1 3.46Å; R47-E50 IonicContact NH1-OE2 2.69Å; R47-E50 PolarHBondContact NH1-OE2 2.94Å; R47-E50 PolarHBondContact O-N 3.32Å; L48-E50 PolarHBondContact O-N 2.92Å; E50-A54 WeakPolarHBondContact O-CB 2.98Å; E50-A54 PolarHBondContact O-N 3.03Å; E50-T103 HydrophobicContact CB-CG2 4.41Å; E50-T103 HydrophobicContact CG-CG2 3.87Å
51	Y	95.1	Very high	93.3	Very high	145 Å²	145	59.1 Å²	59.1	57%	0.569	34%	0.34	S	S	*	.	H	α-helix	trans	-63.8	-48.3	175.2	178.8	-96.5	0	0	0	111.3	R47 L48 L49 A53 A54 E55	R47-Y51 PolarHBondContact O-N 3.24Å; R47-Y51 VanDerWaalsContact O-N 3.13Å; L48-Y51 WeakPolarHBondContact O-CB 3.37Å; L48-Y51 PolarHBondContact O-N 3.23Å; L49-Y51 VanDerWaalsContact C-N 3.29Å; L49-Y51 PolarHBondContact O-N 3.04Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.15Å; Y51-A54 PolarHBondContact O-N 3.02Å; Y51-A54 VanDerWaalsContact O-N 3.17Å; Y51-E55 HydrophobicContact CD1-CG 4.1Å; Y51-E55 HydrophobicContact CD2-CG 4.29Å; Y51-E55 HydrophobicContact CE1-CG 3.63Å; Y51-E55 HydrophobicContact CE2-CG 3.85Å; Y51-E55 HydrophobicContact CG-CG 4.41Å; Y51-E55 VanDerWaalsContact CZ-CG 3.49Å; Y51-E55 WeakPolarHBondContact O-CG 3.49Å; Y51-E55 PolarHBondContact O-N 2.02Å
52	C	95.1	Very high	93.4	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.014	34%	0.341	C	S	.	.	H	α-helix	trans	-53.7	-48.6	176.2	-70.8	0	0	0	0	112.7	L48 L49 E55 E56 C69 F106	L48-C52 PolarHBondContact O-N 3.4Å; L48-C52 PolarHBondContact O-SG 3.14Å; L49-C52 WeakPolarHBondContact O-CB 3.01Å; L49-C52 PolarHBondContact O-N 3.4Å; C52-E55 PolarHBondContact O-N 3.12Å; C52-E56 WeakPolarHBondContact O-CB 3.27Å; C52-E56 PolarHBondContact O-N 3.34Å; C52-C69 HydrophobicContact CB-CB 3.63Å; C52-C69 WeakPolarHBondContact CB-SG 3.38Å; C52-C69 WeakPolarHBondContact SG-CA 3.21Å; C52-C69 WeakPolarHBondContact SG-CB 3.45Å; C52-C69 CovalentContact SG-SG 2.02Å; C52-C69 PolarHBondContact SG-SG 3.11Å; C52-F106 HydrophobicContact CB-CD2 4.06Å; C52-F106 HydrophobicContact CB-CE2 3.93Å; C52-F106 HydrophobicContact CB-CZ 4.44Å; C52-F106 WeakPolarHBondContact O-CE2 3.45Å
53	A	93	Very high	93.3	Very high	24 Å²	24	63.7 Å²	63.7	20%	0.198	37%	0.373	C	S	.	.	H	α-helix	trans	-64.8	-39.1	179.6	0	0	0	0	0	112	L49 Y51 A57	L49-A53 WeakPolarHBondContact O-CB 2.93Å; L49-A53 PolarHBondContact O-N 3.29Å; Y51-A53 VanDerWaalsContact C-N 3.34Å; Y51-A53 PolarHBondContact O-N 3.15Å; A53-A57 VanDerWaalsContact O-CB 3.3Å; A53-A57 WeakPolarHBondContact O-CB 3.33Å; A53-A57 PolarHBondContact O-N 3.26Å; A53-A57 VanDerWaalsContact O-N 3.15Å
54	A	91.6	Very high	93.2	Very high	55 Å²	55	65.2 Å²	65.2	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-66.5	-43.8	177.8	0	0	0	0	0	112.4	E50 Y51	E50-A54 WeakPolarHBondContact O-CB 2.98Å; E50-A54 PolarHBondContact O-N 3.03Å; Y51-A54 PolarHBondContact O-N 3.02Å; Y51-A54 VanDerWaalsContact O-N 3.17Å
55	E	92.8	Very high	93.1	Very high	73 Å²	73	64.3 Å²	64.3	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-68.6	-46.6	179.6	-69.5	-64.3	117.5	0	0	111.9	Y51 C52 A57 V58 S59 L61	Y51-E55 HydrophobicContact CD1-CG 4.1Å; Y51-E55 HydrophobicContact CD2-CG 4.29Å; Y51-E55 HydrophobicContact CE1-CG 3.63Å; Y51-E55 HydrophobicContact CE2-CG 3.85Å; Y51-E55 HydrophobicContact CG-CG 4.41Å; Y51-E55 VanDerWaalsContact CZ-CG 3.49Å; Y51-E55 WeakPolarHBondContact O-CG 3.49Å; Y51-E55 PolarHBondContact O-N 2.02Å; C52-E55 PolarHBondContact O-N 3.12Å; E55-A57 PolarHBondContact O-N 3.42Å; E55-V58 PolarHBondContact O-N 3.1Å; E55-S59 PolarHBondContact O-N 3.48Å; E55-L61 HydrophobicContact CB-CD2 3.62Å
56	E	90.1	Very high	93	Very high	35 Å²	35	65.8 Å²	65.8	16%	0.164	38%	0.376	C	S	.	.	H	α-helix	trans	-62.2	-31.4	178.4	-176.2	76.2	-174.2	0	0	112	C52 V58 S59 L61 R66 F106	C52-E56 WeakPolarHBondContact O-CB 3.27Å; C52-E56 PolarHBondContact O-N 3.34Å; E56-V58 VanDerWaalsContact C-N 3.25Å; E56-V58 PolarHBondContact O-N 3.28Å; E56-S59 WeakPolarHBondContact CA-O 3.18Å; E56-L61 HydrophobicContact CB-CD1 4.27Å; E56-L61 HydrophobicContact CB-CG 4.16Å; E56-L61 VanDerWaalsContact OE2-CB 3.27Å; E56-L61 WeakPolarHBondContact OE2-CB 3.46Å; E56-L61 WeakPolarHBondContact OE2-CG 3.48Å; E56-L61 PolarHBondContact OE2-N 3.2Å; E56-R66 IonicContact OE1-CZ 3.13Å; E56-R66 IonicContact OE1-NH1 3.26Å; E56-R66 PolarHBondContact OE1-NH1 3.31Å; E56-R66 IonicContact OE2-NH1 2.67Å; E56-R66 PolarHBondContact OE2-NH1 3Å; E56-F106 HydrophobicContact CB-CE2 3.7Å; E56-F106 HydrophobicContact CB-CZ 4.02Å; E56-F106 HydrophobicContact CG-CE2 4Å; E56-F106 HydrophobicContact CG-CZ 4.05Å
57	A	86.3	Confident	92.9	Very high	79 Å²	79	71.2 Å²	71.2	65%	0.653	40%	0.404	S	S	*	.	H	α-helix	trans	-66.3	-27	176	0	0	0	0	0	113	A53 E55	A53-A57 VanDerWaalsContact O-CB 3.3Å; A53-A57 WeakPolarHBondContact O-CB 3.33Å; A53-A57 PolarHBondContact O-N 3.26Å; A53-A57 VanDerWaalsContact O-N 3.15Å; E55-A57 PolarHBondContact O-N 3.42Å
58	V	88.1	Confident	92.9	Very high	124 Å²	124	70.3 Å²	70.3	75%	0.752	41%	0.406	S	S	*	.	H	α-helix	trans	-86.7	-48.7	177.4	178.8	0	0	0	0	110.6	E55 E56	E55-V58 PolarHBondContact O-N 3.1Å; E56-V58 VanDerWaalsContact C-N 3.25Å; E56-V58 PolarHBondContact O-N 3.28Å
59	S	88.6	Confident	92.9	Very high	63 Å²	63	68 Å²	68	44%	0.441	39%	0.394	S	S	.	.	S	Bend	trans	-154.3	150.1	-178.9	57.9	0	0	0	0	111.5	E55 E56 L61	E55-S59 PolarHBondContact O-N 3.48Å; E56-S59 WeakPolarHBondContact CA-O 3.18Å; S59-L61 PolarHBondContact O-N 2.95Å
60	P	90.1	Very high	92.8	Very high	112 Å²	112	71 Å²	71	73%	0.727	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-54.5	128.6	176.9	-23.8	33.4	0	0	0	111.7
61	L	91.4	Very high	92.7	Very high	37 Å²	37	75.4 Å²	75.4	19%	0.194	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-64	153.9	176.5	-71	177.5	0	0	0	111.8	E55 E56 S59 A65 R66 F106	E55-L61 HydrophobicContact CB-CD2 3.62Å; E56-L61 HydrophobicContact CB-CD1 4.27Å; E56-L61 HydrophobicContact CB-CG 4.16Å; E56-L61 VanDerWaalsContact OE2-CB 3.27Å; E56-L61 WeakPolarHBondContact OE2-CB 3.46Å; E56-L61 WeakPolarHBondContact OE2-CG 3.48Å; E56-L61 PolarHBondContact OE2-N 3.2Å; S59-L61 PolarHBondContact O-N 2.95Å; L61-A65 HydrophobicContact CB-CB 4.38Å; L61-A65 HydrophobicContact CD2-CB 4.37Å; L61-R66 HydrophobicContact CB-CB 4.26Å; L61-F106 HydrophobicContact CD1-CE2 4.32Å; L61-F106 HydrophobicContact CD1-CZ 3.69Å
62	S	94.1	Very high	92.7	Very high	73 Å²	73	68.8 Å²	68.8	51%	0.51	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62.6	156.4	166.7	71.4	0	0	0	0	110.5	D64 A65 R66	S62-D64 VanDerWaalsContact C-N 3.26Å; S62-D64 PolarHBondContact O-N 3.26Å; S62-A65 PolarHBondContact O-N 2.89Å; S62-A65 WeakPolarHBondContact OG-CB 3.43Å; S62-A65 PolarHBondContact OG-N 3.26Å; S62-R66 WeakPolarHBondContact O-CB 3.22Å; S62-R66 PolarHBondContact O-N 3.43Å
63	S	93.6	Very high	92.7	Very high	99 Å²	99	70.1 Å²	70.1	69%	0.692	41%	0.412	S	S	*	.	H	α-helix	trans	-56.2	-40.7	-178.8	-172.7	0	0	0	0	112.7	L67	S63-L67 PolarHBondContact O-N 3.39Å
64	D	94.7	Very high	92.7	Very high	130 Å²	130	73.1 Å²	73.1	70%	0.695	42%	0.424	S	S	*	.	H	α-helix	trans	-69.9	-46.1	-178.4	-62.2	-25.2	0	0	0	111.5	S62 R66 L67 E68	S62-D64 VanDerWaalsContact C-N 3.26Å; S62-D64 PolarHBondContact O-N 3.26Å; D64-R66 VanDerWaalsContact C-N 3.3Å; D64-R66 PolarHBondContact O-N 3.42Å; D64-L67 WeakPolarHBondContact O-CB 3.47Å; D64-L67 PolarHBondContact O-N 3.26Å; D64-E68 PolarHBondContact O-N 3.04Å; D64-E68 VanDerWaalsContact O-N 3.1Å
65	A	93.9	Very high	92.8	Very high	29 Å²	29	73.2 Å²	73.2	24%	0.24	42%	0.421	C	S	.	.	H	α-helix	trans	-62.3	-40.8	175.9	0	0	0	0	0	111.1	L61 S62 L67 E68 C69	L61-A65 HydrophobicContact CB-CB 4.38Å; L61-A65 HydrophobicContact CD2-CB 4.37Å; S62-A65 PolarHBondContact O-N 2.89Å; S62-A65 WeakPolarHBondContact OG-CB 3.43Å; S62-A65 PolarHBondContact OG-N 3.26Å; A65-L67 VanDerWaalsContact C-N 3.32Å; A65-L67 PolarHBondContact O-N 2.87Å; A65-E68 PolarHBondContact O-N 3.06Å; A65-C69 PolarHBondContact O-N 2.96Å; A65-C69 PolarHBondContact O-SG 2.89Å
66	R	94.2	Very high	92.8	Very high	80 Å²	80	69.8 Å²	69.8	30%	0.302	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-40.9	176	-168.3	179.6	-172	85.1	-1.8	111.6	E56 L61 S62 D64 C69 L70 F106	E56-R66 IonicContact OE1-CZ 3.13Å; E56-R66 IonicContact OE1-NH1 3.26Å; E56-R66 PolarHBondContact OE1-NH1 3.31Å; E56-R66 IonicContact OE2-NH1 2.67Å; E56-R66 PolarHBondContact OE2-NH1 3Å; L61-R66 HydrophobicContact CB-CB 4.26Å; S62-R66 WeakPolarHBondContact O-CB 3.22Å; S62-R66 PolarHBondContact O-N 3.43Å; D64-R66 VanDerWaalsContact C-N 3.3Å; D64-R66 PolarHBondContact O-N 3.42Å; R66-C69 PolarHBondContact O-N 3.33Å; R66-L70 HydrophobicContact CG-CD1 4.36Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.48Å; R66-L70 PolarHBondContact O-N 3.25Å; R66-F106 HydrophobicContact CG-CE1 4.27Å
67	L	94.8	Very high	92.7	Very high	115 Å²	115	73.1 Å²	73.1	60%	0.602	42%	0.421	S	S	*	.	H	α-helix	trans	-62.1	-43.8	177.1	-176.3	65.1	0	0	0	111.5	S63 D64 A65 C69 L70 E71	S63-L67 PolarHBondContact O-N 3.39Å; D64-L67 WeakPolarHBondContact O-CB 3.47Å; D64-L67 PolarHBondContact O-N 3.26Å; A65-L67 VanDerWaalsContact C-N 3.32Å; A65-L67 PolarHBondContact O-N 2.87Å; L67-C69 VanDerWaalsContact C-N 3.35Å; L67-C69 PolarHBondContact O-N 3.36Å; L67-L70 PolarHBondContact O-N 3.19Å; L67-E71 PolarHBondContact O-N 3.01Å
68	E	95.3	Very high	92.7	Very high	113 Å²	113	77.2 Å²	77.2	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-60.8	-43.3	176	-173.1	177.3	-171.1	0	0	111.6	L48 D64 A65 L70 E71 A72	L48-E68 HydrophobicContact CD2-CG 4.31Å; D64-E68 PolarHBondContact O-N 3.04Å; D64-E68 VanDerWaalsContact O-N 3.1Å; A65-E68 PolarHBondContact O-N 3.06Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.35Å; E68-E71 PolarHBondContact O-N 3.47Å; E68-A72 PolarHBondContact O-N 2.84Å
69	C	95.5	Very high	92.9	Very high	5 Å²	5	73.3 Å²	73.3	3%	0.034	40%	0.398	C	S	.	.	H	α-helix	trans	-62.4	-38.4	175	-62.4	0	0	0	0	112.8	L49 C52 A65 R66 L67 A72 Q73 F106	L49-C69 WeakPolarHBondContact CD2-O 3.3Å; C52-C69 HydrophobicContact CB-CB 3.63Å; C52-C69 WeakPolarHBondContact CB-SG 3.38Å; C52-C69 WeakPolarHBondContact SG-CA 3.21Å; C52-C69 WeakPolarHBondContact SG-CB 3.45Å; C52-C69 CovalentContact SG-SG 2.02Å; C52-C69 PolarHBondContact SG-SG 3.11Å; A65-C69 PolarHBondContact O-N 2.96Å; A65-C69 PolarHBondContact O-SG 2.89Å; R66-C69 PolarHBondContact O-N 3.33Å; L67-C69 VanDerWaalsContact C-N 3.35Å; L67-C69 PolarHBondContact O-N 3.36Å; C69-A72 PolarHBondContact O-N 3.34Å; C69-Q73 PolarHBondContact O-N 3.03Å; C69-F106 HydrophobicContact CB-CD1 3.88Å; C69-F106 HydrophobicContact CB-CE1 3.64Å; C69-F106 HydrophobicContact CB-CZ 4.08Å
70	L	94.6	Very high	93.1	Very high	61 Å²	61	79.2 Å²	79.2	32%	0.319	41%	0.411	S	S	.	.	H	α-helix	trans	-68.8	-37.3	176.3	-69.2	171.9	0	0	0	112	R66 L67 E68 Q73 N74 F106 A107	R66-L70 HydrophobicContact CG-CD1 4.36Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.48Å; R66-L70 PolarHBondContact O-N 3.25Å; L67-L70 PolarHBondContact O-N 3.19Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.35Å; L70-Q73 PolarHBondContact O-N 3.37Å; L70-N74 WeakPolarHBondContact O-CB 3.3Å; L70-N74 PolarHBondContact O-N 3.36Å; L70-F106 HydrophobicContact CD2-CD1 4.31Å; L70-A107 HydrophobicContact CD2-CB 3.55Å
71	E	94.9	Very high	93.3	Very high	130 Å²	130	75.9 Å²	75.9	61%	0.607	39%	0.39	S	S	*	.	H	α-helix	trans	-65.7	-40.9	174.1	-174.2	172.4	-169.9	0	0	111.7	L67 E68 N74 S75	L67-E71 PolarHBondContact O-N 3.01Å; E68-E71 PolarHBondContact O-N 3.47Å; E71-N74 PolarHBondContact O-N 3.48Å; E71-S75 WeakPolarHBondContact O-CB 3.49Å; E71-S75 PolarHBondContact O-N 3.14Å; E71-S75 PolarHBondContact O-OG 3.4Å
72	A	94.6	Very high	93.4	Very high	6 Å²	6	74.1 Å²	74.1	5%	0.05	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-45.3	172.7	0	0	0	0	0	111.4	I45 L48 L49 E68 C69 N74 S75 L76	I45-A72 HydrophobicContact CG2-CB 4.15Å; I45-A72 WeakPolarHBondContact CG2-O 3.46Å; L48-A72 HydrophobicContact CD2-CB 3.68Å; L48-A72 HydrophobicContact CG-CB 4.06Å; L49-A72 HydrophobicContact CD2-CB 3.84Å; L49-A72 HydrophobicContact CG-CB 3.97Å; E68-A72 PolarHBondContact O-N 2.84Å; C69-A72 PolarHBondContact O-N 3.34Å; A72-N74 PolarHBondContact O-N 2.89Å; A72-S75 PolarHBondContact O-N 3Å; A72-L76 PolarHBondContact O-N 3.3Å; A72-L76 VanDerWaalsContact O-N 3.09Å
73	Q	94.2	Very high	93.2	Very high	30 Å²	30	73 Å²	73	14%	0.14	37%	0.367	C	S	.	.	H	α-helix	trans	-59.4	-46.7	176	-172.8	-170.9	-82.5	0	0	111.1	L49 C69 L70 S75 L76 Q77	L49-Q73 HydrophobicContact CD2-CB 4.08Å; C69-Q73 PolarHBondContact O-N 3.03Å; L70-Q73 PolarHBondContact O-N 3.37Å; Q73-S75 VanDerWaalsContact C-N 3.32Å; Q73-S75 PolarHBondContact O-N 3.01Å; Q73-L76 PolarHBondContact O-N 3.25Å; Q73-Q77 PolarHBondContact O-N 3.46Å
74	N	93.4	Very high	93.1	Very high	86 Å²	86	71.6 Å²	71.6	46%	0.46	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-41.8	179.5	-171.1	26.6	0	0	0	111.7	L70 E71 A72 L76 Q77	L70-N74 WeakPolarHBondContact O-CB 3.3Å; L70-N74 PolarHBondContact O-N 3.36Å; E71-N74 PolarHBondContact O-N 3.48Å; A72-N74 PolarHBondContact O-N 2.89Å; N74-L76 VanDerWaalsContact C-N 3.27Å; N74-L76 PolarHBondContact O-N 2.96Å; N74-Q77 VanDerWaalsContact O-CB 3.31Å; N74-Q77 WeakPolarHBondContact O-CB 3.07Å; N74-Q77 PolarHBondContact O-N 3.05Å; N74-Q77 VanDerWaalsContact O-N 3.14Å; N74-Q77 PolarHBondContact OD1-OE1 2.99Å
75	S	93.3	Very high	93.1	Very high	57 Å²	57	65.4 Å²	65.4	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-39.4	176.3	-60.4	0	0	0	0	111.6	E71 A72 Q73 Q77	E71-S75 WeakPolarHBondContact O-CB 3.49Å; E71-S75 PolarHBondContact O-N 3.14Å; E71-S75 PolarHBondContact O-OG 3.4Å; A72-S75 PolarHBondContact O-N 3Å; Q73-S75 VanDerWaalsContact C-N 3.32Å; Q73-S75 PolarHBondContact O-N 3.01Å; S75-Q77 VanDerWaalsContact C-N 3.3Å; S75-Q77 PolarHBondContact O-N 3.36Å
76	L	92.3	Very high	93.2	Very high	2 Å²	2	66 Å²	66	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-76.5	-9.4	179.4	-151.4	69.5	0	0	0	114.2	I45 Y46 L49 A72 Q73 N74 H78 Y79 L82 Q83 V104	I45-L76 HydrophobicContact CB-CD1 4.2Å; I45-L76 HydrophobicContact CG2-CB 4Å; I45-L76 HydrophobicContact CG2-CD1 3.96Å; I45-L76 HydrophobicContact CG2-CG 4.46Å; Y46-L76 HydrophobicContact CD2-CD2 4.28Å; L49-L76 HydrophobicContact CD1-CB 4.28Å; L49-L76 HydrophobicContact CD1-CD2 3.65Å; A72-L76 PolarHBondContact O-N 3.3Å; A72-L76 VanDerWaalsContact O-N 3.09Å; Q73-L76 PolarHBondContact O-N 3.25Å; N74-L76 VanDerWaalsContact C-N 3.27Å; N74-L76 PolarHBondContact O-N 2.96Å; L76-H78 PolarHBondContact O-N 3.07Å; L76-Y79 PolarHBondContact O-N 3.23Å; L76-L82 HydrophobicContact CD1-CD1 4.43Å; L76-L82 HydrophobicContact CD2-CD1 3.91Å; L76-L82 HydrophobicContact CG-CD1 4.32Å; L76-Q83 PolarHBondContact O-NE2 3.24Å; L76-V104 HydrophobicContact CD2-CB 4.13Å; L76-V104 HydrophobicContact CD2-CG1 3.63Å
77	Q	89.4	Confident	93.2	Very high	105 Å²	105	62.1 Å²	62.1	49%	0.491	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.1	175.9	-69.9	-174.8	-5.1	0	0	112.6	Q73 N74 S75 Y79 Q83	Q73-Q77 PolarHBondContact O-N 3.46Å; N74-Q77 VanDerWaalsContact O-CB 3.31Å; N74-Q77 WeakPolarHBondContact O-CB 3.07Å; N74-Q77 PolarHBondContact O-N 3.05Å; N74-Q77 VanDerWaalsContact O-N 3.14Å; N74-Q77 PolarHBondContact OD1-OE1 2.99Å; S75-Q77 VanDerWaalsContact C-N 3.3Å; S75-Q77 PolarHBondContact O-N 3.36Å; Q77-Y79 VanDerWaalsContact C-N 3.27Å; Q77-Y79 PolarHBondContact O-N 2.98Å; Q77-Q83 WeakPolarHBondContact O-CG 3.48Å
78	H	86.6	Confident	93.1	Very high	164 Å²	164	62.1 Å²	62.1	76%	0.759	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.9	178.7	-60.5	85.1	0	0	0	112.4	L76 R80	L76-H78 PolarHBondContact O-N 3.07Å; H78-R80 VanDerWaalsContact C-N 3.33Å; H78-R80 PolarHBondContact O-N 3.45Å
79	Y	91.8	Very high	92.8	Very high	42 Å²	42	58.9 Å²	58.9	17%	0.165	28%	0.283	C	S	.	.			trans	-81.8	80.1	176	-164.3	-96.4	0	0	0	110.7	C36 C42 L76 Q77 P81 L82 Q83	C36-Y79 HydrophobicContact CB-CD1 4.44Å; C36-Y79 HydrophobicContact CB-CE1 3.82Å; C36-Y79 PolarHBondContact N-OH 2.9Å; C36-Y79 VanDerWaalsContact N-OH 3.11Å; C42-Y79 HydrophobicContact CB-CD2 4.23Å; C42-Y79 HydrophobicContact CB-CE2 4.29Å; L76-Y79 PolarHBondContact O-N 3.23Å; Q77-Y79 VanDerWaalsContact C-N 3.27Å; Q77-Y79 PolarHBondContact O-N 2.98Å; Y79-P81 VanDerWaalsContact C-N 3.33Å; Y79-P81 HydrophobicContact CD1-CB 4.13Å; Y79-P81 HydrophobicContact CD1-CG 4.2Å; Y79-P81 HydrophobicContact CE1-CB 3.61Å; Y79-P81 HydrophobicContact CE1-CG 3.74Å; Y79-P81 VanDerWaalsContact O-N 3.15Å; Y79-L82 HydrophobicContact CD1-CB 3.92Å; Y79-L82 HydrophobicContact CD1-CD1 3.68Å; Y79-L82 HydrophobicContact CD1-CG 3.68Å; Y79-L82 HydrophobicContact CE1-CD1 4.03Å; Y79-L82 HydrophobicContact CE1-CG 3.88Å; Y79-L82 PolarHBondContact O-N 2.9Å; Y79-Q83 PolarHBondContact O-N 3.4Å
80	R	92.3	Very high	92.4	Very high	188 Å²	188	59.6 Å²	59.6	71%	0.709	29%	0.291	S	S	*	.	H	α-helix	trans	-47.2	-43	-175.2	-170.3	-179.5	-176.8	-176.1	1.4	114.7	H78 L82 Q83 V84	H78-R80 VanDerWaalsContact C-N 3.33Å; H78-R80 PolarHBondContact O-N 3.45Å; R80-L82 VanDerWaalsContact C-N 3.35Å; R80-L82 PolarHBondContact O-N 3.14Å; R80-Q83 PolarHBondContact O-N 2.91Å; R80-Q83 VanDerWaalsContact O-N 3.08Å; R80-V84 HydrophobicContact CG-CG1 4.06Å; R80-V84 HydrophobicContact CG-CG2 4.49Å; R80-V84 WeakPolarHBondContact O-CG2 3.04Å; R80-V84 PolarHBondContact O-N 3.44Å
81	P	94.4	Very high	92.2	Very high	42 Å²	42	58.4 Å²	58.4	27%	0.273	29%	0.288	S	S	.	.	H	α-helix	trans	-53.5	-46.3	-178.1	-28.9	36.8	0	0	0	113.8	L27 A32 Y79 C85	L27-P81 HydrophobicContact CD2-CB 3.51Å; A32-P81 HydrophobicContact CB-CB 4.07Å; Y79-P81 VanDerWaalsContact C-N 3.33Å; Y79-P81 HydrophobicContact CD1-CB 4.13Å; Y79-P81 HydrophobicContact CD1-CG 4.2Å; Y79-P81 HydrophobicContact CE1-CB 3.61Å; Y79-P81 HydrophobicContact CE1-CG 3.74Å; Y79-P81 VanDerWaalsContact O-N 3.15Å; P81-C85 WeakPolarHBondContact O-CB 3.41Å; P81-C85 PolarHBondContact O-N 3.41Å
82	L	93.3	Very high	92	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-71.8	-30.5	178.5	-74.9	169.9	0	0	0	112.6	A32 C36 Y46 L76 Y79 R80 C85 V100 V104	A32-L82 HydrophobicContact CB-CD2 3.82Å; A32-L82 HydrophobicContact CB-CG 4.22Å; C36-L82 HydrophobicContact CB-CD1 3.71Å; C36-L82 HydrophobicContact CB-CG 4.47Å; Y46-L82 HydrophobicContact CD2-CD1 4.13Å; L76-L82 HydrophobicContact CD1-CD1 4.43Å; L76-L82 HydrophobicContact CD2-CD1 3.91Å; L76-L82 HydrophobicContact CG-CD1 4.32Å; Y79-L82 HydrophobicContact CD1-CB 3.92Å; Y79-L82 HydrophobicContact CD1-CD1 3.68Å; Y79-L82 HydrophobicContact CD1-CG 3.68Å; Y79-L82 HydrophobicContact CE1-CD1 4.03Å; Y79-L82 HydrophobicContact CE1-CG 3.88Å; Y79-L82 PolarHBondContact O-N 2.9Å; R80-L82 VanDerWaalsContact C-N 3.35Å; R80-L82 PolarHBondContact O-N 3.14Å; L82-C85 PolarHBondContact O-SG 3.41Å; L82-C85 VanDerWaalsContact O-SG 3.34Å; L82-V100 HydrophobicContact CD2-CG1 3.83Å; L82-V104 HydrophobicContact CB-CG1 4.13Å; L82-V104 HydrophobicContact CD1-CG1 4.08Å; L82-V104 HydrophobicContact CD2-CG1 4.22Å; L82-V104 HydrophobicContact CG-CG1 4.38Å
83	Q	90.6	Very high	92	Very high	48 Å²	48	69.7 Å²	69.7	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-74.6	-29	-179	-60.9	-54.2	-34.8	0	0	113.5	L76 Q77 Y79 R80 R105	L76-Q83 PolarHBondContact O-NE2 3.24Å; Q77-Q83 WeakPolarHBondContact O-CG 3.48Å; Y79-Q83 PolarHBondContact O-N 3.4Å; R80-Q83 PolarHBondContact O-N 2.91Å; R80-Q83 VanDerWaalsContact O-N 3.08Å; Q83-R105 PolarHBondContact O-NH2 3.4Å
84	V	91.4	Very high	92	Very high	71 Å²	71	68.9 Å²	68.9	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-104.5	0	-179.7	-53.5	0	0	0	0	113.5	R80	R80-V84 HydrophobicContact CG-CG1 4.06Å; R80-V84 HydrophobicContact CG-CG2 4.49Å; R80-V84 WeakPolarHBondContact O-CG2 3.04Å; R80-V84 PolarHBondContact O-N 3.44Å
85	C	94.6	Very high	92	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	33%	0.329	C	S	.	.			trans	-66	153.8	-176.5	80	0	0	0	0	112.2	L27 C29 A32 P81 L82 Y101	L27-C85 CarbonylContact O-C 3.52Å; L27-C85 WeakPolarHBondContact O-CA 3.23Å; L27-C85 VanDerWaalsContact O-CB 3.29Å; L27-C85 WeakPolarHBondContact O-CB 3.3Å; C29-C85 WeakPolarHBondContact CA-SG 3.48Å; C29-C85 HydrophobicContact CB-CB 3.79Å; C29-C85 WeakPolarHBondContact CB-SG 3.46Å; C29-C85 WeakPolarHBondContact SG-CB 3.23Å; C29-C85 CovalentContact SG-SG 2.05Å; C29-C85 PolarHBondContact SG-SG 3.48Å; A32-C85 HydrophobicContact CB-CB 4.04Å; P81-C85 WeakPolarHBondContact O-CB 3.41Å; P81-C85 PolarHBondContact O-N 3.41Å; L82-C85 PolarHBondContact O-SG 3.41Å; L82-C85 VanDerWaalsContact O-SG 3.34Å; C85-Y101 WeakPolarHBondContact O-CE2 3.46Å
86	K	95.2	Very high	92.2	Very high	40 Å²	40	73.1 Å²	73.1	17%	0.174	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-135.6	165.5	177.5	-62.5	-64.2	-179	-176.3	0	110.8	S26 L27 D28 C29 S115 P116 E118	S26-K86 VanDerWaalsContact CB-CG 3.49Å; L27-K86 PolarHBondContact O-N 3.34Å; D28-K86 WeakPolarHBondContact CA-O 3.42Å; C29-K86 PolarHBondContact N-O 3.14Å; C29-K86 PolarHBondContact SG-N 3.22Å; K86-S115 PolarHBondContact NZ-O 3.35Å; K86-P116 CarbonylContact C-O 3.57Å; K86-P116 VanDerWaalsContact CA-O 3.28Å; K86-P116 WeakPolarHBondContact CA-O 3.42Å; K86-P116 WeakPolarHBondContact CD-O 3.36Å; K86-E118 HydrophobicContact CB-CB 4.49Å; K86-E118 HydrophobicContact CB-CG 3.71Å
87	C	95.2	Very high	92.4	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-113.9	147.3	178.9	-64.9	0	0	0	0	112.1	C97 L98 P116 Y117 E118	C87-C97 WeakPolarHBondContact CA-SG 3.44Å; C87-C97 HydrophobicContact CB-CB 3.91Å; C87-C97 WeakPolarHBondContact CB-SG 3.47Å; C87-C97 WeakPolarHBondContact SG-CB 3.27Å; C87-C97 PolarHBondContact SG-O 2.92Å; C87-C97 CovalentContact SG-SG 2.04Å; C87-C97 PolarHBondContact SG-SG 3.4Å; C87-L98 HydrophobicContact CB-CD2 4.02Å; C87-P116 PolarHBondContact N-O 3.39Å; C87-Y117 HydrophobicContact CB-CD1 4.18Å; C87-Y117 HydrophobicContact CB-CE1 4.37Å; C87-Y117 CarbonylContact O-C 3.42Å; C87-Y117 VanDerWaalsContact O-CA 3.24Å; C87-Y117 WeakPolarHBondContact O-CA 3.47Å; C87-Y117 WeakPolarHBondContact O-CD1 3.28Å; C87-E118 PolarHBondContact O-N 3.5Å
88	Q	92	Very high	92.7	Very high	115 Å²	115	68.2 Å²	68.2	54%	0.537	31%	0.308	S	S	.	.			trans	-90	122.4	172.7	-172.1	-179.7	7.2	0	0	110.6	S91	Q88-S91 VanDerWaalsContact O-CB 3.28Å; Q88-S91 WeakPolarHBondContact O-CB 3.47Å; Q88-S91 PolarHBondContact O-N 3.22Å
89	R	89.9	Confident	93.1	Very high	45 Å²	45	65.3 Å²	65.3	17%	0.17	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	136.7	175.9	171.1	162	-174.4	-155.4	-8	112.3	S91 E94 Y117 K292	R89-S91 PolarHBondContact O-N 3.19Å; R89-E94 WeakPolarHBondContact CA-OE1 3.34Å; R89-Y117 HydrophobicContact CB-CD1 3.94Å; R89-Y117 HydrophobicContact CB-CE1 4.21Å; R89-K292 PolarHBondContact NH1-O 3.2Å
90	G	86.3	Confident	93.3	Very high	19 Å²	19	63.3 Å²	63.3	20%	0.196	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	7.5	177.2	0	0	0	0	0	114.1	E94	G90-E94 WeakPolarHBondContact CA-OE2 3.36Å; G90-E94 PolarHBondContact N-OE2 3.01Å
91	S	90.8	Very high	93.4	Very high	37 Å²	37	54.5 Å²	54.5	26%	0.259	25%	0.252	S	S	.	.			trans	-68.9	145.5	172.9	177.4	0	0	0	0	110.5	Q88 R89 R93 E94	Q88-S91 VanDerWaalsContact O-CB 3.28Å; Q88-S91 WeakPolarHBondContact O-CB 3.47Å; Q88-S91 PolarHBondContact O-N 3.22Å; R89-S91 PolarHBondContact O-N 3.19Å; S91-R93 PolarHBondContact O-N 3.09Å; S91-R93 PolarHBondContact OG-N 2.9Å; S91-E94 WeakPolarHBondContact O-CB 3.48Å; S91-E94 PolarHBondContact O-N 3.35Å
92	R	90.3	Very high	93.4	Very high	225 Å²	225	53.3 Å²	53.3	85%	0.849	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.1	173.8	-66	-174.2	-177.2	-172.9	-0	112.9
93	R	94.4	Very high	93.4	Very high	148 Å²	148	53.3 Å²	53.3	56%	0.558	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	15.5	179.6	-55.2	-178.9	-68.8	172.8	1.8	112.9	L30 S91 E95 H96 C97	L30-R93 HydrophobicContact CD1-CB 3.68Å; L30-R93 HydrophobicContact CD1-CG 4.34Å; S91-R93 PolarHBondContact O-N 3.09Å; S91-R93 PolarHBondContact OG-N 2.9Å; R93-E95 PolarHBondContact O-N 3.35Å; R93-H96 PolarHBondContact O-N 3.06Å; R93-C97 WeakPolarHBondContact O-CB 3.46Å; R93-C97 PolarHBondContact O-N 3.29Å
94	E	94.4	Very high	93.5	Very high	13 Å²	13	51.1 Å²	51.1	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-57	-48.9	-177	178.6	169.6	-150.9	0	0	111.9	R89 G90 S91 H96 C97 L98 Y117 R264	R89-E94 WeakPolarHBondContact CA-OE1 3.34Å; G90-E94 WeakPolarHBondContact CA-OE2 3.36Å; G90-E94 PolarHBondContact N-OE2 3.01Å; S91-E94 WeakPolarHBondContact O-CB 3.48Å; S91-E94 PolarHBondContact O-N 3.35Å; E94-H96 PolarHBondContact O-N 3.36Å; E94-C97 WeakPolarHBondContact O-CB 3.34Å; E94-C97 PolarHBondContact O-N 3.38Å; E94-C97 VanDerWaalsContact O-N 3.14Å; E94-L98 HydrophobicContact CG-CD1 3.95Å; E94-L98 HydrophobicContact CG-CG 4.28Å; E94-L98 VanDerWaalsContact O-CG 3.3Å; E94-L98 WeakPolarHBondContact O-CG 3.47Å; E94-L98 PolarHBondContact O-N 3.36Å; E94-Y117 HydrophobicContact CG-CE1 4.25Å; E94-Y117 WeakPolarHBondContact OE1-CE1 2.95Å; E94-Y117 PolarHBondContact OE1-OH 3.43Å; E94-Y117 VanDerWaalsContact OE1-OH 3.13Å; E94-R264 VanDerWaalsContact CD-NH2 3.32Å; E94-R264 IonicContact OE1-CZ 3.49Å; E94-R264 IonicContact OE1-NH1 2.66Å; E94-R264 PolarHBondContact OE1-NH1 2.99Å; E94-R264 IonicContact OE1-NH2 2.69Å; E94-R264 PolarHBondContact OE1-NH2 3.28Å; E94-R264 IonicContact OE2-NH2 2.79Å; E94-R264 PolarHBondContact OE2-NH2 3.45Å; E94-R264 VanDerWaalsContact OE2-NH2 3.13Å
95	E	93.9	Very high	93.4	Very high	140 Å²	140	49.5 Å²	49.5	65%	0.654	22%	0.218	S	C	*	.	H	α-helix	trans	-56.8	-47.4	179.4	-68.1	180	170.9	0	0	112	R93 C97 L98 K99	R93-E95 PolarHBondContact O-N 3.35Å; E95-C97 PolarHBondContact O-N 2.95Å; E95-L98 PolarHBondContact O-N 3.3Å; E95-K99 PolarHBondContact O-N 3.46Å
96	H	96.2	Very high	93	Very high	92 Å²	92	49.6 Å²	49.6	43%	0.426	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-43.9	176.8	-172.4	-174.1	0	0	0	111.6	L30 E33 R93 E94 L98 K99 V100	L30-H96 HydrophobicContact CD2-CB 4.17Å; E33-H96 IonicContact OE2-CE1 3.83Å; E33-H96 IonicContact OE2-NE2 3.53Å; R93-H96 PolarHBondContact O-N 3.06Å; E94-H96 PolarHBondContact O-N 3.36Å; H96-L98 VanDerWaalsContact C-N 3.33Å; H96-L98 PolarHBondContact O-N 2.67Å; H96-K99 WeakPolarHBondContact O-CB 3.44Å; H96-K99 PolarHBondContact O-N 2.98Å; H96-V100 WeakPolarHBondContact O-CG2 3.25Å; H96-V100 PolarHBondContact O-N 3.3Å
97	C	97.4	Very high	92.3	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-44.1	178.3	-176.1	0	0	0	0	112.1	C29 L30 C87 R93 E94 E95 K99 V100 Y101	C29-C97 VanDerWaalsContact CB-SG 3.59Å; L30-C97 HydrophobicContact CD2-CB 4.32Å; L30-C97 HydrophobicContact CG-CB 4.24Å; C87-C97 WeakPolarHBondContact CA-SG 3.44Å; C87-C97 HydrophobicContact CB-CB 3.91Å; C87-C97 WeakPolarHBondContact CB-SG 3.47Å; C87-C97 WeakPolarHBondContact SG-CB 3.27Å; C87-C97 PolarHBondContact SG-O 2.92Å; C87-C97 CovalentContact SG-SG 2.04Å; C87-C97 PolarHBondContact SG-SG 3.4Å; R93-C97 WeakPolarHBondContact O-CB 3.46Å; R93-C97 PolarHBondContact O-N 3.29Å; E94-C97 WeakPolarHBondContact O-CB 3.34Å; E94-C97 PolarHBondContact O-N 3.38Å; E94-C97 VanDerWaalsContact O-N 3.14Å; E95-C97 PolarHBondContact O-N 2.95Å; C97-K99 VanDerWaalsContact C-N 3.34Å; C97-V100 PolarHBondContact O-N 3.2Å; C97-Y101 PolarHBondContact O-N 3.09Å
98	L	95.8	Very high	91.1	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-40.3	178.2	-66.9	176.7	0	0	0	111.4	C87 E94 E95 H96 V100 Y101 W102 P116 Y117 L260 S263	C87-L98 HydrophobicContact CB-CD2 4.02Å; E94-L98 HydrophobicContact CG-CD1 3.95Å; E94-L98 HydrophobicContact CG-CG 4.28Å; E94-L98 VanDerWaalsContact O-CG 3.3Å; E94-L98 WeakPolarHBondContact O-CG 3.47Å; E94-L98 PolarHBondContact O-N 3.36Å; E95-L98 PolarHBondContact O-N 3.3Å; H96-L98 VanDerWaalsContact C-N 3.33Å; H96-L98 PolarHBondContact O-N 2.67Å; L98-V100 VanDerWaalsContact C-N 3.32Å; L98-V100 PolarHBondContact O-N 2.98Å; L98-Y101 WeakPolarHBondContact O-CB 3.49Å; L98-Y101 PolarHBondContact O-N 2.66Å; L98-Y101 VanDerWaalsContact O-N 3.14Å; L98-W102 PolarHBondContact O-N 3.27Å; L98-P116 HydrophobicContact CD2-CB 3.91Å; L98-P116 HydrophobicContact CD2-CG 3.92Å; L98-Y117 WeakPolarHBondContact CD1-OH 3.33Å; L98-Y117 HydrophobicContact CD2-CE1 3.95Å; L98-L260 HydrophobicContact CD1-CD1 4.04Å; L98-S263 WeakPolarHBondContact CD2-OG 3.21Å
99	K	95.1	Very high	89.6	Confident	102 Å²	102	48.8 Å²	48.8	44%	0.443	23%	0.226	S	C	.	.	H	α-helix	trans	-55.7	-47.2	173.1	-173.3	-179.5	178.7	-173.7	0	111.7	E95 H96 C97 Y101 W102 T103 E259	E95-K99 PolarHBondContact O-N 3.46Å; H96-K99 WeakPolarHBondContact O-CB 3.44Å; H96-K99 PolarHBondContact O-N 2.98Å; C97-K99 VanDerWaalsContact C-N 3.34Å; K99-Y101 PolarHBondContact O-N 2.75Å; K99-W102 PolarHBondContact O-N 3.1Å; K99-T103 VanDerWaalsContact O-CB 3.28Å; K99-T103 WeakPolarHBondContact O-CB 3.43Å; K99-T103 PolarHBondContact O-N 3.28Å; K99-T103 PolarHBondContact O-OG1 3.02Å; K99-E259 WeakPolarHBondContact CA-OE1 3.19Å; K99-E259 WeakPolarHBondContact CA-OE2 3.32Å; K99-E259 WeakPolarHBondContact CB-OE2 3.47Å
100	V	96.1	Very high	88	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.8	-47.5	175.1	177.2	0	0	0	0	110.9	C29 L30 E33 Y46 L82 H96 C97 L98 W102 T103 V104	C29-V100 HydrophobicContact CB-CB 4.11Å; C29-V100 HydrophobicContact CB-CG1 3.92Å; L30-V100 HydrophobicContact CD2-CG2 4.01Å; E33-V100 HydrophobicContact CB-CG1 3.97Å; E33-V100 HydrophobicContact CB-CG2 4.19Å; E33-V100 HydrophobicContact CG-CG2 4.26Å; Y46-V100 HydrophobicContact CE2-CG1 4.44Å; L82-V100 HydrophobicContact CD2-CG1 3.83Å; H96-V100 WeakPolarHBondContact O-CG2 3.25Å; H96-V100 PolarHBondContact O-N 3.3Å; C97-V100 PolarHBondContact O-N 3.2Å; L98-V100 VanDerWaalsContact C-N 3.32Å; L98-V100 PolarHBondContact O-N 2.98Å; V100-W102 VanDerWaalsContact C-N 3.34Å; V100-W102 PolarHBondContact O-N 2.93Å; V100-T103 PolarHBondContact O-N 3.38Å; V100-V104 PolarHBondContact O-N 3.38Å
101	Y	95	Very high	86.6	Confident	3 Å²	3	59.8 Å²	59.8	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-42.7	-178.9	-178	-85.3	0	0	0	112.7	C85 C97 L98 K99 V104 R105 V114 P116	C85-Y101 WeakPolarHBondContact O-CE2 3.46Å; C97-Y101 PolarHBondContact O-N 3.09Å; L98-Y101 WeakPolarHBondContact O-CB 3.49Å; L98-Y101 PolarHBondContact O-N 2.66Å; L98-Y101 VanDerWaalsContact O-N 3.14Å; K99-Y101 PolarHBondContact O-N 2.75Å; Y101-V104 WeakPolarHBondContact O-CG2 3.28Å; Y101-R105 VanDerWaalsContact CE2-NH1 3.28Å; Y101-R105 PolarHBondContact O-NH1 3.21Å; Y101-V114 PolarHBondContact OH-O 3.21Å; Y101-P116 HydrophobicContact CD1-CB 3.59Å; Y101-P116 HydrophobicContact CD2-CB 3.95Å; Y101-P116 HydrophobicContact CE1-CB 3.58Å; Y101-P116 HydrophobicContact CE2-CB 3.94Å; Y101-P116 HydrophobicContact CG-CB 3.77Å
102	W	93.4	Very high	85.1	Confident	17 Å²	17	59.5 Å²	59.5	6%	0.064	27%	0.273	C	S	.	.	H	α-helix	trans	-81.6	-29.6	-178.4	-68.4	117	0	0	0	113.2	L98 K99 V100 V104 R105 F106 P116 R262 S263	L98-W102 PolarHBondContact O-N 3.27Å; K99-W102 PolarHBondContact O-N 3.1Å; V100-W102 VanDerWaalsContact C-N 3.34Å; V100-W102 PolarHBondContact O-N 2.93Å; W102-V104 VanDerWaalsContact C-N 3.28Å; W102-V104 PolarHBondContact O-N 3.48Å; W102-R105 HydrophobicContact CE3-CB 4.35Å; W102-R105 CarbonylContact O-C 3.2Å; W102-R105 WeakPolarHBondContact O-CA 3.23Å; W102-R105 PolarHBondContact O-N 3.5Å; W102-F106 PolarHBondContact O-N 3.12Å; W102-P116 HydrophobicContact CZ2-CG 4.34Å; W102-R262 HydrophobicContact CH2-CG 4.13Å; W102-R262 HydrophobicContact CZ2-CG 3.85Å; W102-R262 VanDerWaalsContact CZ3-NE 3.34Å; W102-S263 PolarHBondContact NE1-OG 3.13Å
103	T	93.4	Very high	83.9	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-43.3	174	-64	0	0	0	0	111.4	Y46 L49 E50 K99 V100 R105	Y46-T103 HydrophobicContact CE2-CG2 3.95Å; L49-T103 HydrophobicContact CB-CG2 3.87Å; E50-T103 HydrophobicContact CB-CG2 4.41Å; E50-T103 HydrophobicContact CG-CG2 3.87Å; K99-T103 VanDerWaalsContact O-CB 3.28Å; K99-T103 WeakPolarHBondContact O-CB 3.43Å; K99-T103 PolarHBondContact O-N 3.28Å; K99-T103 PolarHBondContact O-OG1 3.02Å; V100-T103 PolarHBondContact O-N 3.38Å; T103-R105 PolarHBondContact O-N 2.89Å
104	V	92.3	Very high	83.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.4	179.7	-54.1	0	0	0	0	113.7	Y46 L76 L82 V100 Y101 W102	Y46-V104 HydrophobicContact CD2-CG1 4.04Å; Y46-V104 HydrophobicContact CE2-CG1 3.87Å; L76-V104 HydrophobicContact CD2-CB 4.13Å; L76-V104 HydrophobicContact CD2-CG1 3.63Å; L82-V104 HydrophobicContact CB-CG1 4.13Å; L82-V104 HydrophobicContact CD1-CG1 4.08Å; L82-V104 HydrophobicContact CD2-CG1 4.22Å; L82-V104 HydrophobicContact CG-CG1 4.38Å; V100-V104 PolarHBondContact O-N 3.38Å; Y101-V104 WeakPolarHBondContact O-CG2 3.28Å; W102-V104 VanDerWaalsContact C-N 3.28Å; W102-V104 PolarHBondContact O-N 3.48Å
105	R	90.4	Very high	83.2	Confident	37 Å²	37	51.3 Å²	51.3	14%	0.14	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	42.6	179.6	-66.4	176.1	-175.8	73.3	2.6	111	Q83 Y101 W102 T103 A107 A108	Q83-R105 PolarHBondContact O-NH2 3.4Å; Y101-R105 VanDerWaalsContact CE2-NH1 3.28Å; Y101-R105 PolarHBondContact O-NH1 3.21Å; W102-R105 HydrophobicContact CE3-CB 4.35Å; W102-R105 CarbonylContact O-C 3.2Å; W102-R105 WeakPolarHBondContact O-CA 3.23Å; W102-R105 PolarHBondContact O-N 3.5Å; T103-R105 PolarHBondContact O-N 2.89Å; R105-A107 PolarHBondContact O-N 3.45Å; R105-A108 HydrophobicContact CB-CB 4.02Å; R105-A108 WeakPolarHBondContact O-CB 3.5Å; R105-A108 PolarHBondContact O-N 3.31Å
106	F	86.2	Confident	83.2	Confident	3 Å²	3	44.6 Å²	44.6	1%	0.013	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.1	-41.9	-179.8	179.4	-104	0	0	0	113.8	L49 C52 E56 L61 R66 C69 L70 W102 Y109	L49-F106 HydrophobicContact CD2-CB 4.32Å; C52-F106 HydrophobicContact CB-CD2 4.06Å; C52-F106 HydrophobicContact CB-CE2 3.93Å; C52-F106 HydrophobicContact CB-CZ 4.44Å; C52-F106 WeakPolarHBondContact O-CE2 3.45Å; E56-F106 HydrophobicContact CB-CE2 3.7Å; E56-F106 HydrophobicContact CB-CZ 4.02Å; E56-F106 HydrophobicContact CG-CE2 4Å; E56-F106 HydrophobicContact CG-CZ 4.05Å; L61-F106 HydrophobicContact CD1-CE2 4.32Å; L61-F106 HydrophobicContact CD1-CZ 3.69Å; R66-F106 HydrophobicContact CG-CE1 4.27Å; C69-F106 HydrophobicContact CB-CD1 3.88Å; C69-F106 HydrophobicContact CB-CE1 3.64Å; C69-F106 HydrophobicContact CB-CZ 4.08Å; L70-F106 HydrophobicContact CD2-CD1 4.31Å; W102-F106 PolarHBondContact O-N 3.12Å; F106-Y109 WeakPolarHBondContact O-CD2 3.29Å; F106-Y109 WeakPolarHBondContact O-CE2 3.29Å
107	A	79.4	Confident	83.2	Confident	42 Å²	42	40.8 Å²	40.8	35%	0.347	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-10.1	-176.1	0	0	0	0	0	115.8	L70 R105 Y109	L70-A107 HydrophobicContact CD2-CB 3.55Å; R105-A107 PolarHBondContact O-N 3.45Å; A107-Y109 PolarHBondContact O-N 2.83Å
108	A	69.4	Low	82.8	Confident	35 Å²	35	43.9 Å²	43.9	29%	0.289	22%	0.221	S	C	.	.			trans	-83.1	41	-162.5	0	0	0	0	0	114.7	R105 R262	R105-A108 HydrophobicContact CB-CB 4.02Å; R105-A108 WeakPolarHBondContact O-CB 3.5Å; R105-A108 PolarHBondContact O-N 3.31Å; A108-R262 PolarHBondContact O-NH2 2.69Å
109	Y	61.5	Low	82.1	Confident	60 Å²	60	49.9 Å²	49.9	24%	0.235	25%	0.249	C	C	.	.	S	Bend	trans	-73.5	-26.2	-176.3	-70.9	-81.8	0	0	0	113.6	F106 A107 R262	F106-Y109 WeakPolarHBondContact O-CD2 3.29Å; F106-Y109 WeakPolarHBondContact O-CE2 3.29Å; A107-Y109 PolarHBondContact O-N 2.83Å; Y109-R262 VanDerWaalsContact CE1-NH1 3.33Å
110	D	55.3	Low	81.2	Confident	157 Å²	157	47.2 Å²	47.2	84%	0.84	24%	0.24	S	C	*	.	S	Bend	trans	-107.1	-11.2	-170	-75.8	-26.1	0	0	0	115.6
111	E	56.6	Low	80.2	Confident	138 Å²	138	55.2 Å²	55.2	65%	0.645	27%	0.274	S	S	*	.			trans	-122	97.8	-178.5	-113.5	174.1	175.6	0	0	112.2	E113	E111-E113 HydrophobicContact CB-CG 4.15Å; E111-E113 HydrophobicContact CG-CG 3.83Å; E111-E113 PolarHBondContact O-N 3.5Å
112	Y	60.8	Low	79	Confident	31 Å²	31	61.4 Å²	61.4	12%	0.122	31%	0.307	C	S	.	.			trans	-78.2	34.9	176.6	-62	-90.9	0	0	0	112.7	V114 R262 F265 A266 Q269	Y112-V114 VanDerWaalsContact C-N 3.25Å; Y112-V114 PolarHBondContact O-N 3.48Å; Y112-R262 HydrophobicContact CE1-CG 4.21Å; Y112-F265 HydrophobicContact CD1-CD1 4.1Å; Y112-F265 AromaticContact CE1-CD1 3.69Å; Y112-F265 HydrophobicContact CE1-CD1 3.69Å; Y112-F265 HydrophobicContact CE1-CE1 4.37Å; Y112-F265 HydrophobicContact CE2-CD1 4.39Å; Y112-F265 HydrophobicContact CE2-CE1 4.28Å; Y112-F265 AromaticContact CZ-CD1 3.86Å; Y112-A266 HydrophobicContact CD1-CB 3.9Å; Y112-Q269 VanDerWaalsContact CD2-OE1 3.27Å
113	E	64.8	Low	77.5	Confident	134 Å²	134	66.1 Å²	66.1	63%	0.626	33%	0.334	S	S	*	.			trans	-69.3	-24.6	-170	-63.5	-157.5	137.6	0	0	113	E111	E111-E113 HydrophobicContact CB-CG 4.15Å; E111-E113 HydrophobicContact CG-CG 3.83Å; E111-E113 PolarHBondContact O-N 3.5Å
114	V	83.6	Confident	76.3	Confident	76 Å²	76	68.9 Å²	68.9	46%	0.461	35%	0.348	S	S	.	.	S	Bend	trans	-133.8	119.9	-173	-172.3	0	0	0	0	112.2	Y101 Y112	Y101-V114 PolarHBondContact OH-O 3.21Å; Y112-V114 VanDerWaalsContact C-N 3.25Å; Y112-V114 PolarHBondContact O-N 3.48Å
115	S	91.2	Very high	75.5	Confident	4 Å²	4	69.5 Å²	69.5	3%	0.028	35%	0.352	C	S	.	.			trans	-62.3	136.8	172.5	178.8	0	0	0	0	111.6	K86 Y117 D267	K86-S115 PolarHBondContact NZ-O 3.35Å; S115-Y117 PolarHBondContact O-N 2.94Å; S115-Y117 PolarHBondContact OG-N 3.48Å; S115-D267 WeakPolarHBondContact CB-OD1 3.26Å; S115-D267 WeakPolarHBondContact OG-CB 3.05Å; S115-D267 PolarHBondContact OG-OD1 3.21Å
116	P	93.8	Very high	74.5	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	-71.6	-13.6	173.6	29.1	-33.6	0	0	0	113.3	K86 C87 L98 Y101 W102	K86-P116 CarbonylContact C-O 3.57Å; K86-P116 VanDerWaalsContact CA-O 3.28Å; K86-P116 WeakPolarHBondContact CA-O 3.42Å; K86-P116 WeakPolarHBondContact CD-O 3.36Å; C87-P116 PolarHBondContact N-O 3.39Å; L98-P116 HydrophobicContact CD2-CB 3.91Å; L98-P116 HydrophobicContact CD2-CG 3.92Å; Y101-P116 HydrophobicContact CD1-CB 3.59Å; Y101-P116 HydrophobicContact CD2-CB 3.95Å; Y101-P116 HydrophobicContact CE1-CB 3.58Å; Y101-P116 HydrophobicContact CE2-CB 3.94Å; Y101-P116 HydrophobicContact CG-CB 3.77Å; W102-P116 HydrophobicContact CZ2-CG 4.34Å
117	Y	94.6	Very high	73.6	Confident	11 Å²	11	80 Å²	80	4%	0.043	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-87.4	152.1	-173.8	-62.3	-71.5	0	0	0	113.1	C87 R89 E94 L98 S115 S263 R264 D267	C87-Y117 HydrophobicContact CB-CD1 4.18Å; C87-Y117 HydrophobicContact CB-CE1 4.37Å; C87-Y117 CarbonylContact O-C 3.42Å; C87-Y117 VanDerWaalsContact O-CA 3.24Å; C87-Y117 WeakPolarHBondContact O-CA 3.47Å; C87-Y117 WeakPolarHBondContact O-CD1 3.28Å; R89-Y117 HydrophobicContact CB-CD1 3.94Å; R89-Y117 HydrophobicContact CB-CE1 4.21Å; E94-Y117 HydrophobicContact CG-CE1 4.25Å; E94-Y117 WeakPolarHBondContact OE1-CE1 2.95Å; E94-Y117 PolarHBondContact OE1-OH 3.43Å; E94-Y117 VanDerWaalsContact OE1-OH 3.13Å; L98-Y117 WeakPolarHBondContact CD1-OH 3.33Å; L98-Y117 HydrophobicContact CD2-CE1 3.95Å; S115-Y117 PolarHBondContact O-N 2.94Å; S115-Y117 PolarHBondContact OG-N 3.48Å; Y117-S263 WeakPolarHBondContact OH-CB 3.49Å; Y117-R264 PolarHBondContact OH-NH1 3.34Å; Y117-D267 HydrophobicContact CD2-CB 3.9Å; Y117-D267 HydrophobicContact CE2-CB 4.3Å
118	E	90	Very high	73.1	Confident	68 Å²	68	78.6 Å²	78.6	32%	0.318	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-60.4	145.7	167.9	-56.1	-160.8	137.4	0	0	110.6	S26 K86 C87 L120	S26-E118 VanDerWaalsContact OG-CG 3.24Å; S26-E118 WeakPolarHBondContact OG-CG 3.42Å; S26-E118 PolarHBondContact OG-OE1 3.5Å; K86-E118 HydrophobicContact CB-CB 4.49Å; K86-E118 HydrophobicContact CB-CG 3.71Å; C87-E118 PolarHBondContact O-N 3.5Å; E118-L120 PolarHBondContact O-N 3.36Å
119	E	82	Confident	73.2	Confident	128 Å²	128	80.6 Å²	80.6	60%	0.598	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-64.9	136	170.3	-61.1	-171.7	171.1	0	0	109.9	K121 R284	E119-K121 PolarHBondContact O-N 2.9Å; E119-R284 IonicContact OE1-CZ 3.16Å; E119-R284 IonicContact OE1-NH1 3.37Å; E119-R284 IonicContact OE1-NH2 3.93Å; E119-R284 PolarHBondContact OE1-NH2 2.97Å; E119-R284 IonicContact OE2-NH2 3.68Å; E119-R284 PolarHBondContact OE2-NH2 2.9Å
120	L	76.1	Confident	73.2	Confident	46 Å²	46	80.7 Å²	80.7	24%	0.241	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-60.2	133.9	177.5	-72.9	138.4	0	0	0	109.5	E118 L122 L124 V125 M289 K292	E118-L120 PolarHBondContact O-N 3.36Å; L120-L122 PolarHBondContact O-N 3.35Å; L120-L124 HydrophobicContact CD2-CD2 3.43Å; L120-L124 VanDerWaalsContact CD2-CD2 3.43Å; L120-L124 HydrophobicContact CD2-CG 4.23Å; L120-V125 HydrophobicContact CB-CG2 3.81Å; L120-M289 HydrophobicContact CB-CE 4.12Å; L120-M289 HydrophobicContact CB-SD 3.6Å; L120-M289 HydrophobicContact CD1-CE 3.69Å; L120-M289 HydrophobicContact CD1-SD 3.27Å; L120-M289 WeakPolarHBondContact CD1-SD 3.48Å; L120-M289 HydrophobicContact CG-CE 4.29Å; L120-M289 HydrophobicContact CG-SD 3.98Å; L120-K292 HydrophobicContact CD1-CB 4.08Å; L120-K292 HydrophobicContact CD1-CG 3.77Å; L120-K292 HydrophobicContact CD2-CG 4.4Å
121	K	74.3	Confident	73.3	Confident	168 Å²	168	75 Å²	75	73%	0.73	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-55.1	134.5	177.4	-64.8	-176.9	-178.7	178.3	0	109.5	E119 N123 L124 V125	E119-K121 PolarHBondContact O-N 2.9Å; K121-N123 PolarHBondContact O-N 2.99Å; K121-L124 WeakPolarHBondContact O-CA 3.37Å; K121-L124 WeakPolarHBondContact O-CB 3.03Å; K121-L124 PolarHBondContact O-N 3.08Å; K121-V125 PolarHBondContact O-N 2.97Å; K121-V125 VanDerWaalsContact O-N 3.1Å
122	L	70.2	Confident	73.4	Confident	132 Å²	132	71.6 Å²	71.6	69%	0.691	35%	0.348	S	S	*	.	H	α-helix	trans	-50.6	-33.6	-179.5	-69.8	172.2	0	0	0	113.4	L120 V125 R126	L120-L122 PolarHBondContact O-N 3.35Å; L122-V125 PolarHBondContact O-N 2.79Å; L122-R126 WeakPolarHBondContact O-CB 3.44Å; L122-R126 PolarHBondContact O-N 3.32Å
123	N	61	Low	72.7	Confident	117 Å²	117	73.8 Å²	73.8	63%	0.626	36%	0.361	S	S	*	.	H	α-helix	trans	-67.8	-37.1	176.7	-66.7	-14.1	0	0	0	112.8	K121 N127	K121-N123 PolarHBondContact O-N 2.99Å; N123-N127 WeakPolarHBondContact O-CB 3.28Å; N123-N127 PolarHBondContact O-N 3.48Å; N123-N127 PolarHBondContact O-ND2 3.13Å; N123-N127 PolarHBondContact O-OD1 2.98Å
124	L	69.7	Low	71.7	Confident	58 Å²	58	70.4 Å²	70.4	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-71.1	-41.8	175.5	179.3	57.5	0	0	0	110.7	L120 K121 R126 N127 I128	L120-L124 HydrophobicContact CD2-CD2 3.43Å; L120-L124 VanDerWaalsContact CD2-CD2 3.43Å; L120-L124 HydrophobicContact CD2-CG 4.23Å; K121-L124 WeakPolarHBondContact O-CA 3.37Å; K121-L124 WeakPolarHBondContact O-CB 3.03Å; K121-L124 PolarHBondContact O-N 3.08Å; L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 PolarHBondContact O-N 3.49Å; L124-N127 PolarHBondContact O-N 3.47Å; L124-N127 VanDerWaalsContact O-N 3.12Å; L124-I128 HydrophobicContact CD1-CD1 4.44Å; L124-I128 HydrophobicContact CD1-CG1 4.48Å; L124-I128 HydrophobicContact CG-CD1 4.28Å; L124-I128 WeakPolarHBondContact O-CG1 3.35Å; L124-I128 PolarHBondContact O-N 2.7Å
125	V	75	Confident	69.9	Low	15 Å²	15	71.1 Å²	71.1	9%	0.091	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-47.8	172.6	179.4	0	0	0	0	110.3	L120 K121 L122 N127 I128 E129 A288 M289	L120-V125 HydrophobicContact CB-CG2 3.81Å; K121-V125 PolarHBondContact O-N 2.97Å; K121-V125 VanDerWaalsContact O-N 3.1Å; L122-V125 PolarHBondContact O-N 2.79Å; V125-N127 PolarHBondContact O-N 3.13Å; V125-I128 PolarHBondContact O-N 2.79Å; V125-E129 WeakPolarHBondContact O-CG 2.98Å; V125-E129 PolarHBondContact O-N 2.81Å; V125-A288 HydrophobicContact CG1-CB 4.35Å; V125-M289 HydrophobicContact CG2-CG 4.44Å; V125-M289 HydrophobicContact CG2-SD 3.68Å
126	R	68.3	Low	67.5	Low	165 Å²	165	73.5 Å²	73.5	62%	0.623	38%	0.376	S	S	*	.	H	α-helix	trans	-59.3	-43.8	172.7	-88.2	-153.6	174.1	113.4	-0.3	112.2	L122 L124 I128 E129 V130	L122-R126 WeakPolarHBondContact O-CB 3.44Å; L122-R126 PolarHBondContact O-N 3.32Å; L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 PolarHBondContact O-N 3.49Å; R126-I128 VanDerWaalsContact C-N 3.31Å; R126-I128 PolarHBondContact O-N 2.04Å; R126-E129 CarbonylContact O-C 3.43Å; R126-E129 PolarHBondContact O-N 2.05Å; R126-E129 VanDerWaalsContact O-N 3.13Å; R126-V130 WeakPolarHBondContact O-CA 3.5Å; R126-V130 WeakPolarHBondContact O-CB 3.03Å; R126-V130 WeakPolarHBondContact O-CG2 3.06Å; R126-V130 PolarHBondContact O-N 3.34Å
127	N	68.8	Low	64.8	Low	94 Å²	94	80.8 Å²	80.8	50%	0.503	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-37	179.3	-72.7	-13.9	0	0	0	112.2	N123 L124 V125 V130 S131	N123-N127 WeakPolarHBondContact O-CB 3.28Å; N123-N127 PolarHBondContact O-N 3.48Å; N123-N127 PolarHBondContact O-ND2 3.13Å; N123-N127 PolarHBondContact O-OD1 2.98Å; L124-N127 PolarHBondContact O-N 3.47Å; L124-N127 VanDerWaalsContact O-N 3.12Å; V125-N127 PolarHBondContact O-N 3.13Å; N127-V130 PolarHBondContact O-N 3.06Å; N127-S131 WeakPolarHBondContact O-CB 3.06Å; N127-S131 PolarHBondContact O-N 3Å; N127-S131 PolarHBondContact O-OG 2.69Å
128	I	69.2	Low	62.1	Low	13 Å²	13	83.3 Å²	83.3	7%	0.067	44%	0.435	C	S	.	.	H	α-helix	trans	-64.6	-44.5	172.9	-64.3	164.6	0	0	0	109.8	L124 V125 R126 V130 R132 E203 F207 A288	L124-I128 HydrophobicContact CD1-CD1 4.44Å; L124-I128 HydrophobicContact CD1-CG1 4.48Å; L124-I128 HydrophobicContact CG-CD1 4.28Å; L124-I128 WeakPolarHBondContact O-CG1 3.35Å; L124-I128 PolarHBondContact O-N 2.7Å; V125-I128 PolarHBondContact O-N 2.79Å; R126-I128 VanDerWaalsContact C-N 3.31Å; R126-I128 PolarHBondContact O-N 2.04Å; I128-V130 VanDerWaalsContact C-N 3.35Å; I128-V130 PolarHBondContact O-N 3.08Å; I128-R132 PolarHBondContact O-N 3.29Å; I128-E203 HydrophobicContact CD1-CB 4.39Å; I128-E203 HydrophobicContact CD1-CG 3.95Å; I128-E203 HydrophobicContact CG1-CB 3.91Å; I128-E203 HydrophobicContact CG1-CG 4.03Å; I128-F207 HydrophobicContact CG2-CD2 4.05Å; I128-F207 HydrophobicContact CG2-CE2 3.85Å; I128-A288 HydrophobicContact CB-CB 4.06Å; I128-A288 HydrophobicContact CG2-CB 3.6Å
129	E	69.9	Low	59.8	Low	78 Å²	78	82.3 Å²	82.3	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-72.4	-22.9	178.5	-69	176.3	171.7	0	0	114.2	V125 R126 R132 A288	V125-E129 WeakPolarHBondContact O-CG 2.98Å; V125-E129 PolarHBondContact O-N 2.81Å; R126-E129 CarbonylContact O-C 3.43Å; R126-E129 PolarHBondContact O-N 2.05Å; R126-E129 VanDerWaalsContact O-N 3.13Å; E129-R132 WeakPolarHBondContact O-CB 3.45Å; E129-A288 HydrophobicContact CG-CB 4.08Å
130	V	62.5	Low	57.7	Low	62 Å²	62	81.7 Å²	81.7	38%	0.376	45%	0.449	S	S	.	.	H	α-helix	trans	-94.7	-30.6	-179.7	170.3	0	0	0	0	111.1	R126 N127 I128 R132 M133 A134	R126-V130 WeakPolarHBondContact O-CA 3.5Å; R126-V130 WeakPolarHBondContact O-CB 3.03Å; R126-V130 WeakPolarHBondContact O-CG2 3.06Å; R126-V130 PolarHBondContact O-N 3.34Å; N127-V130 PolarHBondContact O-N 3.06Å; I128-V130 VanDerWaalsContact C-N 3.35Å; I128-V130 PolarHBondContact O-N 3.08Å; V130-R132 PolarHBondContact O-N 3.47Å; V130-M133 HydrophobicContact CB-CE 4.08Å; V130-M133 HydrophobicContact CG1-CE 4.1Å; V130-M133 HydrophobicContact CG2-CE 3.62Å; V130-M133 CarbonylContact O-C 3.45Å; V130-M133 VanDerWaalsContact O-CA 3.25Å; V130-M133 WeakPolarHBondContact O-CA 3.38Å; V130-M133 VanDerWaalsContact O-CB 3.22Å; V130-M133 WeakPolarHBondContact O-CB 3.32Å; V130-M133 PolarHBondContact O-N 3.32Å; V130-A134 PolarHBondContact O-N 3.24Å
131	S	57.9	Low	55.7	Low	36 Å²	36	83.7 Å²	83.7	25%	0.252	47%	0.466	S	S	.	.	H	α-helix	trans	-62.2	-28.1	168.6	-61.1	0	0	0	0	110.7	N127 M133 A134	N127-S131 WeakPolarHBondContact O-CB 3.06Å; N127-S131 PolarHBondContact O-N 3Å; N127-S131 PolarHBondContact O-OG 2.69Å; S131-M133 PolarHBondContact O-N 2.93Å; S131-A134 PolarHBondContact O-N 3.25Å
132	R	58	Low	54.2	Low	67 Å²	67	81.1 Å²	81.1	25%	0.253	46%	0.464	S	S	.	.	H	α-helix	trans	-52.2	-34	162.4	-161.6	-175.6	68.1	94.3	1.4	113.2	I128 E129 V130 I136 I352	I128-R132 PolarHBondContact O-N 3.29Å; E129-R132 WeakPolarHBondContact O-CB 3.45Å; V130-R132 PolarHBondContact O-N 3.47Å; R132-I136 WeakPolarHBondContact O-CG1 3.35Å; R132-I352 PolarHBondContact NH1-O 3.41Å
133	M	45.9	Very low	52.9	Low	77 Å²	77	79.9 Å²	79.9	38%	0.379	46%	0.462	S	S	.	.	H	α-helix	trans	-86.6	-21.7	179.3	-58.4	-165.2	-85.5	0	0	113.8	V130 S131 S135 I136 M137	V130-M133 HydrophobicContact CB-CE 4.08Å; V130-M133 HydrophobicContact CG1-CE 4.1Å; V130-M133 HydrophobicContact CG2-CE 3.62Å; V130-M133 CarbonylContact O-C 3.45Å; V130-M133 VanDerWaalsContact O-CA 3.25Å; V130-M133 WeakPolarHBondContact O-CA 3.38Å; V130-M133 VanDerWaalsContact O-CB 3.22Å; V130-M133 WeakPolarHBondContact O-CB 3.32Å; V130-M133 PolarHBondContact O-N 3.32Å; S131-M133 PolarHBondContact O-N 2.93Å; M133-S135 VanDerWaalsContact C-N 3.33Å; M133-I136 HydrophobicContact CB-CD1 4.32Å; M133-I136 HydrophobicContact CG-CD1 4.16Å; M133-I136 WeakPolarHBondContact O-CA 3.44Å; M133-I136 VanDerWaalsContact O-CB 3.24Å; M133-I136 WeakPolarHBondContact O-CB 3.46Å; M133-I136 PolarHBondContact O-N 2.98Å; M133-M137 PolarHBondContact O-N 2.03Å
134	A	44.6	Very low	52.1	Low	64 Å²	64	78.5 Å²	78.5	53%	0.529	46%	0.458	S	S	.	.	H	α-helix	trans	-67.4	-36.2	173.5	0	0	0	0	0	111.5	V130 S131 I136 M137 A138	V130-A134 PolarHBondContact O-N 3.24Å; S131-A134 PolarHBondContact O-N 3.25Å; A134-I136 PolarHBondContact O-N 3.32Å; A134-M137 PolarHBondContact O-N 3.08Å; A134-A138 PolarHBondContact O-N 2.93Å
135	S	44.2	Very low	51.1	Low	91 Å²	91	83.6 Å²	83.6	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-62.5	-20.6	167.5	-57.3	0	0	0	0	113.3	M133	M133-S135 VanDerWaalsContact C-N 3.33Å
136	I	40.9	Very low	50.2	Low	53 Å²	53	86.6 Å²	86.6	27%	0.272	52%	0.519	S	S	.	.	H	α-helix	trans	-82.4	-34.6	177.9	-58.3	174	0	0	0	111.2	R132 M133 A134 A139	R132-I136 WeakPolarHBondContact O-CG1 3.35Å; M133-I136 HydrophobicContact CB-CD1 4.32Å; M133-I136 HydrophobicContact CG-CD1 4.16Å; M133-I136 WeakPolarHBondContact O-CA 3.44Å; M133-I136 VanDerWaalsContact O-CB 3.24Å; M133-I136 WeakPolarHBondContact O-CB 3.46Å; M133-I136 PolarHBondContact O-N 2.98Å; A134-I136 PolarHBondContact O-N 3.32Å; I136-A139 PolarHBondContact O-N 2.84Å
137	M	37.4	Very low	50.3	Low	153 Å²	153	83.2 Å²	83.2	75%	0.754	51%	0.51	S	S	*	.	H	α-helix	trans	-81.7	-28.6	179.9	-66	-168.1	-150.3	0	0	113.5	M133 A134 A139 S140	M133-M137 PolarHBondContact O-N 2.03Å; A134-M137 PolarHBondContact O-N 3.08Å; M137-A139 VanDerWaalsContact C-N 3.26Å; M137-S140 PolarHBondContact O-N 3.37Å
138	A	38.9	Very low	51.1	Low	65 Å²	65	80 Å²	80	54%	0.537	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-72.5	-19.7	170.1	0	0	0	0	0	112.7	A134 S140 S141	A134-A138 PolarHBondContact O-N 2.93Å; A138-S140 VanDerWaalsContact C-N 3.3Å; A138-S140 PolarHBondContact O-N 3.29Å; A138-S141 PolarHBondContact O-N 3.48Å; A138-S141 PolarHBondContact O-OG 2.69Å
139	A	41.6	Very low	52	Low	47 Å²	47	84 Å²	84	39%	0.388	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-77.8	-10.8	175.9	0	0	0	0	0	113.9	I136 M137 S141 V143	I136-A139 PolarHBondContact O-N 2.84Å; M137-A139 VanDerWaalsContact C-N 3.26Å; A139-S141 PolarHBondContact O-N 3Å; A139-V143 HydrophobicContact CB-CG2 4.37Å
140	S	37	Very low	53.1	Low	115 Å²	115	80.3 Å²	80.3	80%	0.804	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-72.4	-10.9	168.8	-67.1	0	0	0	0	112.8	M137 A138	M137-S140 PolarHBondContact O-N 3.37Å; A138-S140 VanDerWaalsContact C-N 3.3Å; A138-S140 PolarHBondContact O-N 3.29Å
141	S	35.4	Very low	54.6	Low	87 Å²	87	80 Å²	80	61%	0.608	49%	0.491	S	S	*	.	S	Bend	trans	-102.7	92.1	158.9	56.5	0	0	0	0	108.6	A138 A139	A138-S141 PolarHBondContact O-N 3.48Å; A138-S141 PolarHBondContact O-OG 2.69Å; A139-S141 PolarHBondContact O-N 3Å
142	V	41.2	Very low	56.2	Low	115 Å²	115	82.1 Å²	82.1	70%	0.697	50%	0.495	S	S	*	.			trans	45.5	94.6	160.7	-169.2	0	0	0	0	113.2	V144	V142-V144 HydrophobicContact CG1-CG2 4.21Å; V142-V144 PolarHBondContact O-N 3.22Å
143	V	44.8	Very low	57.9	Low	105 Å²	105	79.4 Å²	79.4	64%	0.636	49%	0.487	S	S	*	.			trans	-53.7	102.7	152.4	-172.3	0	0	0	0	105.2	A139 D145	A139-V143 HydrophobicContact CB-CG2 4.37Å; V143-D145 PolarHBondContact O-N 2.9Å
144	V	43.9	Very low	60.2	Low	89 Å²	89	76.1 Å²	76.1	54%	0.539	47%	0.472	S	S	.	.			trans	-66.4	97.3	169.9	177.3	0	0	0	0	104.2	V142 G146 Q147	V142-V144 HydrophobicContact CG1-CG2 4.21Å; V142-V144 PolarHBondContact O-N 3.22Å; V144-G146 PolarHBondContact O-N 3.22Å; V144-Q147 PolarHBondContact O-N 3.05Å; V144-Q147 VanDerWaalsContact O-N 3.12Å
145	D	47.1	Very low	62.6	Low	164 Å²	164	77.3 Å²	77.3	88%	0.877	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	106.7	175.1	-165.2	18.4	0	0	0	107.7	V143	V143-D145 PolarHBondContact O-N 2.9Å
146	G	57.4	Low	64.9	Low	78 Å²	78	75.4 Å²	75.4	80%	0.804	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.6	-7.2	-179.6	0	0	0	0	0	117.8	V144 N148	V144-G146 PolarHBondContact O-N 3.22Å; G146-N148 PolarHBondContact O-N 3.48Å
147	Q	69.4	Low	67.5	Low	95 Å²	95	72.9 Å²	72.9	44%	0.444	44%	0.436	S	S	.	.			trans	-83.7	118.6	-179.9	-153.6	166.4	16.7	0	0	112.7	V144 Q149	V144-Q147 PolarHBondContact O-N 3.05Å; V144-Q147 VanDerWaalsContact O-N 3.12Å; Q147-Q149 PolarHBondContact O-N 2.57Å
148	N	85.2	Confident	70.3	Confident	26 Å²	26	67.8 Å²	67.8	14%	0.139	42%	0.423	C	S	.	.			trans	-56.4	114.9	177.8	179.2	-37.5	0	0	0	111.6	G146 C150 L151 K152 C219	G146-N148 PolarHBondContact O-N 3.48Å; N148-C150 VanDerWaalsContact C-N 3.29Å; N148-C150 PolarHBondContact O-N 2.82Å; N148-C150 WeakPolarHBondContact OD1-CB 3.22Å; N148-C150 PolarHBondContact OD1-N 2.01Å; N148-L151 HydrophobicContact CB-CB 3.89Å; N148-L151 WeakPolarHBondContact O-CA 3.5Å; N148-L151 VanDerWaalsContact O-CB 3.28Å; N148-L151 WeakPolarHBondContact O-CB 3.38Å; N148-L151 PolarHBondContact O-N 2.82Å; N148-L151 PolarHBondContact OD1-N 3.31Å; N148-K152 PolarHBondContact O-N 2.72Å; N148-C219 WeakPolarHBondContact ND2-CA 3.34Å; N148-C219 WeakPolarHBondContact ND2-CB 3.43Å; N148-C219 PolarHBondContact ND2-N 3.41Å; N148-C219 PolarHBondContact OD1-SG 2.79Å
149	Q	89.3	Confident	73	Confident	96 Å²	96	71.6 Å²	71.6	45%	0.449	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-32.4	-174.4	-64	-68.6	19.3	0	0	113.4	Q147 L151 K152 A153 C212 P213	Q147-Q149 PolarHBondContact O-N 2.57Å; Q149-L151 VanDerWaalsContact C-N 3.31Å; Q149-K152 PolarHBondContact O-N 2.84Å; Q149-A153 WeakPolarHBondContact O-CB 3.46Å; Q149-A153 PolarHBondContact O-N 2.71Å; Q149-C212 HydrophobicContact CB-CB 4.41Å; Q149-P213 HydrophobicContact CB-CG 4.34Å; Q149-P213 HydrophobicContact CG-CG 4.21Å
150	C	93.5	Very high	75.5	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.014	43%	0.43	C	S	.	.	H	α-helix	trans	-69.1	-31.4	173.3	-57.8	0	0	0	0	112.1	N148 A154 C212 C214 C219 R222	N148-C150 VanDerWaalsContact C-N 3.29Å; N148-C150 PolarHBondContact O-N 2.82Å; N148-C150 WeakPolarHBondContact OD1-CB 3.22Å; N148-C150 PolarHBondContact OD1-N 2.01Å; C150-A154 WeakPolarHBondContact O-CB 3.31Å; C150-A154 PolarHBondContact O-N 3.01Å; C150-A154 VanDerWaalsContact O-N 3.11Å; C150-C212 WeakPolarHBondContact CA-SG 3.32Å; C150-C212 HydrophobicContact CB-CB 3.89Å; C150-C212 WeakPolarHBondContact CB-SG 3.33Å; C150-C212 WeakPolarHBondContact SG-CB 3.42Å; C150-C212 CovalentContact SG-SG 2.01Å; C150-C212 PolarHBondContact SG-SG 2.89Å; C150-C214 PolarHBondContact SG-SG 2.91Å; C150-C219 PolarHBondContact SG-SG 2.63Å; C150-R222 VanDerWaalsContact C-CD 3.49Å; C150-R222 HydrophobicContact CB-CB 4.2Å; C150-R222 HydrophobicContact CB-CG 3.88Å
151	L	93.4	Very high	78.4	Confident	56 Å²	56	75.8 Å²	75.8	29%	0.293	43%	0.43	S	S	.	.	H	α-helix	trans	-68.1	-44.6	172.7	176.8	63	0	0	0	110.4	N148 Q149 A154 Q155	N148-L151 HydrophobicContact CB-CB 3.89Å; N148-L151 WeakPolarHBondContact O-CA 3.5Å; N148-L151 VanDerWaalsContact O-CB 3.28Å; N148-L151 WeakPolarHBondContact O-CB 3.38Å; N148-L151 PolarHBondContact O-N 2.82Å; N148-L151 PolarHBondContact OD1-N 3.31Å; Q149-L151 VanDerWaalsContact C-N 3.31Å; L151-A154 WeakPolarHBondContact O-CB 3.49Å; L151-A154 PolarHBondContact O-N 3.47Å; L151-A154 VanDerWaalsContact O-N 3.16Å; L151-Q155 WeakPolarHBondContact O-CG 2.94Å; L151-Q155 PolarHBondContact O-N 3.07Å
152	K	91.2	Very high	81.3	Confident	80 Å²	80	76.1 Å²	76.1	35%	0.348	42%	0.42	S	S	.	.	H	α-helix	trans	-58.5	-48.8	175.7	178.4	53.9	175.1	159.8	0	111.6	N148 Q149 A154 Q155 D156	N148-K152 PolarHBondContact O-N 2.72Å; Q149-K152 PolarHBondContact O-N 2.84Å; K152-A154 VanDerWaalsContact C-N 3.25Å; K152-A154 PolarHBondContact O-N 3.21Å; K152-Q155 WeakPolarHBondContact O-CB 2.99Å; K152-Q155 PolarHBondContact O-N 3.31Å; K152-D156 WeakPolarHBondContact CE-OD1 3.36Å; K152-D156 WeakPolarHBondContact CE-OD2 3.24Å; K152-D156 IonicContact NZ-OD1 2.69Å; K152-D156 PolarHBondContact NZ-OD1 3.42Å; K152-D156 IonicContact NZ-OD2 2.96Å; K152-D156 PolarHBondContact NZ-OD2 3.18Å; K152-D156 PolarHBondContact O-N 3.25Å
153	A	92.8	Very high	84	Confident	9 Å²	9	70.6 Å²	70.6	7%	0.074	39%	0.387	C	S	.	.	H	α-helix	trans	-57.3	-38.2	175.1	0	0	0	0	0	112.8	Q149 C157 A208 L209	Q149-A153 WeakPolarHBondContact O-CB 3.46Å; Q149-A153 PolarHBondContact O-N 2.71Å; A153-C157 WeakPolarHBondContact O-CB 3.44Å; A153-C157 PolarHBondContact O-N 2.87Å; A153-A208 HydrophobicContact CB-CB 3.79Å; A153-A208 WeakPolarHBondContact CB-O 3.31Å; A153-L209 HydrophobicContact CB-CD2 4.27Å; A153-L209 HydrophobicContact CB-CG 4.42Å
154	A	95.1	Very high	86.6	Confident	9 Å²	9	66.2 Å²	66.2	7%	0.074	36%	0.363	C	S	.	.	H	α-helix	trans	-68.3	-34.6	176.2	0	0	0	0	0	113.6	C150 L151 K152 G158 R167 L209	C150-A154 WeakPolarHBondContact O-CB 3.31Å; C150-A154 PolarHBondContact O-N 3.01Å; C150-A154 VanDerWaalsContact O-N 3.11Å; L151-A154 WeakPolarHBondContact O-CB 3.49Å; L151-A154 PolarHBondContact O-N 3.47Å; L151-A154 VanDerWaalsContact O-N 3.16Å; K152-A154 VanDerWaalsContact C-N 3.25Å; K152-A154 PolarHBondContact O-N 3.21Å; A154-G158 PolarHBondContact O-N 3.44Å; A154-R167 PolarHBondContact O-NH1 3.34Å; A154-L209 HydrophobicContact CB-CD2 3.96Å
155	Q	95.1	Very high	89.2	Confident	88 Å²	88	65.6 Å²	65.6	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-69.3	-47.7	173.8	-69.9	171	-24.9	0	0	110.9	L151 K152 C157 G158 L159	L151-Q155 WeakPolarHBondContact O-CG 2.94Å; L151-Q155 PolarHBondContact O-N 3.07Å; K152-Q155 WeakPolarHBondContact O-CB 2.99Å; K152-Q155 PolarHBondContact O-N 3.31Å; Q155-C157 VanDerWaalsContact C-N 3.34Å; Q155-C157 PolarHBondContact O-N 3.15Å; Q155-G158 WeakPolarHBondContact O-CA 3.18Å; Q155-G158 PolarHBondContact O-N 3.18Å; Q155-L159 WeakPolarHBondContact O-CG 3.07Å; Q155-L159 PolarHBondContact O-N 2.93Å
156	D	93.2	Very high	91.6	Very high	51 Å²	51	58.4 Å²	58.4	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-41	-179	-65.9	-20.8	0	0	0	111.7	K152 G158 L159 Y160 Y205	K152-D156 WeakPolarHBondContact CE-OD1 3.36Å; K152-D156 WeakPolarHBondContact CE-OD2 3.24Å; K152-D156 IonicContact NZ-OD1 2.69Å; K152-D156 PolarHBondContact NZ-OD1 3.42Å; K152-D156 IonicContact NZ-OD2 2.96Å; K152-D156 PolarHBondContact NZ-OD2 3.18Å; K152-D156 PolarHBondContact O-N 3.25Å; D156-G158 VanDerWaalsContact C-N 3.31Å; D156-G158 PolarHBondContact O-N 3.04Å; D156-L159 PolarHBondContact O-N 2.91Å; D156-Y160 PolarHBondContact O-N 3.2Å; D156-Y160 VanDerWaalsContact O-N 3.13Å; D156-Y205 HydrophobicContact CB-CE1 4.39Å
157	C	95.8	Very high	93.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-39.5	170.4	173.7	0	0	0	0	112.5	A153 Q155 L159 Y160 C163 G164 L209	A153-C157 WeakPolarHBondContact O-CB 3.44Å; A153-C157 PolarHBondContact O-N 2.87Å; Q155-C157 VanDerWaalsContact C-N 3.34Å; Q155-C157 PolarHBondContact O-N 3.15Å; C157-L159 VanDerWaalsContact C-N 3.31Å; C157-L159 PolarHBondContact O-N 3.44Å; C157-Y160 PolarHBondContact O-N 2.95Å; C157-C163 HydrophobicContact CB-CB 4.03Å; C157-C163 WeakPolarHBondContact CB-SG 3.47Å; C157-C163 WeakPolarHBondContact O-CB 3.43Å; C157-C163 WeakPolarHBondContact SG-CB 3.49Å; C157-C163 CovalentContact SG-SG 2.03Å; C157-C163 PolarHBondContact SG-SG 3.44Å; C157-G164 WeakPolarHBondContact O-CA 3.42Å; C157-G164 PolarHBondContact O-N 3.39Å; C157-L209 HydrophobicContact CB-CD1 3.89Å; C157-L209 HydrophobicContact CB-CG 4.47Å
158	G	95.9	Very high	95	Very high	46 Å²	46	57.2 Å²	57.2	47%	0.474	30%	0.302	S	S	.	.	H	α-helix	trans	-66.9	-31.4	178.5	0	0	0	0	0	113.4	A154 Q155 D156	A154-G158 PolarHBondContact O-N 3.44Å; Q155-G158 WeakPolarHBondContact O-CA 3.18Å; Q155-G158 PolarHBondContact O-N 3.18Å; D156-G158 VanDerWaalsContact C-N 3.31Å; D156-G158 PolarHBondContact O-N 3.04Å
159	L	95.2	Very high	95.6	Very high	146 Å²	146	59.7 Å²	59.7	76%	0.764	31%	0.313	S	S	*	.	H	α-helix	trans	-75.8	-29.1	175.7	-66.3	174.2	0	0	0	112.5	Q155 D156 C157 E161	Q155-L159 WeakPolarHBondContact O-CG 3.07Å; Q155-L159 PolarHBondContact O-N 2.93Å; D156-L159 PolarHBondContact O-N 2.91Å; C157-L159 VanDerWaalsContact C-N 3.31Å; C157-L159 PolarHBondContact O-N 3.44Å; L159-E161 PolarHBondContact O-N 2.76Å
160	Y	94.9	Very high	96	Very high	80 Å²	80	55.3 Å²	55.3	31%	0.314	29%	0.292	S	S	.	.	S	Bend	trans	-85.1	104.6	174.1	-179.5	-121	0	0	0	110.5	D156 C157 K162 C163 G164 P202 Y205	D156-Y160 PolarHBondContact O-N 3.2Å; D156-Y160 VanDerWaalsContact O-N 3.13Å; C157-Y160 PolarHBondContact O-N 2.95Å; Y160-K162 VanDerWaalsContact C-N 3.3Å; Y160-K162 HydrophobicContact CD1-CB 4.38Å; Y160-K162 HydrophobicContact CE1-CB 3.75Å; Y160-K162 PolarHBondContact O-N 3.43Å; Y160-K162 VanDerWaalsContact O-N 3.08Å; Y160-C163 HydrophobicContact CD1-CB 3.58Å; Y160-C163 HydrophobicContact CE1-CB 4.39Å; Y160-C163 HydrophobicContact CG-CB 4.44Å; Y160-C163 WeakPolarHBondContact O-CA 3.04Å; Y160-C163 PolarHBondContact O-N 3.4Å; Y160-G164 PolarHBondContact O-N 2.92Å; Y160-P202 HydrophobicContact CE1-CG 4.1Å; Y160-Y205 AromaticContact CD1-CD2 3.68Å; Y160-Y205 HydrophobicContact CD1-CD2 3.68Å; Y160-Y205 AromaticContact CD1-CE2 3.51Å; Y160-Y205 HydrophobicContact CD1-CE2 3.51Å; Y160-Y205 HydrophobicContact CD1-CG 4.29Å; Y160-Y205 AromaticContact CD1-CZ 3.99Å; Y160-Y205 HydrophobicContact CD2-CE2 4.31Å; Y160-Y205 HydrophobicContact CE1-CD2 4.1Å; Y160-Y205 AromaticContact CE1-CE2 3.96Å; Y160-Y205 HydrophobicContact CE1-CE2 3.96Å; Y160-Y205 HydrophobicContact CG-CD2 4.3Å; Y160-Y205 HydrophobicContact CG-CE1 4.34Å; Y160-Y205 AromaticContact CG-CE2 3.73Å; Y160-Y205 HydrophobicContact CG-CE2 3.73Å; Y160-Y205 AromaticContact CG-CZ 3.75Å
161	E	96.9	Very high	96.2	Very high	170 Å²	170	57.6 Å²	57.6	79%	0.794	31%	0.306	S	S	*	.	H	α-helix	trans	-42.2	-51.1	-171.5	-174.7	-177.3	177.2	0	0	114	L159 C163 G164 S165	L159-E161 PolarHBondContact O-N 2.76Å; E161-C163 PolarHBondContact O-N 2.9Å; E161-G164 PolarHBondContact O-N 2.96Å; E161-S165 VanDerWaalsContact O-CB 3.27Å; E161-S165 WeakPolarHBondContact O-CB 3.33Å; E161-S165 PolarHBondContact O-N 3.43Å
162	K	97.1	Very high	96.3	Very high	93 Å²	93	59 Å²	59	40%	0.404	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-39.5	-179.5	-168.9	-176.5	-171.3	-170	0	112.8	Y160 L166 R200	Y160-K162 VanDerWaalsContact C-N 3.3Å; Y160-K162 HydrophobicContact CD1-CB 4.38Å; Y160-K162 HydrophobicContact CE1-CB 3.75Å; Y160-K162 PolarHBondContact O-N 3.43Å; Y160-K162 VanDerWaalsContact O-N 3.08Å; K162-L166 HydrophobicContact CG-CD1 4.12Å; K162-L166 WeakPolarHBondContact O-CB 3.28Å; K162-L166 WeakPolarHBondContact O-CG 3.46Å; K162-L166 PolarHBondContact O-N 2.73Å; K162-L166 VanDerWaalsContact O-N 3.17Å; K162-R200 WeakPolarHBondContact CE-O 3.49Å; K162-R200 PolarHBondContact NZ-O 3.43Å
163	C	98.1	Very high	96.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-71.5	-45.4	177	-171.6	0	0	0	0	111.1	C157 Y160 E161 S165 R167 V201	C157-C163 HydrophobicContact CB-CB 4.03Å; C157-C163 WeakPolarHBondContact CB-SG 3.47Å; C157-C163 WeakPolarHBondContact O-CB 3.43Å; C157-C163 WeakPolarHBondContact SG-CB 3.49Å; C157-C163 CovalentContact SG-SG 2.03Å; C157-C163 PolarHBondContact SG-SG 3.44Å; Y160-C163 HydrophobicContact CD1-CB 3.58Å; Y160-C163 HydrophobicContact CE1-CB 4.39Å; Y160-C163 HydrophobicContact CG-CB 4.44Å; Y160-C163 WeakPolarHBondContact O-CA 3.04Å; Y160-C163 PolarHBondContact O-N 3.4Å; E161-C163 PolarHBondContact O-N 2.9Å; C163-S165 PolarHBondContact O-N 2.86Å; C163-R167 WeakPolarHBondContact O-CB 3.04Å; C163-R167 PolarHBondContact O-N 2.91Å; C163-V201 HydrophobicContact CB-CG1 3.84Å; C163-V201 HydrophobicContact CB-CG2 4.29Å; C163-V201 VanDerWaalsContact SG-CG1 3.56Å
164	G	98.1	Very high	96.7	Very high	13 Å²	13	56 Å²	56	13%	0.134	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-44.6	177.9	0	0	0	0	0	112.7	C157 Y160 E161 S168	C157-G164 WeakPolarHBondContact O-CA 3.42Å; C157-G164 PolarHBondContact O-N 3.39Å; Y160-G164 PolarHBondContact O-N 2.92Å; E161-G164 PolarHBondContact O-N 2.96Å; G164-S168 WeakPolarHBondContact O-CB 3.32Å; G164-S168 PolarHBondContact O-N 2.7Å; G164-S168 PolarHBondContact O-OG 2.83Å
165	S	98.6	Very high	96.5	Very high	75 Å²	75	59.7 Å²	59.7	52%	0.524	33%	0.328	S	S	.	.	H	α-helix	trans	-63.9	-56.1	177.7	176.6	0	0	0	0	112	E161 C163 R167 S168 E169	E161-S165 VanDerWaalsContact O-CB 3.27Å; E161-S165 WeakPolarHBondContact O-CB 3.33Å; E161-S165 PolarHBondContact O-N 3.43Å; C163-S165 PolarHBondContact O-N 2.86Å; S165-R167 VanDerWaalsContact C-N 3.25Å; S165-R167 PolarHBondContact O-N 3.17Å; S165-S168 WeakPolarHBondContact O-CB 3.34Å; S165-S168 PolarHBondContact O-N 3.08Å; S165-S168 VanDerWaalsContact O-N 3.12Å; S165-E169 PolarHBondContact O-N 3.14Å
166	L	98.6	Very high	96.2	Very high	14 Å²	14	62.9 Å²	62.9	7%	0.073	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-29.6	-179.9	-67.2	176.6	0	0	0	112.6	K162 E169 Y170 R196 F197 R200 V201	K162-L166 HydrophobicContact CG-CD1 4.12Å; K162-L166 WeakPolarHBondContact O-CB 3.28Å; K162-L166 WeakPolarHBondContact O-CG 3.46Å; K162-L166 PolarHBondContact O-N 2.73Å; K162-L166 VanDerWaalsContact O-N 3.17Å; L166-E169 WeakPolarHBondContact CD2-OE2 3.41Å; L166-E169 PolarHBondContact O-N 2.91Å; L166-Y170 WeakPolarHBondContact O-CD1 3.18Å; L166-Y170 PolarHBondContact O-N 2.81Å; L166-Y170 VanDerWaalsContact O-N 3.14Å; L166-R196 HydrophobicContact CD2-CG 4.25Å; L166-F197 HydrophobicContact CB-CD2 3.85Å; L166-R200 HydrophobicContact CD1-CB 3.63Å; L166-V201 HydrophobicContact CB-CG2 4.13Å; L166-V201 HydrophobicContact CD1-CG2 3.71Å
167	R	98.4	Very high	95.6	Very high	77 Å²	77	68.5 Å²	68.5	29%	0.291	36%	0.358	S	S	.	.	H	α-helix	trans	-65.1	-46.3	173.1	-179.4	175.3	177.9	-132	-4.7	111.4	A154 C163 S165 E169 Y170 V171 F197	A154-R167 PolarHBondContact O-NH1 3.34Å; C163-R167 WeakPolarHBondContact O-CB 3.04Å; C163-R167 PolarHBondContact O-N 2.91Å; S165-R167 VanDerWaalsContact C-N 3.25Å; S165-R167 PolarHBondContact O-N 3.17Å; R167-E169 VanDerWaalsContact C-N 3.32Å; R167-Y170 VanDerWaalsContact CA-CE1 3.43Å; R167-Y170 HydrophobicContact CB-CE1 3.94Å; R167-Y170 HydrophobicContact CG-CE1 3.74Å; R167-Y170 WeakPolarHBondContact O-CD1 3.24Å; R167-V171 HydrophobicContact CG-CG2 4.5Å; R167-V171 WeakPolarHBondContact O-CB 3.44Å; R167-V171 WeakPolarHBondContact O-CG2 3.37Å; R167-V171 PolarHBondContact O-N 2.94Å; R167-F197 HydrophobicContact CB-CD2 4.39Å; R167-F197 HydrophobicContact CB-CE2 3.92Å
168	S	98.1	Very high	94.5	Very high	71 Å²	71	70.7 Å²	70.7	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-42	176.5	-56.8	0	0	0	0	111	G164 S165 Y170 V171 V172	G164-S168 WeakPolarHBondContact O-CB 3.32Å; G164-S168 PolarHBondContact O-N 2.7Å; G164-S168 PolarHBondContact O-OG 2.83Å; S165-S168 WeakPolarHBondContact O-CB 3.34Å; S165-S168 PolarHBondContact O-N 3.08Å; S165-S168 VanDerWaalsContact O-N 3.12Å; S168-Y170 PolarHBondContact O-N 2.82Å; S168-V171 PolarHBondContact O-N 3.03Å; S168-V172 WeakPolarHBondContact O-CB 3.22Å; S168-V172 WeakPolarHBondContact O-CG2 3.44Å; S168-V172 PolarHBondContact O-N 3.06Å
169	E	98.2	Very high	93.4	Very high	77 Å²	77	71.7 Å²	71.7	36%	0.36	37%	0.374	S	S	.	.	H	α-helix	trans	-54.3	-54.6	176.1	-171.8	-168	150.2	0	0	111.8	S165 L166 R167 V171 V172 A173 R196	S165-E169 PolarHBondContact O-N 3.14Å; L166-E169 WeakPolarHBondContact CD2-OE2 3.41Å; L166-E169 PolarHBondContact O-N 2.91Å; R167-E169 VanDerWaalsContact C-N 3.32Å; E169-V171 PolarHBondContact O-N 3.37Å; E169-V172 PolarHBondContact O-N 3.38Å; E169-A173 WeakPolarHBondContact O-CB 3.21Å; E169-A173 PolarHBondContact O-N 3.34Å; E169-R196 WeakPolarHBondContact OE1-CD 3.34Å; E169-R196 IonicContact OE1-NE 4Å; E169-R196 IonicContact OE2-NE 3.74Å; E169-R196 PolarHBondContact OE2-NE 2.92Å
170	Y	98.4	Very high	91.9	Very high	4 Å²	4	69.6 Å²	69.6	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-69.7	-35.8	-178.3	83.9	-109.9	0	0	0	112.3	L166 R167 S168 V172 A173 C174 L194 F197 T226 V228	L166-Y170 WeakPolarHBondContact O-CD1 3.18Å; L166-Y170 PolarHBondContact O-N 2.81Å; L166-Y170 VanDerWaalsContact O-N 3.14Å; R167-Y170 VanDerWaalsContact CA-CE1 3.43Å; R167-Y170 HydrophobicContact CB-CE1 3.94Å; R167-Y170 HydrophobicContact CG-CE1 3.74Å; R167-Y170 WeakPolarHBondContact O-CD1 3.24Å; S168-Y170 PolarHBondContact O-N 2.82Å; Y170-V172 VanDerWaalsContact C-N 3.34Å; Y170-V172 PolarHBondContact O-N 3.27Å; Y170-A173 PolarHBondContact O-N 3.03Å; Y170-C174 WeakPolarHBondContact O-CB 3.43Å; Y170-C174 PolarHBondContact O-N 3.43Å; Y170-C174 PolarHBondContact O-SG 3.37Å; Y170-L194 HydrophobicContact CD1-CD2 4.39Å; Y170-L194 HydrophobicContact CD2-CD2 3.52Å; Y170-L194 HydrophobicContact CD2-CG 4.2Å; Y170-L194 HydrophobicContact CE2-CD2 3.87Å; Y170-L194 HydrophobicContact CG-CD2 3.85Å; Y170-L194 HydrophobicContact CG-CG 4.4Å; Y170-F197 HydrophobicContact CD1-CB 3.76Å; Y170-F197 HydrophobicContact CD1-CD1 4.09Å; Y170-F197 AromaticContact CD1-CD2 3.8Å; Y170-F197 HydrophobicContact CD1-CD2 3.8Å; Y170-F197 HydrophobicContact CD1-CE2 4.44Å; Y170-F197 AromaticContact CD1-CG 3.61Å; Y170-F197 HydrophobicContact CD1-CG 3.61Å; Y170-F197 HydrophobicContact CE1-CB 4.35Å; Y170-F197 AromaticContact CE1-CD1 3.82Å; Y170-F197 HydrophobicContact CE1-CD1 3.82Å; Y170-F197 AromaticContact CE1-CD2 3.74Å; Y170-F197 HydrophobicContact CE1-CD2 3.74Å; Y170-F197 HydrophobicContact CE1-CE1 4.03Å; Y170-F197 AromaticContact CE1-CE2 3.94Å; Y170-F197 HydrophobicContact CE1-CE2 3.94Å; Y170-F197 AromaticContact CE1-CG 3.69Å; Y170-F197 HydrophobicContact CE1-CG 3.69Å; Y170-F197 HydrophobicContact CE1-CZ 4.1Å; Y170-T226 WeakPolarHBondContact CE2-O 3.24Å; Y170-T226 PolarHBondContact OH-O 2.93Å; Y170-V228 HydrophobicContact CE2-CG2 4.38Å
171	V	97.3	Very high	90.3	Very high	50 Å²	50	72.2 Å²	72.2	30%	0.303	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-45.1	177.4	169.2	0	0	0	0	110.3	R167 S168 E169 C174 T175	R167-V171 HydrophobicContact CG-CG2 4.5Å; R167-V171 WeakPolarHBondContact O-CB 3.44Å; R167-V171 WeakPolarHBondContact O-CG2 3.37Å; R167-V171 PolarHBondContact O-N 2.94Å; S168-V171 PolarHBondContact O-N 3.03Å; E169-V171 PolarHBondContact O-N 3.37Å; V171-C174 PolarHBondContact O-N 2.79Å; V171-T175 HydrophobicContact CG1-CG2 4.36Å; V171-T175 WeakPolarHBondContact O-CB 3.42Å; V171-T175 VanDerWaalsContact O-CG2 3.32Å; V171-T175 WeakPolarHBondContact O-CG2 3.41Å; V171-T175 PolarHBondContact O-N 2.7Å; V171-T175 PolarHBondContact O-OG1 2.57Å
172	V	96.2	Very high	88.7	Confident	86 Å²	86	64.8 Å²	64.8	52%	0.521	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-45.9	175.6	170.9	0	0	0	0	110.6	S168 E169 Y170 C174 T175 K176	S168-V172 WeakPolarHBondContact O-CB 3.22Å; S168-V172 WeakPolarHBondContact O-CG2 3.44Å; S168-V172 PolarHBondContact O-N 3.06Å; E169-V172 PolarHBondContact O-N 3.38Å; Y170-V172 VanDerWaalsContact C-N 3.34Å; Y170-V172 PolarHBondContact O-N 3.27Å; V172-C174 PolarHBondContact O-N 3.22Å; V172-T175 PolarHBondContact O-N 2.76Å; V172-K176 VanDerWaalsContact O-CB 3.23Å; V172-K176 WeakPolarHBondContact O-CB 3.28Å; V172-K176 PolarHBondContact O-N 2.91Å
173	A	96.1	Very high	87.2	Confident	23 Å²	23	67.3 Å²	67.3	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-59.7	-33.3	178.5	0	0	0	0	0	113.2	E169 Y170 A193	E169-A173 WeakPolarHBondContact O-CB 3.21Å; E169-A173 PolarHBondContact O-N 3.34Å; Y170-A173 PolarHBondContact O-N 3.03Å; A173-A193 HydrophobicContact CB-CB 3.83Å
174	C	95.1	Very high	86.2	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.02	40%	0.399	C	S	.	.	H	α-helix	trans	-89	-18.8	-178.9	-60.7	0	0	0	0	114.5	Y170 V171 V172 C185 C190 V228 C231	Y170-C174 WeakPolarHBondContact O-CB 3.43Å; Y170-C174 PolarHBondContact O-N 3.43Å; Y170-C174 PolarHBondContact O-SG 3.37Å; V171-C174 PolarHBondContact O-N 2.79Å; V172-C174 PolarHBondContact O-N 3.22Å; C174-C185 WeakPolarHBondContact O-CB 3.43Å; C174-C190 HydrophobicContact CB-CB 3.84Å; C174-C190 WeakPolarHBondContact CB-SG 3.38Å; C174-C190 VanDerWaalsContact SG-CA 3.5Å; C174-C190 WeakPolarHBondContact SG-CB 3.44Å; C174-C190 CovalentContact SG-SG 2.03Å; C174-C190 PolarHBondContact SG-SG 2.04Å; C174-V228 HydrophobicContact CB-CB 3.8Å; C174-V228 HydrophobicContact CB-CG1 3.86Å; C174-V228 HydrophobicContact CB-CG2 3.98Å; C174-C231 HydrophobicContact CB-CB 4.25Å; C174-C231 VanDerWaalsContact O-CB 3.31Å; C174-C231 WeakPolarHBondContact O-CB 3.5Å; C174-C231 PolarHBondContact O-SG 3.24Å; C174-C231 VanDerWaalsContact O-SG 3.41Å
175	T	92.4	Very high	85.8	Confident	87 Å²	87	70 Å²	70	53%	0.534	40%	0.402	S	S	.	.	H	α-helix	trans	-106.7	-19.7	-177.6	56.2	0	0	0	0	113.5	V171 V172 R177 V228	V171-T175 HydrophobicContact CG1-CG2 4.36Å; V171-T175 WeakPolarHBondContact O-CB 3.42Å; V171-T175 VanDerWaalsContact O-CG2 3.32Å; V171-T175 WeakPolarHBondContact O-CG2 3.41Å; V171-T175 PolarHBondContact O-N 2.7Å; V171-T175 PolarHBondContact O-OG1 2.57Å; V172-T175 PolarHBondContact O-N 2.76Å; T175-R177 PolarHBondContact O-N 3.35Å; T175-V228 HydrophobicContact CG2-CG1 4.17Å
176	K	87.4	Confident	85.5	Confident	155 Å²	155	69 Å²	69	67%	0.674	39%	0.391	S	S	*	.	S	Bend	trans	-64.4	125.3	174.3	-171.6	171.3	-176.7	172.3	0	110.1	V172	V172-K176 VanDerWaalsContact O-CB 3.23Å; V172-K176 WeakPolarHBondContact O-CB 3.28Å; V172-K176 PolarHBondContact O-N 2.91Å
177	R	80.6	Confident	85.2	Confident	168 Å²	168	71.1 Å²	71.1	63%	0.634	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	139.4	176.1	-63.8	-176.1	-174.1	170.3	1.9	110.3	T175	T175-R177 PolarHBondContact O-N 3.35Å
178	A	73.6	Confident	84.9	Confident	47 Å²	47	75.3 Å²	75.3	39%	0.388	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-38.3	-179.3	0	0	0	0	0	112.1	S184	A178-S184 WeakPolarHBondContact CB-O 3.45Å; A178-S184 PolarHBondContact N-O 3.3Å
179	T	72	Confident	84.8	Confident	67 Å²	67	78.6 Å²	78.6	41%	0.411	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	160.4	171.8	66.6	0	0	0	0	109.9	T181 D182	T179-T181 PolarHBondContact O-N 3.5Å; T179-T181 VanDerWaalsContact O-N 3.14Å; T179-T181 PolarHBondContact OG1-OG1 3.34Å; T179-D182 PolarHBondContact O-N 3.13Å; T179-D182 WeakPolarHBondContact OG1-CB 3.29Å; T179-D182 PolarHBondContact OG1-N 3.01Å
180	A	63.3	Low	84.8	Confident	101 Å²	101	74.9 Å²	74.9	84%	0.835	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.3	-180	0	0	0	0	0	113.4
181	T	62	Low	84.8	Confident	136 Å²	136	75.5 Å²	75.5	83%	0.834	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-9	-177	50.6	0	0	0	0	114	T179	T179-T181 PolarHBondContact O-N 3.5Å; T179-T181 VanDerWaalsContact O-N 3.14Å; T179-T181 PolarHBondContact OG1-OG1 3.34Å
182	D	63.1	Low	84.7	Confident	13 Å²	13	80.1 Å²	80.1	7%	0.07	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.8	-174.8	-167.2	0.7	0	0	0	110.2	T179 S184 R238	T179-D182 PolarHBondContact O-N 3.13Å; T179-D182 WeakPolarHBondContact OG1-CB 3.29Å; T179-D182 PolarHBondContact OG1-N 3.01Å; D182-S184 PolarHBondContact O-N 3.14Å; D182-S184 WeakPolarHBondContact OD1-CB 3.17Å; D182-S184 PolarHBondContact OD1-N 3.05Å; D182-S184 VanDerWaalsContact OD1-N 3.09Å; D182-S184 PolarHBondContact OD1-OG 3.08Å; D182-S184 PolarHBondContact OD2-OG 3.04Å; D182-R238 IonicContact OD1-CZ 3.99Å; D182-R238 IonicContact OD1-NE 2.79Å; D182-R238 IonicContact OD2-CZ 3.38Å; D182-R238 IonicContact OD2-NE 3.9Å; D182-R238 IonicContact OD2-NH1 2.75Å; D182-R238 PolarHBondContact OD2-NH1 3.06Å; D182-R238 IonicContact OD2-NH2 3.94Å; D182-R238 PolarHBondContact OD2-NH2 3.05Å
183	N	65.9	Low	84.8	Confident	146 Å²	146	76.4 Å²	76.4	78%	0.781	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	0.7	175.2	-73.4	-25.6	0	0	0	112.4
184	S	77.9	Confident	85	Confident	41 Å²	41	75.4 Å²	75.4	29%	0.287	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	146.9	175.9	83.2	0	0	0	0	112.8	A178 D182	A178-S184 WeakPolarHBondContact CB-O 3.45Å; A178-S184 PolarHBondContact N-O 3.3Å; D182-S184 PolarHBondContact O-N 3.14Å; D182-S184 WeakPolarHBondContact OD1-CB 3.17Å; D182-S184 PolarHBondContact OD1-N 3.05Å; D182-S184 VanDerWaalsContact OD1-N 3.09Å; D182-S184 PolarHBondContact OD1-OG 3.08Å; D182-S184 PolarHBondContact OD2-OG 3.04Å
185	C	88.9	Confident	85.1	Confident	30 Å²	30	77.9 Å²	77.9	20%	0.203	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	162.2	172.1	71	0	0	0	0	111	C174 R187 C231	C174-C185 WeakPolarHBondContact O-CB 3.43Å; C185-R187 PolarHBondContact O-N 2.69Å; C185-C231 HydrophobicContact CB-CB 3.77Å; C185-C231 WeakPolarHBondContact CB-SG 3.25Å; C185-C231 WeakPolarHBondContact SG-CA 3.19Å; C185-C231 WeakPolarHBondContact SG-CB 3.04Å; C185-C231 CovalentContact SG-SG 2.01Å; C185-C231 PolarHBondContact SG-SG 2.03Å
186	N	91.2	Very high	85.3	Confident	54 Å²	54	79.2 Å²	79.2	29%	0.289	40%	0.401	S	S	.	.			trans	-79.3	88.3	167.2	-170.7	-40.2	0	0	0	110.4	Q188 K189 C190	N186-Q188 VanDerWaalsContact C-N 3.29Å; N186-Q188 PolarHBondContact O-N 3.17Å; N186-Q188 PolarHBondContact OD1-N 3.34Å; N186-K189 HydrophobicContact CB-CB 4.19Å; N186-K189 HydrophobicContact CB-CD 4.35Å; N186-K189 HydrophobicContact CB-CG 4.39Å; N186-K189 PolarHBondContact O-N 3.39Å; N186-K189 PolarHBondContact OD1-N 3.29Å; N186-C190 PolarHBondContact O-N 2.77Å
187	R	92.2	Very high	85.8	Confident	58 Å²	58	72 Å²	72	22%	0.219	37%	0.37	C	S	.	.	H	α-helix	trans	-58	-37.2	-176.9	-172.3	172.5	-178.6	116.3	-15.4	113.2	C185 C190 H191 C231 S232 F233 E234	C185-R187 PolarHBondContact O-N 2.69Å; R187-C190 WeakPolarHBondContact O-CB 3.43Å; R187-C190 PolarHBondContact O-N 3.23Å; R187-H191 PolarHBondContact NE-CE1 3.48Å; R187-H191 WeakPolarHBondContact O-CB 3.4Å; R187-H191 PolarHBondContact O-N 2.82Å; R187-C231 WeakPolarHBondContact CG-O 3.43Å; R187-C231 PolarHBondContact NH1-O 2.84Å; R187-S232 PolarHBondContact NH2-O 2.69Å; R187-F233 PolarHBondContact NH1-O 2.83Å; R187-F233 PolarHBondContact NH2-O 2.94Å; R187-E234 PolarHBondContact NH1-O 3.33Å
188	Q	93.9	Very high	86.6	Confident	165 Å²	165	64.2 Å²	64.2	77%	0.771	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-46.1	178.3	-69.4	179.9	-18.7	0	0	112	N186 H191 K192	N186-Q188 VanDerWaalsContact C-N 3.29Å; N186-Q188 PolarHBondContact O-N 3.17Å; N186-Q188 PolarHBondContact OD1-N 3.34Å; Q188-H191 PolarHBondContact O-N 3.46Å; Q188-K192 WeakPolarHBondContact O-CB 3.44Å; Q188-K192 PolarHBondContact O-N 3.28Å
189	K	95.8	Very high	87.5	Confident	139 Å²	139	64.5 Å²	64.5	60%	0.604	33%	0.334	S	S	*	.	H	α-helix	trans	-63.5	-43.6	175.1	-72.7	-174.7	-179.1	-173.9	0	111.4	N186 K192 A193	N186-K189 HydrophobicContact CB-CB 4.19Å; N186-K189 HydrophobicContact CB-CD 4.35Å; N186-K189 HydrophobicContact CB-CG 4.39Å; N186-K189 PolarHBondContact O-N 3.39Å; N186-K189 PolarHBondContact OD1-N 3.29Å; K189-K192 PolarHBondContact O-N 3.04Å; K189-A193 WeakPolarHBondContact O-CB 3.45Å; K189-A193 PolarHBondContact O-N 2.93Å
190	C	97.4	Very high	88.6	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.6	-51	175	173.9	0	0	0	0	112.1	C174 N186 R187 K192 A193 L194 C231	C174-C190 HydrophobicContact CB-CB 3.84Å; C174-C190 WeakPolarHBondContact CB-SG 3.38Å; C174-C190 VanDerWaalsContact SG-CA 3.5Å; C174-C190 WeakPolarHBondContact SG-CB 3.44Å; C174-C190 CovalentContact SG-SG 2.03Å; C174-C190 PolarHBondContact SG-SG 2.04Å; N186-C190 PolarHBondContact O-N 2.77Å; R187-C190 WeakPolarHBondContact O-CB 3.43Å; R187-C190 PolarHBondContact O-N 3.23Å; C190-K192 PolarHBondContact O-N 3.41Å; C190-A193 PolarHBondContact O-N 3.03Å; C190-L194 WeakPolarHBondContact O-CB 3.46Å; C190-L194 WeakPolarHBondContact O-CG 3.04Å; C190-L194 PolarHBondContact O-N 3.29Å; C190-C231 VanDerWaalsContact SG-SG 3.6Å
191	H	97.6	Very high	90.1	Very high	16 Å²	16	60.8 Å²	60.8	7%	0.074	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-43.6	178.1	-80.2	-164.5	0	0	0	112.2	R187 Q188 A193 L194 R195 S232 G299 T300	R187-H191 PolarHBondContact NE-CE1 3.48Å; R187-H191 WeakPolarHBondContact O-CB 3.4Å; R187-H191 PolarHBondContact O-N 2.82Å; Q188-H191 PolarHBondContact O-N 3.46Å; H191-A193 PolarHBondContact O-N 2.96Å; H191-L194 PolarHBondContact O-N 3.4Å; H191-R195 WeakPolarHBondContact O-CG 3.43Å; H191-R195 PolarHBondContact O-N 2.94Å; H191-S232 PolarHBondContact NE2-O 3.41Å; H191-G299 WeakPolarHBondContact CB-O 3.33Å; H191-T300 PolarHBondContact CE1-O 3.24Å; H191-T300 VanDerWaalsContact CE1-O 3.31Å
192	K	97.1	Very high	91.5	Very high	148 Å²	148	55.6 Å²	55.6	64%	0.643	26%	0.26	S	S	*	.	H	α-helix	trans	-60.6	-44.8	176.5	-173.5	176.1	-179.4	177.1	0	111.9	Q188 K189 C190 R195 R196	Q188-K192 WeakPolarHBondContact O-CB 3.44Å; Q188-K192 PolarHBondContact O-N 3.28Å; K189-K192 PolarHBondContact O-N 3.04Å; C190-K192 PolarHBondContact O-N 3.41Å; K192-R195 PolarHBondContact O-N 3.34Å; K192-R196 PolarHBondContact O-N 3.41Å; K192-R196 VanDerWaalsContact O-N 3.08Å
193	A	98.2	Very high	92.7	Very high	7 Å²	7	56.3 Å²	56.3	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-38.9	178.3	0	0	0	0	0	112.3	A173 K189 C190 H191 R196 F197	A173-A193 HydrophobicContact CB-CB 3.83Å; K189-A193 WeakPolarHBondContact O-CB 3.45Å; K189-A193 PolarHBondContact O-N 2.93Å; C190-A193 PolarHBondContact O-N 3.03Å; H191-A193 PolarHBondContact O-N 2.96Å; A193-R196 PolarHBondContact O-N 2.79Å; A193-F197 PolarHBondContact O-N 2.98Å
194	L	98.5	Very high	93.7	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-45.2	173.7	-80.9	168.7	0	0	0	112.2	Y170 C190 H191 R196 F197 L198 I227 I298	Y170-L194 HydrophobicContact CD1-CD2 4.39Å; Y170-L194 HydrophobicContact CD2-CD2 3.52Å; Y170-L194 HydrophobicContact CD2-CG 4.2Å; Y170-L194 HydrophobicContact CE2-CD2 3.87Å; Y170-L194 HydrophobicContact CG-CD2 3.85Å; Y170-L194 HydrophobicContact CG-CG 4.4Å; C190-L194 WeakPolarHBondContact O-CB 3.46Å; C190-L194 WeakPolarHBondContact O-CG 3.04Å; C190-L194 PolarHBondContact O-N 3.29Å; H191-L194 PolarHBondContact O-N 3.4Å; L194-R196 PolarHBondContact O-N 3.04Å; L194-F197 WeakPolarHBondContact O-CB 3.46Å; L194-F197 PolarHBondContact O-N 2.85Å; L194-L198 WeakPolarHBondContact O-CG 3.4Å; L194-L198 PolarHBondContact O-N 2.68Å; L194-I227 HydrophobicContact CD2-CB 4.29Å; L194-I227 HydrophobicContact CD2-CG2 4.34Å; L194-I298 HydrophobicContact CD1-CG2 4.5Å
195	R	97.6	Very high	94.3	Very high	56 Å²	56	54.8 Å²	54.8	21%	0.211	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-47.3	175.5	-69.1	-168.6	-54.6	-96.9	9.8	111	H191 K192 F197 L198 E199 G299	H191-R195 WeakPolarHBondContact O-CG 3.43Å; H191-R195 PolarHBondContact O-N 2.94Å; K192-R195 PolarHBondContact O-N 3.34Å; R195-F197 VanDerWaalsContact C-N 3.33Å; R195-F197 PolarHBondContact O-N 3.34Å; R195-L198 PolarHBondContact O-N 2.99Å; R195-E199 WeakPolarHBondContact O-CB 3.33Å; R195-E199 VanDerWaalsContact O-CG 3.28Å; R195-E199 WeakPolarHBondContact O-CG 3.4Å; R195-E199 PolarHBondContact O-N 3.48Å; R195-G299 PolarHBondContact NH1-O 3.44Å
196	R	96.8	Very high	94.6	Very high	115 Å²	115	53.4 Å²	53.4	43%	0.434	24%	0.235	S	C	.	.	H	α-helix	trans	-56.8	-45	175.9	-177.4	-177.2	173.6	102.8	-2.6	111.8	L166 E169 K192 A193 L194 E199 R200	L166-R196 HydrophobicContact CD2-CG 4.25Å; E169-R196 WeakPolarHBondContact OE1-CD 3.34Å; E169-R196 IonicContact OE1-NE 4Å; E169-R196 IonicContact OE2-NE 3.74Å; E169-R196 PolarHBondContact OE2-NE 2.92Å; K192-R196 PolarHBondContact O-N 3.41Å; K192-R196 VanDerWaalsContact O-N 3.08Å; A193-R196 PolarHBondContact O-N 2.79Å; L194-R196 PolarHBondContact O-N 3.04Å; R196-E199 PolarHBondContact O-N 3.29Å; R196-R200 HydrophobicContact CG-CG 4.23Å; R196-R200 VanDerWaalsContact O-CB 3.23Å; R196-R200 WeakPolarHBondContact O-CB 3.27Å; R196-R200 WeakPolarHBondContact O-CG 3.42Å; R196-R200 PolarHBondContact O-N 3.12Å
197	F	98.5	Very high	94.7	Very high	2 Å²	2	51 Å²	51	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-52.5	175.9	173	-99.4	0	0	0	111.4	L166 R167 Y170 A193 L194 R195 E199 R200 V201 L209	L166-F197 HydrophobicContact CB-CD2 3.85Å; R167-F197 HydrophobicContact CB-CD2 4.39Å; R167-F197 HydrophobicContact CB-CE2 3.92Å; Y170-F197 HydrophobicContact CD1-CB 3.76Å; Y170-F197 HydrophobicContact CD1-CD1 4.09Å; Y170-F197 AromaticContact CD1-CD2 3.8Å; Y170-F197 HydrophobicContact CD1-CD2 3.8Å; Y170-F197 HydrophobicContact CD1-CE2 4.44Å; Y170-F197 AromaticContact CD1-CG 3.61Å; Y170-F197 HydrophobicContact CD1-CG 3.61Å; Y170-F197 HydrophobicContact CE1-CB 4.35Å; Y170-F197 AromaticContact CE1-CD1 3.82Å; Y170-F197 HydrophobicContact CE1-CD1 3.82Å; Y170-F197 AromaticContact CE1-CD2 3.74Å; Y170-F197 HydrophobicContact CE1-CD2 3.74Å; Y170-F197 HydrophobicContact CE1-CE1 4.03Å; Y170-F197 AromaticContact CE1-CE2 3.94Å; Y170-F197 HydrophobicContact CE1-CE2 3.94Å; Y170-F197 AromaticContact CE1-CG 3.69Å; Y170-F197 HydrophobicContact CE1-CG 3.69Å; Y170-F197 HydrophobicContact CE1-CZ 4.1Å; A193-F197 PolarHBondContact O-N 2.98Å; L194-F197 WeakPolarHBondContact O-CB 3.46Å; L194-F197 PolarHBondContact O-N 2.85Å; R195-F197 VanDerWaalsContact C-N 3.33Å; R195-F197 PolarHBondContact O-N 3.34Å; F197-E199 VanDerWaalsContact C-N 3.3Å; F197-E199 PolarHBondContact O-N 3.29Å; F197-R200 PolarHBondContact O-N 3.19Å; F197-V201 HydrophobicContact CD2-CB 4.36Å; F197-V201 HydrophobicContact CD2-CG2 3.53Å; F197-V201 HydrophobicContact CE2-CB 4.21Å; F197-V201 HydrophobicContact CE2-CG1 4.29Å; F197-V201 HydrophobicContact CE2-CG2 3.59Å; F197-V201 HydrophobicContact CG-CG2 4.27Å; F197-V201 HydrophobicContact CZ-CG1 4.39Å; F197-V201 HydrophobicContact CZ-CG2 4.36Å; F197-V201 WeakPolarHBondContact O-CB 3.41Å; F197-V201 WeakPolarHBondContact O-CG2 3.13Å; F197-V201 PolarHBondContact O-N 3.34Å; F197-L209 HydrophobicContact CE1-CD1 4.48Å; F197-L209 HydrophobicContact CZ-CD1 3.71Å
198	L	96.7	Very high	94.7	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-72.2	-19.2	-175.9	-63	174.9	0	0	0	114.7	L194 R195 L210 I298	L194-L198 WeakPolarHBondContact O-CG 3.4Å; L194-L198 PolarHBondContact O-N 2.68Å; R195-L198 PolarHBondContact O-N 2.99Å; L198-L210 HydrophobicContact CD2-CD1 3.61Å; L198-I298 HydrophobicContact CD1-CB 3.57Å; L198-I298 HydrophobicContact CD1-CD1 4.01Å; L198-I298 HydrophobicContact CD1-CG1 4.35Å; L198-I298 HydrophobicContact CD1-CG2 3.67Å
199	E	93.9	Very high	94.7	Very high	54 Å²	54	42.1 Å²	42.1	25%	0.252	19%	0.188	S	C	.	.	H	α-helix	trans	-90.3	-28.3	176.1	-72.8	166.6	-176.3	0	0	112.8	R195 R196 F197 R264	R195-E199 WeakPolarHBondContact O-CB 3.33Å; R195-E199 VanDerWaalsContact O-CG 3.28Å; R195-E199 WeakPolarHBondContact O-CG 3.4Å; R195-E199 PolarHBondContact O-N 3.48Å; R196-E199 PolarHBondContact O-N 3.29Å; F197-E199 VanDerWaalsContact C-N 3.3Å; F197-E199 PolarHBondContact O-N 3.29Å; E199-R264 IonicContact OE1-CZ 2.7Å; E199-R264 IonicContact OE1-NH2 3.08Å; E199-R264 PolarHBondContact OE1-NH2 2.97Å
200	R	94.8	Very high	94.7	Very high	86 Å²	86	36 Å²	36	33%	0.325	16%	0.162	S	C	.	.	H	α-helix	trans	-106.9	-24	-172.4	-58.8	-59.2	-175.3	81.5	3.4	114	K162 L166 R196 F197	K162-R200 WeakPolarHBondContact CE-O 3.49Å; K162-R200 PolarHBondContact NZ-O 3.43Å; L166-R200 HydrophobicContact CD1-CB 3.63Å; R196-R200 HydrophobicContact CG-CG 4.23Å; R196-R200 VanDerWaalsContact O-CB 3.23Å; R196-R200 WeakPolarHBondContact O-CB 3.27Å; R196-R200 WeakPolarHBondContact O-CG 3.42Å; R196-R200 PolarHBondContact O-N 3.12Å; F197-R200 PolarHBondContact O-N 3.19Å
201	V	94.4	Very high	94.6	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.024	16%	0.163	C	C	.	.	S	Bend	trans	-84.6	130.5	175.6	175.8	0	0	0	0	109.3	C163 L166 F197	C163-V201 HydrophobicContact CB-CG1 3.84Å; C163-V201 HydrophobicContact CB-CG2 4.29Å; C163-V201 VanDerWaalsContact SG-CG1 3.56Å; L166-V201 HydrophobicContact CB-CG2 4.13Å; L166-V201 HydrophobicContact CD1-CG2 3.71Å; F197-V201 HydrophobicContact CD2-CB 4.36Å; F197-V201 HydrophobicContact CD2-CG2 3.53Å; F197-V201 HydrophobicContact CE2-CB 4.21Å; F197-V201 HydrophobicContact CE2-CG1 4.29Å; F197-V201 HydrophobicContact CE2-CG2 3.59Å; F197-V201 HydrophobicContact CG-CG2 4.27Å; F197-V201 HydrophobicContact CZ-CG1 4.39Å; F197-V201 HydrophobicContact CZ-CG2 4.36Å; F197-V201 WeakPolarHBondContact O-CB 3.41Å; F197-V201 WeakPolarHBondContact O-CG2 3.13Å; F197-V201 PolarHBondContact O-N 3.34Å
202	P	91.1	Very high	94.4	Very high	27 Å²	27	35.7 Å²	35.7	18%	0.175	16%	0.161	C	C	.	.			trans	-54.8	146.8	176.1	-25.1	34.9	0	0	0	113	Y160 E204 Y205 S206	Y160-P202 HydrophobicContact CE1-CG 4.1Å; P202-E204 HydrophobicContact CB-CG 4.24Å; P202-E204 VanDerWaalsContact CB-OE1 3.25Å; P202-E204 WeakPolarHBondContact CB-OE1 3.04Å; P202-E204 WeakPolarHBondContact CB-OE2 2.97Å; P202-E204 PolarHBondContact O-N 3.13Å; P202-Y205 HydrophobicContact CB-CD2 4.27Å; P202-Y205 HydrophobicContact CG-CD2 4.45Å; P202-Y205 PolarHBondContact O-N 3.25Å; P202-Y205 VanDerWaalsContact O-N 3.15Å; P202-S206 PolarHBondContact O-N 3.14Å; P202-S206 VanDerWaalsContact O-N 3.1Å; P202-S206 PolarHBondContact O-OG 3.15Å; P202-S206 VanDerWaalsContact O-OG 3.14Å
203	E	88.5	Confident	94.1	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.126	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-31	-175.9	-70.9	80.1	-178.1	0	0	112.5	I128 Y205 S206 F207 K292	I128-E203 HydrophobicContact CD1-CB 4.39Å; I128-E203 HydrophobicContact CD1-CG 3.95Å; I128-E203 HydrophobicContact CG1-CB 3.91Å; I128-E203 HydrophobicContact CG1-CG 4.03Å; E203-Y205 PolarHBondContact O-N 3.1Å; E203-S206 WeakPolarHBondContact CA-OG 3.37Å; E203-S206 PolarHBondContact O-N 3.33Å; E203-F207 HydrophobicContact CB-CD1 4.29Å; E203-F207 HydrophobicContact CB-CD2 4.12Å; E203-F207 HydrophobicContact CB-CE1 4.31Å; E203-F207 HydrophobicContact CB-CE2 4.15Å; E203-F207 HydrophobicContact CB-CG 4.19Å; E203-F207 HydrophobicContact CB-CZ 4.24Å; E203-F207 HydrophobicContact CG-CD1 4.35Å; E203-F207 HydrophobicContact CG-CD2 4.49Å; E203-F207 HydrophobicContact CG-CE1 3.89Å; E203-F207 HydrophobicContact CG-CE2 4.06Å; E203-F207 HydrophobicContact CG-CZ 3.73Å; E203-F207 WeakPolarHBondContact O-CB 3.41Å; E203-F207 PolarHBondContact O-N 2.81Å; E203-K292 HydrophobicContact CG-CD 4.44Å; E203-K292 WeakPolarHBondContact OE1-CE 3.24Å; E203-K292 IonicContact OE1-NZ 3.4Å; E203-K292 PolarHBondContact OE1-NZ 3.37Å
204	E	86.1	Confident	93.7	Very high	94 Å²	94	32.9 Å²	32.9	44%	0.439	16%	0.158	S	C	.	.	H	α-helix	trans	-59	-31.2	177.5	63.6	-90.8	-151.4	0	0	113.2	P202 A208	P202-E204 HydrophobicContact CB-CG 4.24Å; P202-E204 VanDerWaalsContact CB-OE1 3.25Å; P202-E204 WeakPolarHBondContact CB-OE1 3.04Å; P202-E204 WeakPolarHBondContact CB-OE2 2.97Å; P202-E204 PolarHBondContact O-N 3.13Å; E204-A208 VanDerWaalsContact O-CB 3.28Å; E204-A208 WeakPolarHBondContact O-CB 3.43Å
205	Y	91.5	Very high	93.3	Very high	62 Å²	62	38.6 Å²	38.6	24%	0.243	20%	0.199	C	C	.	.	H	α-helix	trans	-93.4	-47	176.3	-62.1	-77.4	0	0	0	111.8	D156 Y160 P202 E203 A208 L209	D156-Y205 HydrophobicContact CB-CE1 4.39Å; Y160-Y205 AromaticContact CD1-CD2 3.68Å; Y160-Y205 HydrophobicContact CD1-CD2 3.68Å; Y160-Y205 AromaticContact CD1-CE2 3.51Å; Y160-Y205 HydrophobicContact CD1-CE2 3.51Å; Y160-Y205 HydrophobicContact CD1-CG 4.29Å; Y160-Y205 AromaticContact CD1-CZ 3.99Å; Y160-Y205 HydrophobicContact CD2-CE2 4.31Å; Y160-Y205 HydrophobicContact CE1-CD2 4.1Å; Y160-Y205 AromaticContact CE1-CE2 3.96Å; Y160-Y205 HydrophobicContact CE1-CE2 3.96Å; Y160-Y205 HydrophobicContact CG-CD2 4.3Å; Y160-Y205 HydrophobicContact CG-CE1 4.34Å; Y160-Y205 AromaticContact CG-CE2 3.73Å; Y160-Y205 HydrophobicContact CG-CE2 3.73Å; Y160-Y205 AromaticContact CG-CZ 3.75Å; P202-Y205 HydrophobicContact CB-CD2 4.27Å; P202-Y205 HydrophobicContact CG-CD2 4.45Å; P202-Y205 PolarHBondContact O-N 3.25Å; P202-Y205 VanDerWaalsContact O-N 3.15Å; E203-Y205 PolarHBondContact O-N 3.1Å; Y205-A208 PolarHBondContact O-N 3.36Å; Y205-L209 WeakPolarHBondContact O-CG 3.34Å; Y205-L209 PolarHBondContact O-N 3.48Å; Y205-L209 VanDerWaalsContact O-N 3.11Å
206	S	94.1	Very high	93	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-68.9	-38.7	-175	58.4	0	0	0	0	112.3	P202 E203 L209 L210	P202-S206 PolarHBondContact O-N 3.14Å; P202-S206 VanDerWaalsContact O-N 3.1Å; P202-S206 PolarHBondContact O-OG 3.15Å; P202-S206 VanDerWaalsContact O-OG 3.14Å; E203-S206 WeakPolarHBondContact CA-OG 3.37Å; E203-S206 PolarHBondContact O-N 3.33Å; S206-L209 PolarHBondContact O-N 2.66Å; S206-L210 WeakPolarHBondContact O-CG 3.46Å; S206-L210 PolarHBondContact O-N 2.86Å; S206-L210 VanDerWaalsContact O-N 3.13Å
207	F	93.8	Very high	92.9	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.013	21%	0.208	C	C	.	.	H	α-helix	trans	-73.8	-33.9	176.5	-70.4	7.9	0	0	0	111.7	I128 E203 L209 L210 F211 L291 K292 T295 M350	I128-F207 HydrophobicContact CG2-CD2 4.05Å; I128-F207 HydrophobicContact CG2-CE2 3.85Å; E203-F207 HydrophobicContact CB-CD1 4.29Å; E203-F207 HydrophobicContact CB-CD2 4.12Å; E203-F207 HydrophobicContact CB-CE1 4.31Å; E203-F207 HydrophobicContact CB-CE2 4.15Å; E203-F207 HydrophobicContact CB-CG 4.19Å; E203-F207 HydrophobicContact CB-CZ 4.24Å; E203-F207 HydrophobicContact CG-CD1 4.35Å; E203-F207 HydrophobicContact CG-CD2 4.49Å; E203-F207 HydrophobicContact CG-CE1 3.89Å; E203-F207 HydrophobicContact CG-CE2 4.06Å; E203-F207 HydrophobicContact CG-CZ 3.73Å; E203-F207 WeakPolarHBondContact O-CB 3.41Å; E203-F207 PolarHBondContact O-N 2.81Å; F207-L209 VanDerWaalsContact C-N 3.29Å; F207-L209 PolarHBondContact O-N 3.45Å; F207-L210 PolarHBondContact O-N 2.76Å; F207-F211 HydrophobicContact CB-CD2 3.83Å; F207-F211 HydrophobicContact CB-CE2 4.24Å; F207-F211 HydrophobicContact CD1-CD2 4.37Å; F207-F211 AromaticContact CD1-CE2 3.91Å; F207-F211 HydrophobicContact CD1-CE2 3.91Å; F207-F211 HydrophobicContact CD2-CE2 4.48Å; F207-F211 HydrophobicContact CE1-CE2 4.37Å; F207-F211 HydrophobicContact CG-CD2 4.04Å; F207-F211 AromaticContact CG-CE2 3.97Å; F207-F211 HydrophobicContact CG-CE2 3.97Å; F207-F211 WeakPolarHBondContact O-CB 3.39Å; F207-F211 WeakPolarHBondContact O-CD2 3.27Å; F207-F211 PolarHBondContact O-N 3.48Å; F207-L291 HydrophobicContact CD2-CB 4.39Å; F207-L291 HydrophobicContact CD2-CD1 4.38Å; F207-L291 HydrophobicContact CE2-CB 3.87Å; F207-L291 HydrophobicContact CZ-CB 4.21Å; F207-K292 HydrophobicContact CE1-CD 4.44Å; F207-K292 HydrophobicContact CZ-CB 4.09Å; F207-K292 HydrophobicContact CZ-CD 4.01Å; F207-T295 HydrophobicContact CD1-CG2 4.07Å; F207-T295 HydrophobicContact CE1-CG2 3.63Å; F207-T295 HydrophobicContact CZ-CG2 4.44Å; F207-M350 HydrophobicContact CB-CE 3.86Å
208	A	91.6	Very high	92.7	Very high	31 Å²	31	43.9 Å²	43.9	26%	0.256	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-38.5	174.1	0	0	0	0	0	111.7	A153 E204 Y205 C212	A153-A208 HydrophobicContact CB-CB 3.79Å; A153-A208 WeakPolarHBondContact CB-O 3.31Å; E204-A208 VanDerWaalsContact O-CB 3.28Å; E204-A208 WeakPolarHBondContact O-CB 3.43Å; Y205-A208 PolarHBondContact O-N 3.36Å; A208-C212 WeakPolarHBondContact O-CB 3.36Å; A208-C212 PolarHBondContact O-N 2.03Å
209	L	94.3	Very high	92.6	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-68.7	-39.5	174.9	-78.4	169	0	0	0	113.7	A153 A154 C157 F197 Y205 S206 F207 T226	A153-L209 HydrophobicContact CB-CD2 4.27Å; A153-L209 HydrophobicContact CB-CG 4.42Å; A154-L209 HydrophobicContact CB-CD2 3.96Å; C157-L209 HydrophobicContact CB-CD1 3.89Å; C157-L209 HydrophobicContact CB-CG 4.47Å; F197-L209 HydrophobicContact CE1-CD1 4.48Å; F197-L209 HydrophobicContact CZ-CD1 3.71Å; Y205-L209 WeakPolarHBondContact O-CG 3.34Å; Y205-L209 PolarHBondContact O-N 3.48Å; Y205-L209 VanDerWaalsContact O-N 3.11Å; S206-L209 PolarHBondContact O-N 2.66Å; F207-L209 VanDerWaalsContact C-N 3.29Å; F207-L209 PolarHBondContact O-N 3.45Å; L209-T226 HydrophobicContact CB-CG2 4.08Å; L209-T226 PolarHBondContact O-OG1 3.46Å
210	L	96.1	Very high	92.7	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-82.8	-37.1	-174.7	-73.6	173.5	0	0	0	113.1	L198 S206 F207 R223 T226 I227 T295 I298 Y306	L198-L210 HydrophobicContact CD2-CD1 3.61Å; S206-L210 WeakPolarHBondContact O-CG 3.46Å; S206-L210 PolarHBondContact O-N 2.86Å; S206-L210 VanDerWaalsContact O-N 3.13Å; F207-L210 PolarHBondContact O-N 2.76Å; L210-R223 WeakPolarHBondContact O-CG 3.41Å; L210-T226 HydrophobicContact CD2-CG2 3.73Å; L210-T226 HydrophobicContact CG-CG2 4.35Å; L210-I227 HydrophobicContact CD2-CG2 3.74Å; L210-T295 HydrophobicContact CD1-CG2 3.58Å; L210-I298 HydrophobicContact CD1-CD1 4.05Å; L210-I298 HydrophobicContact CD2-CD1 4.07Å; L210-Y306 WeakPolarHBondContact O-CE2 3.18Å; L210-Y306 PolarHBondContact O-OH 3.33Å
211	F	95.2	Very high	92.8	Very high	4 Å²	4	39 Å²	39	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-121.6	17.9	-167.2	-50.3	-62.6	0	0	0	113.5	F207 L291 Y294 T295 I347 M350	F207-F211 HydrophobicContact CB-CD2 3.83Å; F207-F211 HydrophobicContact CB-CE2 4.24Å; F207-F211 HydrophobicContact CD1-CD2 4.37Å; F207-F211 AromaticContact CD1-CE2 3.91Å; F207-F211 HydrophobicContact CD1-CE2 3.91Å; F207-F211 HydrophobicContact CD2-CE2 4.48Å; F207-F211 HydrophobicContact CE1-CE2 4.37Å; F207-F211 HydrophobicContact CG-CD2 4.04Å; F207-F211 AromaticContact CG-CE2 3.97Å; F207-F211 HydrophobicContact CG-CE2 3.97Å; F207-F211 WeakPolarHBondContact O-CB 3.39Å; F207-F211 WeakPolarHBondContact O-CD2 3.27Å; F207-F211 PolarHBondContact O-N 3.48Å; F211-L291 HydrophobicContact CD1-CD2 4.25Å; F211-L291 HydrophobicContact CD2-CD1 4.3Å; F211-L291 HydrophobicContact CD2-CD2 4.23Å; F211-L291 HydrophobicContact CE1-CD2 4.02Å; F211-L291 HydrophobicContact CE2-CB 4.15Å; F211-L291 HydrophobicContact CE2-CD1 4.46Å; F211-L291 HydrophobicContact CE2-CD2 4.01Å; F211-L291 HydrophobicContact CE2-CG 4.42Å; F211-L291 HydrophobicContact CG-CD2 4.35Å; F211-L291 HydrophobicContact CZ-CB 4.45Å; F211-L291 HydrophobicContact CZ-CD2 3.89Å; F211-Y294 AromaticContact CE1-CD1 3.77Å; F211-Y294 HydrophobicContact CE1-CD1 3.77Å; F211-Y294 AromaticContact CE1-CE1 3.7Å; F211-Y294 HydrophobicContact CE1-CE1 3.7Å; F211-Y294 AromaticContact CZ-CD1 3.69Å; F211-Y294 HydrophobicContact CZ-CD1 3.69Å; F211-Y294 HydrophobicContact CZ-CE1 4.02Å; F211-T295 HydrophobicContact CE2-CG2 3.69Å; F211-T295 HydrophobicContact CZ-CG2 3.57Å; F211-I347 HydrophobicContact CD1-CG1 4.07Å; F211-I347 HydrophobicContact CD1-CG2 4.44Å; F211-I347 HydrophobicContact CE1-CG1 4.3Å; F211-M350 HydrophobicContact CB-CB 4.16Å; F211-M350 HydrophobicContact CB-CG 3.85Å
212	C	92.8	Very high	92.9	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.034	24%	0.24	C	C	.	.			trans	-50.3	133.1	175	41.1	0	0	0	0	111.7	Q149 C150 A208 R223	Q149-C212 HydrophobicContact CB-CB 4.41Å; C150-C212 WeakPolarHBondContact CA-SG 3.32Å; C150-C212 HydrophobicContact CB-CB 3.89Å; C150-C212 WeakPolarHBondContact CB-SG 3.33Å; C150-C212 WeakPolarHBondContact SG-CB 3.42Å; C150-C212 CovalentContact SG-SG 2.01Å; C150-C212 PolarHBondContact SG-SG 2.89Å; A208-C212 WeakPolarHBondContact O-CB 3.36Å; A208-C212 PolarHBondContact O-N 2.03Å; C212-R223 VanDerWaalsContact O-CD 3.26Å; C212-R223 WeakPolarHBondContact O-CD 3.45Å; C212-R223 PolarHBondContact O-NH1 3.27Å
213	P	91.5	Very high	93.2	Very high	53 Å²	53	43 Å²	43	34%	0.344	23%	0.234	S	C	.	.			trans	-69.8	148	173.5	31.7	-36.7	0	0	0	110.3	Q149 C219	Q149-P213 HydrophobicContact CB-CG 4.34Å; Q149-P213 HydrophobicContact CG-CG 4.21Å; P213-C219 PolarHBondContact O-SG 2.98Å
214	C	90.8	Very high	93.6	Very high	43 Å²	43	43.8 Å²	43.8	29%	0.291	24%	0.236	S	C	.	.			trans	-135.8	139	-177.9	-70	0	0	0	0	111.5	C150 C219 G220	C150-C214 PolarHBondContact SG-SG 2.91Å; C214-C219 WeakPolarHBondContact CA-SG 2.96Å; C214-C219 HydrophobicContact CB-CB 3.54Å; C214-C219 WeakPolarHBondContact CB-SG 3.45Å; C214-C219 WeakPolarHBondContact SG-CB 3.49Å; C214-C219 PolarHBondContact SG-O 2.86Å; C214-C219 VanDerWaalsContact SG-O 3.37Å; C214-C219 CovalentContact SG-SG 2.05Å; C214-C219 PolarHBondContact SG-SG 3.09Å; C214-G220 PolarHBondContact SG-N 3.2Å; C214-G220 VanDerWaalsContact SG-N 3.37Å
215	S	88.8	Confident	94.1	Very high	123 Å²	123	45 Å²	45	86%	0.86	24%	0.239	S	C	*	.	S	Bend	trans	-100.6	-17.2	174.2	46.3	0	0	0	0	113.1
216	D	91.4	Very high	94.5	Very high	74 Å²	74	42.8 Å²	42.8	40%	0.396	23%	0.233	S	C	.	.	S	Bend	trans	-137.4	169.5	-176.3	64.1	55.9	0	0	0	112.5	L218 C219 G220	D216-L218 WeakPolarHBondContact OD1-CB 3.43Å; D216-L218 PolarHBondContact OD1-N 2.7Å; D216-C219 WeakPolarHBondContact OD1-CB 3.25Å; D216-C219 PolarHBondContact OD1-N 3.36Å; D216-G220 PolarHBondContact O-N 3.23Å; D216-G220 VanDerWaalsContact O-N 3.08Å
217	T	94.9	Very high	94.6	Very high	73 Å²	73	43 Å²	43	45%	0.448	23%	0.234	S	C	.	.	H	α-helix	trans	-73.7	-23.4	-177.3	54.3	0	0	0	0	113.5	E221	T217-E221 VanDerWaalsContact O-CB 3.23Å; T217-E221 WeakPolarHBondContact O-CB 3.21Å; T217-E221 PolarHBondContact O-N 3.4Å
218	L	94.4	Very high	94.8	Very high	136 Å²	136	43.9 Å²	43.9	71%	0.712	24%	0.239	S	C	*	.	H	α-helix	trans	-71.9	-42.8	177.2	-66.1	176.6	0	0	0	110.7	D216 E221 R222	D216-L218 WeakPolarHBondContact OD1-CB 3.43Å; D216-L218 PolarHBondContact OD1-N 2.7Å; L218-E221 PolarHBondContact O-N 3.15Å; L218-R222 PolarHBondContact O-N 3.23Å
219	C	95.4	Very high	94.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-50.3	168.9	-178.4	0	0	0	0	111.1	N148 C150 P213 C214 D216 E221 R222 R223	N148-C219 WeakPolarHBondContact ND2-CA 3.34Å; N148-C219 WeakPolarHBondContact ND2-CB 3.43Å; N148-C219 PolarHBondContact ND2-N 3.41Å; N148-C219 PolarHBondContact OD1-SG 2.79Å; C150-C219 PolarHBondContact SG-SG 2.63Å; P213-C219 PolarHBondContact O-SG 2.98Å; C214-C219 WeakPolarHBondContact CA-SG 2.96Å; C214-C219 HydrophobicContact CB-CB 3.54Å; C214-C219 WeakPolarHBondContact CB-SG 3.45Å; C214-C219 WeakPolarHBondContact SG-CB 3.49Å; C214-C219 PolarHBondContact SG-O 2.86Å; C214-C219 VanDerWaalsContact SG-O 3.37Å; C214-C219 CovalentContact SG-SG 2.05Å; C214-C219 PolarHBondContact SG-SG 3.09Å; D216-C219 WeakPolarHBondContact OD1-CB 3.25Å; D216-C219 PolarHBondContact OD1-N 3.36Å; C219-E221 VanDerWaalsContact C-N 3.27Å; C219-E221 PolarHBondContact O-N 2.94Å; C219-R222 WeakPolarHBondContact O-CB 3.38Å; C219-R222 PolarHBondContact O-N 3.46Å; C219-R222 VanDerWaalsContact O-N 3.12Å; C219-R223 PolarHBondContact O-N 2.96Å
220	G	95.9	Very high	94.8	Very high	1 Å²	1	46 Å²	46	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-35.4	179.6	0	0	0	0	0	112.9	C214 D216 R223 R224 N309	C214-G220 PolarHBondContact SG-N 3.2Å; C214-G220 VanDerWaalsContact SG-N 3.37Å; D216-G220 PolarHBondContact O-N 3.23Å; D216-G220 VanDerWaalsContact O-N 3.08Å; G220-R223 WeakPolarHBondContact O-CB 3.22Å; G220-R223 PolarHBondContact O-N 3.49Å; G220-R224 WeakPolarHBondContact O-CB 3.47Å; G220-R224 PolarHBondContact O-N 2.94Å; G220-N309 WeakPolarHBondContact CA-O 3.49Å
221	E	96.6	Very high	94.7	Very high	40 Å²	40	45.6 Å²	45.6	19%	0.187	25%	0.251	C	S	.	.	H	α-helix	trans	-70.1	-38.7	175	-177.2	61	-170.2	0	0	111.9	T217 L218 C219 R223 R224 K225 N309	T217-E221 VanDerWaalsContact O-CB 3.23Å; T217-E221 WeakPolarHBondContact O-CB 3.21Å; T217-E221 PolarHBondContact O-N 3.4Å; L218-E221 PolarHBondContact O-N 3.15Å; C219-E221 VanDerWaalsContact C-N 3.27Å; C219-E221 PolarHBondContact O-N 2.94Å; E221-R223 VanDerWaalsContact C-N 3.33Å; E221-R223 PolarHBondContact O-N 3.1Å; E221-R224 PolarHBondContact O-N 3.2Å; E221-R224 IonicContact OE1-CZ 3.69Å; E221-R224 IonicContact OE1-NE 3.46Å; E221-R224 IonicContact OE1-NH2 3.65Å; E221-R224 PolarHBondContact OE1-NH2 3.44Å; E221-R224 IonicContact OE2-CZ 2.85Å; E221-R224 IonicContact OE2-NE 2.78Å; E221-R224 PolarHBondContact OE2-NE 2.84Å; E221-R224 IonicContact OE2-NH2 3.55Å; E221-R224 PolarHBondContact OE2-NH2 3.01Å; E221-K225 HydrophobicContact CG-CD 4.19Å; E221-K225 WeakPolarHBondContact O-CB 3.43Å; E221-K225 WeakPolarHBondContact O-CG 3.32Å; E221-K225 PolarHBondContact O-N 3Å; E221-K225 WeakPolarHBondContact OE1-CD 3.36Å; E221-K225 WeakPolarHBondContact OE1-CE 3.22Å; E221-K225 IonicContact OE1-NZ 3.52Å; E221-K225 PolarHBondContact OE1-NZ 3.02Å; E221-K225 VanDerWaalsContact OE1-NZ 3.16Å; E221-N309 HydrophobicContact CB-CB 3.96Å
222	R	96.8	Very high	94.7	Very high	103 Å²	103	45.4 Å²	45.4	39%	0.389	25%	0.25	S	C	.	.	H	α-helix	trans	-59.3	-45.5	172.1	-177.2	177.6	-65.1	-81.7	-0.7	110.9	C150 L218 C219 K225 T226	C150-R222 VanDerWaalsContact C-CD 3.49Å; C150-R222 HydrophobicContact CB-CB 4.2Å; C150-R222 HydrophobicContact CB-CG 3.88Å; L218-R222 PolarHBondContact O-N 3.23Å; C219-R222 WeakPolarHBondContact O-CB 3.38Å; C219-R222 PolarHBondContact O-N 3.46Å; C219-R222 VanDerWaalsContact O-N 3.12Å; R222-K225 PolarHBondContact O-N 3.38Å; R222-T226 PolarHBondContact O-N 2.97Å; R222-T226 PolarHBondContact O-OG1 2.83Å
223	R	96.9	Very high	94.7	Very high	12 Å²	12	45.6 Å²	45.6	5%	0.045	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-49	176	-172	173.8	66.9	-156.7	-1.3	112	L210 C212 C219 G220 E221 K225 T226 Y306 S311	L210-R223 WeakPolarHBondContact O-CG 3.41Å; C212-R223 VanDerWaalsContact O-CD 3.26Å; C212-R223 WeakPolarHBondContact O-CD 3.45Å; C212-R223 PolarHBondContact O-NH1 3.27Å; C219-R223 PolarHBondContact O-N 2.96Å; G220-R223 WeakPolarHBondContact O-CB 3.22Å; G220-R223 PolarHBondContact O-N 3.49Å; E221-R223 VanDerWaalsContact C-N 3.33Å; E221-R223 PolarHBondContact O-N 3.1Å; R223-K225 VanDerWaalsContact C-N 3.25Å; R223-K225 PolarHBondContact O-N 3.27Å; R223-T226 WeakPolarHBondContact O-CB 3.04Å; R223-T226 PolarHBondContact O-N 3.09Å; R223-T226 PolarHBondContact O-OG1 2.99Å; R223-T226 VanDerWaalsContact O-OG1 3.06Å; R223-Y306 HydrophobicContact CG-CD2 4.01Å; R223-Y306 HydrophobicContact CG-CE2 3.49Å; R223-Y306 VanDerWaalsContact CG-CE2 3.49Å; R223-S311 PolarHBondContact NH2-O 3.41Å
224	R	97.4	Very high	94.6	Very high	43 Å²	43	45.3 Å²	45.3	16%	0.162	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-34.1	178	-169.9	-173.7	76.1	84.3	1.8	112.5	G220 E221 E234 N305	G220-R224 WeakPolarHBondContact O-CB 3.47Å; G220-R224 PolarHBondContact O-N 2.94Å; E221-R224 PolarHBondContact O-N 3.2Å; E221-R224 IonicContact OE1-CZ 3.69Å; E221-R224 IonicContact OE1-NE 3.46Å; E221-R224 IonicContact OE1-NH2 3.65Å; E221-R224 PolarHBondContact OE1-NH2 3.44Å; E221-R224 IonicContact OE2-CZ 2.85Å; E221-R224 IonicContact OE2-NE 2.78Å; E221-R224 PolarHBondContact OE2-NE 2.84Å; E221-R224 IonicContact OE2-NH2 3.55Å; E221-R224 PolarHBondContact OE2-NH2 3.01Å; R224-E234 IonicContact NH1-OE1 3.3Å; R224-E234 PolarHBondContact NH1-OE1 3.18Å; R224-N305 PolarHBondContact O-ND2 3.07Å
225	K	96.9	Very high	93.8	Very high	119 Å²	119	48.9 Å²	48.9	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-82.1	-6.4	179.6	-79.2	-178.8	164.5	159	0	114.7	E221 R222 R223 I227 V228	E221-K225 HydrophobicContact CG-CD 4.19Å; E221-K225 WeakPolarHBondContact O-CB 3.43Å; E221-K225 WeakPolarHBondContact O-CG 3.32Å; E221-K225 PolarHBondContact O-N 3Å; E221-K225 WeakPolarHBondContact OE1-CD 3.36Å; E221-K225 WeakPolarHBondContact OE1-CE 3.22Å; E221-K225 IonicContact OE1-NZ 3.52Å; E221-K225 PolarHBondContact OE1-NZ 3.02Å; E221-K225 VanDerWaalsContact OE1-NZ 3.16Å; R222-K225 PolarHBondContact O-N 3.38Å; R223-K225 VanDerWaalsContact C-N 3.25Å; R223-K225 PolarHBondContact O-N 3.27Å; K225-I227 PolarHBondContact O-N 2.92Å; K225-I227 VanDerWaalsContact O-N 3.09Å; K225-V228 PolarHBondContact O-N 2.89Å
226	T	98.1	Very high	92.5	Very high	17 Å²	17	48.3 Å²	48.3	10%	0.104	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-38.4	-176.8	-65.9	0	0	0	0	113.3	Y170 L209 L210 R222 R223	Y170-T226 WeakPolarHBondContact CE2-O 3.24Å; Y170-T226 PolarHBondContact OH-O 2.93Å; L209-T226 HydrophobicContact CB-CG2 4.08Å; L209-T226 PolarHBondContact O-OG1 3.46Å; L210-T226 HydrophobicContact CD2-CG2 3.73Å; L210-T226 HydrophobicContact CG-CG2 4.35Å; R222-T226 PolarHBondContact O-N 2.97Å; R222-T226 PolarHBondContact O-OG1 2.83Å; R223-T226 WeakPolarHBondContact O-CB 3.04Å; R223-T226 PolarHBondContact O-N 3.09Å; R223-T226 PolarHBondContact O-OG1 2.99Å; R223-T226 VanDerWaalsContact O-OG1 3.06Å
227	I	97.9	Very high	90.7	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	10.2	-178.2	64.5	168.1	0	0	0	114.4	L194 L210 K225 S232 I298 T303 N305	L194-I227 HydrophobicContact CD2-CB 4.29Å; L194-I227 HydrophobicContact CD2-CG2 4.34Å; L210-I227 HydrophobicContact CD2-CG2 3.74Å; K225-I227 PolarHBondContact O-N 2.92Å; K225-I227 VanDerWaalsContact O-N 3.09Å; I227-S232 VanDerWaalsContact O-CB 3.29Å; I227-S232 WeakPolarHBondContact O-CB 3.15Å; I227-S232 PolarHBondContact O-OG 3.49Å; I227-I298 HydrophobicContact CG2-CD1 4.37Å; I227-I298 HydrophobicContact CG2-CG2 3.99Å; I227-T303 HydrophobicContact CD1-CG2 3.86Å; I227-N305 HydrophobicContact CD1-CB 4.07Å
228	V	96.8	Very high	88.6	Confident	21 Å²	21	52.6 Å²	52.6	13%	0.127	26%	0.258	C	S	.	.			trans	56.3	67.4	-176.8	-165.9	0	0	0	0	112.1	Y170 C174 T175 K225 S230 C231 S232	Y170-V228 HydrophobicContact CE2-CG2 4.38Å; C174-V228 HydrophobicContact CB-CB 3.8Å; C174-V228 HydrophobicContact CB-CG1 3.86Å; C174-V228 HydrophobicContact CB-CG2 3.98Å; T175-V228 HydrophobicContact CG2-CG1 4.17Å; K225-V228 PolarHBondContact O-N 2.89Å; V228-S230 PolarHBondContact O-N 3.3Å; V228-S230 VanDerWaalsContact O-N 3.14Å; V228-C231 HydrophobicContact CG1-CB 4.34Å; V228-C231 PolarHBondContact O-N 3.36Å; V228-S232 PolarHBondContact O-N 2.86Å; V228-S232 PolarHBondContact O-OG 2.04Å; V228-S232 VanDerWaalsContact O-OG 3.05Å
229	P	95	Very high	86.4	Confident	7 Å²	7	50.2 Å²	50.2	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-28.3	-169.4	21.8	-33.1	0	0	0	114.7	C231 F233 E234	P229-C231 PolarHBondContact O-N 3.27Å; P229-F233 HydrophobicContact CB-CB 3.91Å; P229-F233 HydrophobicContact CB-CD1 4.34Å; P229-F233 CarbonylContact O-C 3.57Å; P229-F233 WeakPolarHBondContact O-CB 2.99Å; P229-F233 PolarHBondContact O-N 2.9Å; P229-F233 VanDerWaalsContact O-N 3.08Å; P229-E234 WeakPolarHBondContact O-CB 3.45Å; P229-E234 PolarHBondContact O-N 2.88Å
230	S	91.1	Very high	84	Confident	74 Å²	74	58.4 Å²	58.4	52%	0.517	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-14.4	177.3	57.4	0	0	0	0	114.1	V228	V228-S230 PolarHBondContact O-N 3.3Å; V228-S230 VanDerWaalsContact O-N 3.14Å
231	C	93.4	Very high	81.8	Confident	3 Å²	3	67 Å²	67	2%	0.02	35%	0.345	C	S	.	.	H	α-helix	trans	-119	-46.4	177.7	179.5	0	0	0	0	112.3	C174 C185 R187 C190 V228 P229	C174-C231 HydrophobicContact CB-CB 4.25Å; C174-C231 VanDerWaalsContact O-CB 3.31Å; C174-C231 WeakPolarHBondContact O-CB 3.5Å; C174-C231 PolarHBondContact O-SG 3.24Å; C174-C231 VanDerWaalsContact O-SG 3.41Å; C185-C231 HydrophobicContact CB-CB 3.77Å; C185-C231 WeakPolarHBondContact CB-SG 3.25Å; C185-C231 WeakPolarHBondContact SG-CA 3.19Å; C185-C231 WeakPolarHBondContact SG-CB 3.04Å; C185-C231 CovalentContact SG-SG 2.01Å; C185-C231 PolarHBondContact SG-SG 2.03Å; R187-C231 WeakPolarHBondContact CG-O 3.43Å; R187-C231 PolarHBondContact NH1-O 2.84Å; C190-C231 VanDerWaalsContact SG-SG 3.6Å; V228-C231 HydrophobicContact CG1-CB 4.34Å; V228-C231 PolarHBondContact O-N 3.36Å; P229-C231 PolarHBondContact O-N 3.27Å
232	S	94.9	Very high	79.8	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-88.3	-21.9	-170.5	66	0	0	0	0	114.5	R187 H191 I227 V228	R187-S232 PolarHBondContact NH2-O 2.69Å; H191-S232 PolarHBondContact NE2-O 3.41Å; I227-S232 VanDerWaalsContact O-CB 3.29Å; I227-S232 WeakPolarHBondContact O-CB 3.15Å; I227-S232 PolarHBondContact O-OG 3.49Å; V228-S232 PolarHBondContact O-N 2.86Å; V228-S232 PolarHBondContact O-OG 2.04Å; V228-S232 VanDerWaalsContact O-OG 3.05Å
233	F	94.1	Very high	78.2	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.035	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-68.1	-173.1	-179.2	-117.1	0	0	0	110.4	R187 P229 T303 N305 S315 W317	R187-F233 PolarHBondContact NH1-O 2.83Å; R187-F233 PolarHBondContact NH2-O 2.94Å; P229-F233 HydrophobicContact CB-CB 3.91Å; P229-F233 HydrophobicContact CB-CD1 4.34Å; P229-F233 CarbonylContact O-C 3.57Å; P229-F233 WeakPolarHBondContact O-CB 2.99Å; P229-F233 PolarHBondContact O-N 2.9Å; P229-F233 VanDerWaalsContact O-N 3.08Å; F233-T303 VanDerWaalsContact CD2-O 3.22Å; F233-T303 WeakPolarHBondContact CD2-O 3.43Å; F233-T303 WeakPolarHBondContact CE2-O 3.49Å; F233-N305 HydrophobicContact CB-CB 4.46Å; F233-N305 HydrophobicContact CD1-CB 3.96Å; F233-N305 HydrophobicContact CD2-CB 3.71Å; F233-N305 HydrophobicContact CE1-CB 4.05Å; F233-N305 HydrophobicContact CE2-CB 3.81Å; F233-N305 HydrophobicContact CG-CB 3.79Å; F233-N305 HydrophobicContact CZ-CB 3.99Å; F233-S315 WeakPolarHBondContact CE2-O 3.47Å; F233-W317 AromaticContact CD1-CE3 3.96Å; F233-W317 HydrophobicContact CD1-CE3 3.96Å; F233-W317 HydrophobicContact CD2-CB 4.15Å; F233-W317 AromaticContact CE1-CE3 3.54Å; F233-W317 HydrophobicContact CE1-CE3 3.54Å; F233-W317 HydrophobicContact CE1-CZ3 4.14Å; F233-W317 HydrophobicContact CE2-CB 3.93Å; F233-W317 HydrophobicContact CZ-CB 4.18Å; F233-W317 AromaticContact CZ-CE3 3.99Å; F233-W317 HydrophobicContact CZ-CE3 3.99Å
234	E	88.6	Confident	77.3	Confident	47 Å²	47	78.1 Å²	78.1	22%	0.22	41%	0.41	C	S	.	.			trans	-66.4	137.6	179	-58.9	168	-167.3	0	0	109.9	R187 R224 P229 W317	R187-E234 PolarHBondContact NH1-O 3.33Å; R224-E234 IonicContact NH1-OE1 3.3Å; R224-E234 PolarHBondContact NH1-OE1 3.18Å; P229-E234 WeakPolarHBondContact O-CB 3.45Å; P229-E234 PolarHBondContact O-N 2.88Å; E234-W317 HydrophobicContact CB-CH2 4.34Å; E234-W317 HydrophobicContact CB-CZ2 4.33Å; E234-W317 HydrophobicContact CG-CE3 4.18Å; E234-W317 HydrophobicContact CG-CH2 3.99Å; E234-W317 HydrophobicContact CG-CZ2 4.47Å; E234-W317 HydrophobicContact CG-CZ3 3.83Å
235	E	75.3	Confident	76.9	Confident	118 Å²	118	79.6 Å²	79.6	55%	0.551	42%	0.418	S	S	*	.			trans	-109.5	104.1	172.1	-171.5	164.8	-155.5	0	0	108
236	N	61.2	Low	76.7	Confident	111 Å²	111	76.2 Å²	76.2	59%	0.594	41%	0.408	S	S	*	.			trans	-99.7	100.5	177.8	-65.6	-45.8	0	0	0	107.9
237	A	53.4	Low	76.6	Confident	55 Å²	55	76.5 Å²	76.5	46%	0.455	41%	0.409	S	S	.	.			trans	-68.7	148.7	171.4	0	0	0	0	0	110.6	G239 V243	A237-G239 PolarHBondContact O-N 2.92Å; A237-V243 HydrophobicContact CB-CB 4.2Å; A237-V243 HydrophobicContact CB-CG2 3.56Å
238	R	50.3	Low	76.5	Confident	183 Å²	183	76.3 Å²	76.3	69%	0.691	41%	0.408	S	S	*	.	S	Bend	trans	-59.1	127.7	-177.8	-56.8	175.5	-166.6	-137.3	-4.9	110.7	D182 E240	D182-R238 IonicContact OD1-CZ 3.99Å; D182-R238 IonicContact OD1-NE 2.79Å; D182-R238 IonicContact OD2-CZ 3.38Å; D182-R238 IonicContact OD2-NE 3.9Å; D182-R238 IonicContact OD2-NH1 2.75Å; D182-R238 PolarHBondContact OD2-NH1 3.06Å; D182-R238 IonicContact OD2-NH2 3.94Å; D182-R238 PolarHBondContact OD2-NH2 3.05Å; R238-E240 PolarHBondContact O-N 3.38Å
239	G	47.5	Very low	76.5	Confident	86 Å²	86	76.8 Å²	76.8	89%	0.887	41%	0.41	S	S	*	.	S	Bend	trans	68.2	-29	144.6	0	0	0	0	0	120.2	A237	A237-G239 PolarHBondContact O-N 2.92Å
240	E	45.8	Very low	76.5	Confident	173 Å²	173	79 Å²	79	81%	0.808	43%	0.425	S	S	*	.	S	Bend	trans	-140.8	119.9	-174.7	-72.6	179.8	165.8	0	0	110.1	R238	R238-E240 PolarHBondContact O-N 3.38Å
241	E	49.9	Very low	76.7	Confident	183 Å²	183	76 Å²	76	86%	0.855	40%	0.404	S	S	*	.	S	Bend	trans	58.4	125	179.7	-147.3	165.3	-167.5	0	0	114.7	V243	E241-V243 VanDerWaalsContact C-N 3.29Å; E241-V243 PolarHBondContact O-N 3.38Å
242	R	54.3	Low	76.7	Confident	245 Å²	245	77.9 Å²	77.9	93%	0.925	41%	0.412	S	S	*	.			trans	-60.7	97.6	171.1	-70	176.3	-178.8	160.1	0.1	106.9	G244	R242-G244 PolarHBondContact O-N 3.38Å
243	V	64.1	Low	76.6	Confident	92 Å²	92	81.6 Å²	81.6	56%	0.558	43%	0.432	S	S	*	.			trans	-54.4	108.8	170.5	176.8	0	0	0	0	105.4	A237 E241	A237-V243 HydrophobicContact CB-CB 4.2Å; A237-V243 HydrophobicContact CB-CG2 3.56Å; E241-V243 VanDerWaalsContact C-N 3.29Å; E241-V243 PolarHBondContact O-N 3.38Å
244	G	77.4	Confident	76.6	Confident	50 Å²	50	88 Å²	88	52%	0.515	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-58.5	164.1	-178.6	0	0	0	0	0	110.2	R242	R242-G244 PolarHBondContact O-N 3.38Å
245	K	89.8	Confident	76.9	Confident	74 Å²	74	85.7 Å²	85.7	32%	0.322	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-54.6	128.8	174.1	-68.8	-173.6	-179.8	-174.4	0	109.6	W317 C318 S319	K245-W317 HydrophobicContact CD-CD2 4.44Å; K245-W317 HydrophobicContact CD-CE3 4.31Å; K245-W317 HydrophobicContact CD-CZ3 4.48Å; K245-W317 VanDerWaalsContact CE-CZ3 3.44Å; K245-W317 HydrophobicContact CG-CD2 4.06Å; K245-W317 HydrophobicContact CG-CE3 4.32Å; K245-W317 HydrophobicContact CG-CH2 4.32Å; K245-W317 HydrophobicContact CG-CZ2 4.04Å; K245-W317 HydrophobicContact CG-CZ3 4.46Å; K245-C318 WeakPolarHBondContact CD-O 3.01Å; K245-S319 PolarHBondContact O-OG 3.35Å
246	P	92.6	Very high	77.6	Confident	48 Å²	48	80.9 Å²	80.9	31%	0.312	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-61.6	163.9	177.9	27.7	-36.2	0	0	0	111	W317 C318 S319	P246-W317 WeakPolarHBondContact CD-O 3.44Å; P246-C318 CarbonylContact O-C 3.59Å; P246-C318 WeakPolarHBondContact O-CA 3.22Å; P246-C318 VanDerWaalsContact O-CB 3.22Å; P246-C318 WeakPolarHBondContact O-CB 3Å; P246-S319 PolarHBondContact O-N 2.95Å
247	N	95.1	Very high	79	Confident	24 Å²	24	84.2 Å²	84.2	13%	0.128	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-66.5	136.7	174.4	-169.9	-73.1	0	0	0	110.9	L249 S250 L251 S319 E321 S323	N247-L249 VanDerWaalsContact C-N 3.26Å; N247-L249 PolarHBondContact O-N 3.23Å; N247-L249 VanDerWaalsContact OD1-CB 3.27Å; N247-L249 WeakPolarHBondContact OD1-CB 3.25Å; N247-L249 PolarHBondContact OD1-N 3.34Å; N247-S250 WeakPolarHBondContact O-CB 3.49Å; N247-S250 PolarHBondContact O-N 2.98Å; N247-S250 VanDerWaalsContact O-N 3.12Å; N247-L251 PolarHBondContact O-N 2.95Å; N247-S319 CarbonylContact C-O 3.3Å; N247-S319 WeakPolarHBondContact CA-O 3.39Å; N247-E321 PolarHBondContact ND2-O 3.3Å; N247-S323 PolarHBondContact ND2-OG 3.37Å
248	C	96.9	Very high	80.8	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-63.4	-28.6	-178.5	-58.6	0	0	0	0	113.7	L251 Q252 C318 S319 I333 Q334	C248-L251 PolarHBondContact O-N 2.93Å; C248-Q252 WeakPolarHBondContact O-CB 3.48Å; C248-Q252 PolarHBondContact O-N 3.41Å; C248-C318 VanDerWaalsContact CA-SG 3.5Å; C248-C318 HydrophobicContact CB-CB 3.83Å; C248-C318 WeakPolarHBondContact CB-SG 3.02Å; C248-C318 WeakPolarHBondContact SG-CB 3.37Å; C248-C318 CovalentContact SG-SG 2.04Å; C248-C318 PolarHBondContact SG-SG 3.47Å; C248-S319 PolarHBondContact N-O 3.17Å; C248-S319 PolarHBondContact SG-O 3.49Å; C248-I333 HydrophobicContact CB-CB 4.4Å; C248-I333 HydrophobicContact CB-CD1 4.48Å; C248-I333 HydrophobicContact CB-CG2 4.19Å; C248-Q334 VanDerWaalsContact SG-CG 3.51Å
249	L	96.3	Very high	82.8	Confident	32 Å²	32	80 Å²	80	17%	0.168	41%	0.411	C	S	.	.	H	α-helix	trans	-66.6	-41.9	173.9	-65.5	162.3	0	0	0	110.8	N247 L251 Q252 N253 E326 C330 I333	N247-L249 VanDerWaalsContact C-N 3.26Å; N247-L249 PolarHBondContact O-N 3.23Å; N247-L249 VanDerWaalsContact OD1-CB 3.27Å; N247-L249 WeakPolarHBondContact OD1-CB 3.25Å; N247-L249 PolarHBondContact OD1-N 3.34Å; L249-L251 VanDerWaalsContact C-N 3.35Å; L249-Q252 PolarHBondContact O-N 3Å; L249-N253 WeakPolarHBondContact O-CB 3.4Å; L249-N253 PolarHBondContact O-N 2.69Å; L249-E326 HydrophobicContact CD1-CB 3.49Å; L249-E326 VanDerWaalsContact CD1-CB 3.49Å; L249-C330 HydrophobicContact CD1-CB 3.94Å; L249-C330 HydrophobicContact CG-CB 3.89Å; L249-I333 HydrophobicContact CD2-CD1 3.75Å; L249-I333 HydrophobicContact CG-CD1 4.33Å
250	S	94.6	Very high	85.1	Confident	52 Å²	52	76.8 Å²	76.8	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-62.4	-44	174.1	-51.6	0	0	0	0	111	N247 Q252 N253 Y254	N247-S250 WeakPolarHBondContact O-CB 3.49Å; N247-S250 PolarHBondContact O-N 2.98Å; N247-S250 VanDerWaalsContact O-N 3.12Å; S250-Q252 VanDerWaalsContact C-N 3.34Å; S250-Q252 PolarHBondContact O-N 3.4Å; S250-N253 PolarHBondContact O-N 2.82Å; S250-Y254 WeakPolarHBondContact O-CD2 3.44Å; S250-Y254 PolarHBondContact O-N 3Å
251	L	94.6	Very high	87.5	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-43.4	176.6	-169	68	0	0	0	112.1	N247 C248 L249 Y254 C255 I301 M302 Q316 C318	N247-L251 PolarHBondContact O-N 2.95Å; C248-L251 PolarHBondContact O-N 2.93Å; L249-L251 VanDerWaalsContact C-N 3.35Å; L251-Y254 PolarHBondContact O-N 2.92Å; L251-C255 PolarHBondContact O-N 3.21Å; L251-I301 HydrophobicContact CD1-CD1 4.29Å; L251-I301 HydrophobicContact CD1-CG1 3.78Å; L251-M302 HydrophobicContact CD2-CG 4.27Å; L251-M302 HydrophobicContact CG-CG 4.07Å; L251-Q316 HydrophobicContact CD2-CB 4.17Å; L251-C318 HydrophobicContact CB-CB 4.5Å; L251-C318 HydrophobicContact CD2-CB 3.99Å
252	Q	94.6	Very high	89.6	Confident	41 Å²	41	60.3 Å²	60.3	19%	0.192	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-41	175.2	-173.1	-172.7	28.2	0	0	111.9	C248 L249 S250 C255 S256 F265 I333	C248-Q252 WeakPolarHBondContact O-CB 3.48Å; C248-Q252 PolarHBondContact O-N 3.41Å; L249-Q252 PolarHBondContact O-N 3Å; S250-Q252 VanDerWaalsContact C-N 3.34Å; S250-Q252 PolarHBondContact O-N 3.4Å; Q252-C255 WeakPolarHBondContact O-CB 3.35Å; Q252-C255 PolarHBondContact O-N 2.91Å; Q252-S256 PolarHBondContact O-N 3.28Å; Q252-F265 HydrophobicContact CG-CE1 4.32Å; Q252-I333 HydrophobicContact CB-CD1 4.04Å; Q252-I333 HydrophobicContact CG-CD1 4.45Å
253	N	92.4	Very high	91.6	Very high	78 Å²	78	48.6 Å²	48.6	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-38.6	176.9	-173.8	6.9	0	0	0	112	L249 S250 C255 S256 R257	L249-N253 WeakPolarHBondContact O-CB 3.4Å; L249-N253 PolarHBondContact O-N 2.69Å; S250-N253 PolarHBondContact O-N 2.82Å; N253-C255 VanDerWaalsContact C-N 3.33Å; N253-S256 PolarHBondContact O-N 3.12Å; N253-S256 PolarHBondContact O-OG 3.46Å; N253-R257 WeakPolarHBondContact O-CG 3.28Å; N253-R257 PolarHBondContact OD1-NE 2.83Å
254	Y	93.3	Very high	93.1	Very high	142 Å²	142	44.3 Å²	44.3	56%	0.557	23%	0.225	S	C	*	.	H	α-helix	trans	-64.7	-40.1	171.8	-66.6	-57	0	0	0	111.9	S250 L251 R257 I301	S250-Y254 WeakPolarHBondContact O-CD2 3.44Å; S250-Y254 PolarHBondContact O-N 3Å; L251-Y254 PolarHBondContact O-N 2.92Å; Y254-R257 PolarHBondContact O-N 3.49Å; Y254-I301 HydrophobicContact CD2-CD1 4.46Å; Y254-I301 HydrophobicContact CG-CD1 4.32Å
255	C	94.6	Very high	94	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-37.8	176.7	-174.1	0	0	0	0	113.1	L251 Q252 N253 R257 D258 C261 R262 I301 M302	L251-C255 PolarHBondContact O-N 3.21Å; Q252-C255 WeakPolarHBondContact O-CB 3.35Å; Q252-C255 PolarHBondContact O-N 2.91Å; N253-C255 VanDerWaalsContact C-N 3.33Å; C255-R257 PolarHBondContact O-N 3.1Å; C255-D258 PolarHBondContact O-N 2.85Å; C255-D258 VanDerWaalsContact O-N 3.15Å; C255-C261 VanDerWaalsContact CA-SG 3.59Å; C255-C261 HydrophobicContact CB-CB 4.03Å; C255-C261 WeakPolarHBondContact CB-SG 3.4Å; C255-C261 WeakPolarHBondContact SG-CB 3.41Å; C255-C261 PolarHBondContact SG-O 3.46Å; C255-C261 VanDerWaalsContact SG-O 3.41Å; C255-C261 CovalentContact SG-SG 2.04Å; C255-C261 PolarHBondContact SG-SG 3.41Å; C255-R262 PolarHBondContact O-N 2.86Å; C255-I301 HydrophobicContact CB-CG2 3.96Å; C255-M302 HydrophobicContact CB-CG 3.74Å; C255-M302 HydrophobicContact CB-SD 3.45Å; C255-M302 WeakPolarHBondContact CB-SD 3.31Å; C255-M302 PolarHBondContact SG-SD 3.4Å
256	S	91.6	Very high	94.2	Very high	16 Å²	16	38.4 Å²	38.4	11%	0.112	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-19.8	-178.5	69.3	0	0	0	0	113.5	Q252 N253 R262	Q252-S256 PolarHBondContact O-N 3.28Å; N253-S256 PolarHBondContact O-N 3.12Å; N253-S256 PolarHBondContact O-OG 3.46Å; S256-R262 WeakPolarHBondContact O-CD 3.48Å
257	R	89.7	Confident	94.3	Very high	182 Å²	182	36.8 Å²	36.8	69%	0.687	17%	0.174	S	C	*	.	H	α-helix	trans	-87.1	-20.4	174.8	-62.9	175.4	-174.3	-144.5	-4.1	113.5	N253 Y254 C255	N253-R257 WeakPolarHBondContact O-CG 3.28Å; N253-R257 PolarHBondContact OD1-NE 2.83Å; Y254-R257 PolarHBondContact O-N 3.49Å; C255-R257 PolarHBondContact O-N 3.1Å
258	D	92.1	Very high	94.4	Very high	79 Å²	79	35.7 Å²	35.7	42%	0.422	17%	0.168	S	C	.	.	S	Bend	trans	-94.3	113	175.9	179.4	-96.1	0	0	0	109.4	C255 L260 C261 R262	C255-D258 PolarHBondContact O-N 2.85Å; C255-D258 VanDerWaalsContact O-N 3.15Å; D258-L260 VanDerWaalsContact C-N 3.26Å; D258-L260 PolarHBondContact O-N 3.26Å; D258-L260 PolarHBondContact OD1-N 3.16Å; D258-C261 HydrophobicContact CB-CB 3.92Å; D258-C261 PolarHBondContact O-N 3.43Å; D258-C261 WeakPolarHBondContact OD1-CB 3.45Å; D258-C261 PolarHBondContact OD1-N 3.34Å; D258-R262 VanDerWaalsContact O-CB 3.28Å; D258-R262 WeakPolarHBondContact O-CB 3.46Å; D258-R262 PolarHBondContact O-N 3.3Å
259	E	92.2	Very high	94.2	Very high	70 Å²	70	37.9 Å²	37.9	33%	0.327	18%	0.178	S	C	.	.	H	α-helix	trans	-57.7	-39	-173.4	-67	-176	149.4	0	0	112.5	K99 S263	K99-E259 WeakPolarHBondContact CA-OE1 3.19Å; K99-E259 WeakPolarHBondContact CA-OE2 3.32Å; K99-E259 WeakPolarHBondContact CB-OE2 3.47Å; E259-S263 VanDerWaalsContact O-CB 3.22Å; E259-S263 WeakPolarHBondContact O-CB 3.46Å; E259-S263 PolarHBondContact O-N 3.06Å; E259-S263 PolarHBondContact O-OG 2.97Å
260	L	95.1	Very high	94.1	Very high	18 Å²	18	38.7 Å²	38.7	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-51.8	177.2	-178.5	62.5	0	0	0	111	L98 D258 S263 R264	L98-L260 HydrophobicContact CD1-CD1 4.04Å; D258-L260 VanDerWaalsContact C-N 3.26Å; D258-L260 PolarHBondContact O-N 3.26Å; D258-L260 PolarHBondContact OD1-N 3.16Å; L260-S263 WeakPolarHBondContact O-CB 3.13Å; L260-S263 PolarHBondContact O-N 3.11Å; L260-R264 HydrophobicContact CD1-CG 4.21Å; L260-R264 HydrophobicContact CG-CG 4.44Å; L260-R264 VanDerWaalsContact O-CG 3.24Å; L260-R264 WeakPolarHBondContact O-CG 3.39Å; L260-R264 PolarHBondContact O-N 3.11Å
261	C	96.2	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-50.5	179.9	-170.8	0	0	0	0	111.3	C255 D258 S263 R264 F265 T300	C255-C261 VanDerWaalsContact CA-SG 3.59Å; C255-C261 HydrophobicContact CB-CB 4.03Å; C255-C261 WeakPolarHBondContact CB-SG 3.4Å; C255-C261 WeakPolarHBondContact SG-CB 3.41Å; C255-C261 PolarHBondContact SG-O 3.46Å; C255-C261 VanDerWaalsContact SG-O 3.41Å; C255-C261 CovalentContact SG-SG 2.04Å; C255-C261 PolarHBondContact SG-SG 3.41Å; D258-C261 HydrophobicContact CB-CB 3.92Å; D258-C261 PolarHBondContact O-N 3.43Å; D258-C261 WeakPolarHBondContact OD1-CB 3.45Å; D258-C261 PolarHBondContact OD1-N 3.34Å; C261-S263 PolarHBondContact O-N 3.3Å; C261-R264 PolarHBondContact O-N 3.03Å; C261-R264 VanDerWaalsContact O-N 3.13Å; C261-F265 WeakPolarHBondContact O-CB 3.19Å; C261-F265 PolarHBondContact O-N 3.43Å; C261-T300 HydrophobicContact CB-CG2 4.4Å
262	R	94.3	Very high	94	Very high	10 Å²	10	35.9 Å²	35.9	4%	0.038	16%	0.162	C	C	.	.	H	α-helix	trans	-51.6	-44.6	175.4	-176.1	-174.8	-179.4	173.9	-5.5	111.3	W102 A108 Y109 Y112 C255 S256 D258 F265 A266	W102-R262 HydrophobicContact CH2-CG 4.13Å; W102-R262 HydrophobicContact CZ2-CG 3.85Å; W102-R262 VanDerWaalsContact CZ3-NE 3.34Å; A108-R262 PolarHBondContact O-NH2 2.69Å; Y109-R262 VanDerWaalsContact CE1-NH1 3.33Å; Y112-R262 HydrophobicContact CE1-CG 4.21Å; C255-R262 PolarHBondContact O-N 2.86Å; S256-R262 WeakPolarHBondContact O-CD 3.48Å; D258-R262 VanDerWaalsContact O-CB 3.28Å; D258-R262 WeakPolarHBondContact O-CB 3.46Å; D258-R262 PolarHBondContact O-N 3.3Å; R262-F265 PolarHBondContact O-N 3.36Å; R262-A266 WeakPolarHBondContact O-CB 3.46Å; R262-A266 PolarHBondContact O-N 2.89Å
263	S	95.3	Very high	94	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.1	-45	179.3	-59	0	0	0	0	112.8	L98 W102 Y117 E259 L260 C261 F265 A266 D267	L98-S263 WeakPolarHBondContact CD2-OG 3.21Å; W102-S263 PolarHBondContact NE1-OG 3.13Å; Y117-S263 WeakPolarHBondContact OH-CB 3.49Å; E259-S263 VanDerWaalsContact O-CB 3.22Å; E259-S263 WeakPolarHBondContact O-CB 3.46Å; E259-S263 PolarHBondContact O-N 3.06Å; E259-S263 PolarHBondContact O-OG 2.97Å; L260-S263 WeakPolarHBondContact O-CB 3.13Å; L260-S263 PolarHBondContact O-N 3.11Å; C261-S263 PolarHBondContact O-N 3.3Å; S263-F265 VanDerWaalsContact C-N 3.32Å; S263-A266 PolarHBondContact O-N 2.84Å; S263-D267 WeakPolarHBondContact O-CB 3.36Å; S263-D267 PolarHBondContact O-N 3.32Å
264	R	96.5	Very high	94	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-35.5	177.9	-65.4	-66.3	-164.1	-130.3	-5.2	111.4	E94 Y117 E199 L260 C261 D267 F268 G296 L297 T300	E94-R264 VanDerWaalsContact CD-NH2 3.32Å; E94-R264 IonicContact OE1-CZ 3.49Å; E94-R264 IonicContact OE1-NH1 2.66Å; E94-R264 PolarHBondContact OE1-NH1 2.99Å; E94-R264 IonicContact OE1-NH2 2.69Å; E94-R264 PolarHBondContact OE1-NH2 3.28Å; E94-R264 IonicContact OE2-NH2 2.79Å; E94-R264 PolarHBondContact OE2-NH2 3.45Å; E94-R264 VanDerWaalsContact OE2-NH2 3.13Å; Y117-R264 PolarHBondContact OH-NH1 3.34Å; E199-R264 IonicContact OE1-CZ 2.7Å; E199-R264 IonicContact OE1-NH2 3.08Å; E199-R264 PolarHBondContact OE1-NH2 2.97Å; L260-R264 HydrophobicContact CD1-CG 4.21Å; L260-R264 HydrophobicContact CG-CG 4.44Å; L260-R264 VanDerWaalsContact O-CG 3.24Å; L260-R264 WeakPolarHBondContact O-CG 3.39Å; L260-R264 PolarHBondContact O-N 3.11Å; C261-R264 PolarHBondContact O-N 3.03Å; C261-R264 VanDerWaalsContact O-N 3.13Å; R264-D267 PolarHBondContact O-N 3.3Å; R264-F268 WeakPolarHBondContact O-CB 3.43Å; R264-F268 PolarHBondContact O-N 3.47Å; R264-G296 WeakPolarHBondContact CD-O 3.29Å; R264-G296 WeakPolarHBondContact CG-O 3.45Å; R264-G296 PolarHBondContact NE-O 2.89Å; R264-L297 HydrophobicContact CB-CD2 4.02Å; R264-T300 HydrophobicContact CB-CG2 4.42Å; R264-T300 HydrophobicContact CG-CG2 4.24Å
265	F	95.9	Very high	94	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-72.2	-41.9	176.7	-170.8	-117.8	0	0	0	112.5	Y112 Q252 C261 R262 S263 D267 F268 Q269 L297 M302 L336 F337	Y112-F265 HydrophobicContact CD1-CD1 4.1Å; Y112-F265 AromaticContact CE1-CD1 3.69Å; Y112-F265 HydrophobicContact CE1-CD1 3.69Å; Y112-F265 HydrophobicContact CE1-CE1 4.37Å; Y112-F265 HydrophobicContact CE2-CD1 4.39Å; Y112-F265 HydrophobicContact CE2-CE1 4.28Å; Y112-F265 AromaticContact CZ-CD1 3.86Å; Q252-F265 HydrophobicContact CG-CE1 4.32Å; C261-F265 WeakPolarHBondContact O-CB 3.19Å; C261-F265 PolarHBondContact O-N 3.43Å; R262-F265 PolarHBondContact O-N 3.36Å; S263-F265 VanDerWaalsContact C-N 3.32Å; F265-D267 VanDerWaalsContact C-N 3.3Å; F265-D267 PolarHBondContact O-N 2.98Å; F265-F268 HydrophobicContact CD2-CD1 4.32Å; F265-F268 HydrophobicContact CE2-CD1 4.27Å; F265-F268 PolarHBondContact O-N 2.88Å; F265-Q269 VanDerWaalsContact CD1-OE1 3.29Å; F265-Q269 VanDerWaalsContact CE1-CD 3.49Å; F265-Q269 HydrophobicContact CE1-CG 4.26Å; F265-Q269 HydrophobicContact CE2-CG 4.3Å; F265-Q269 HydrophobicContact CZ-CG 4.1Å; F265-Q269 WeakPolarHBondContact O-CG 3.45Å; F265-Q269 PolarHBondContact O-N 3.12Å; F265-L297 HydrophobicContact CB-CD2 4.1Å; F265-L297 HydrophobicContact CD2-CD2 4.27Å; F265-M302 HydrophobicContact CD1-SD 4.39Å; F265-M302 HydrophobicContact CD2-CE 3.76Å; F265-M302 HydrophobicContact CD2-SD 3.95Å; F265-M302 HydrophobicContact CE1-CE 4.46Å; F265-M302 HydrophobicContact CE2-CE 3.51Å; F265-M302 HydrophobicContact CE2-SD 4.26Å; F265-M302 HydrophobicContact CG-CE 4.35Å; F265-M302 HydrophobicContact CG-SD 4.03Å; F265-M302 HydrophobicContact CZ-CE 3.89Å; F265-L336 HydrophobicContact CE2-CD1 4.08Å; F265-L336 HydrophobicContact CZ-CD1 3.7Å; F265-F337 HydrophobicContact CE2-CE2 4.19Å; F265-F337 HydrophobicContact CE2-CZ 4.1Å
266	A	94.6	Very high	93.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56.9	-44.9	170.1	0	0	0	0	0	111.7	Y112 R262 S263 F268 Q269 H270	Y112-A266 HydrophobicContact CD1-CB 3.9Å; R262-A266 WeakPolarHBondContact O-CB 3.46Å; R262-A266 PolarHBondContact O-N 2.89Å; S263-A266 PolarHBondContact O-N 2.84Å; A266-F268 VanDerWaalsContact C-N 3.34Å; A266-F268 PolarHBondContact O-N 3.45Å; A266-Q269 PolarHBondContact O-N 3.34Å; A266-H270 VanDerWaalsContact O-CB 3.25Å; A266-H270 WeakPolarHBondContact O-CB 3.42Å; A266-H270 PolarHBondContact O-N 3.34Å
267	D	95	Very high	93.7	Very high	14 Å²	14	46.6 Å²	46.6	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-39.9	178	-165.7	53.9	0	0	0	112.7	S115 Y117 S263 R264 F265 N271 A293	S115-D267 WeakPolarHBondContact CB-OD1 3.26Å; S115-D267 WeakPolarHBondContact OG-CB 3.05Å; S115-D267 PolarHBondContact OG-OD1 3.21Å; Y117-D267 HydrophobicContact CD2-CB 3.9Å; Y117-D267 HydrophobicContact CE2-CB 4.3Å; S263-D267 WeakPolarHBondContact O-CB 3.36Å; S263-D267 PolarHBondContact O-N 3.32Å; R264-D267 PolarHBondContact O-N 3.3Å; F265-D267 VanDerWaalsContact C-N 3.3Å; F265-D267 PolarHBondContact O-N 2.98Å; D267-N271 WeakPolarHBondContact O-CB 3.45Å; D267-N271 PolarHBondContact O-N 3.47Å; D267-N271 PolarHBondContact O-ND2 2.94Å; D267-N271 PolarHBondContact OD1-ND2 3.38Å; D267-A293 WeakPolarHBondContact OD2-CB 3.43Å
268	F	95.9	Very high	93.7	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-49.6	174.6	172.7	-106.8	0	0	0	112	R264 F265 A266 H270 N271 C272 A293 Y294 L297 L336 F337 L343	R264-F268 WeakPolarHBondContact O-CB 3.43Å; R264-F268 PolarHBondContact O-N 3.47Å; F265-F268 HydrophobicContact CD2-CD1 4.32Å; F265-F268 HydrophobicContact CE2-CD1 4.27Å; F265-F268 PolarHBondContact O-N 2.88Å; A266-F268 VanDerWaalsContact C-N 3.34Å; A266-F268 PolarHBondContact O-N 3.45Å; F268-H270 VanDerWaalsContact C-N 3.27Å; F268-H270 PolarHBondContact O-N 3.16Å; F268-N271 PolarHBondContact O-N 3.01Å; F268-C272 HydrophobicContact CD2-CB 3.99Å; F268-C272 WeakPolarHBondContact CD2-SG 3.38Å; F268-C272 HydrophobicContact CE2-CB 3.76Å; F268-C272 WeakPolarHBondContact CE2-SG 3.49Å; F268-C272 HydrophobicContact CZ-CB 4.27Å; F268-C272 VanDerWaalsContact O-CB 3.23Å; F268-C272 WeakPolarHBondContact O-CB 3.41Å; F268-C272 PolarHBondContact O-N 3.49Å; F268-A293 HydrophobicContact CB-CB 4.44Å; F268-Y294 HydrophobicContact CE2-CD2 4.11Å; F268-L297 HydrophobicContact CB-CD1 3.82Å; F268-L297 HydrophobicContact CB-CG 4.27Å; F268-L297 HydrophobicContact CD1-CD1 3.93Å; F268-L297 HydrophobicContact CD2-CD1 4.03Å; F268-L297 HydrophobicContact CG-CD1 3.65Å; F268-L336 HydrophobicContact CE1-CB 4.04Å; F268-L336 WeakPolarHBondContact CZ-O 3.32Å; F268-F337 HydrophobicContact CD1-CE1 4.07Å; F268-F337 AromaticContact CD1-CZ 3.92Å; F268-F337 HydrophobicContact CD1-CZ 3.92Å; F268-F337 AromaticContact CE1-CD1 4Å; F268-F337 HydrophobicContact CE1-CD1 4Å; F268-F337 AromaticContact CE1-CE1 3.44Å; F268-F337 HydrophobicContact CE1-CE1 3.44Å; F268-F337 VanDerWaalsContact CE1-CE1 3.44Å; F268-F337 HydrophobicContact CE1-CE2 4.06Å; F268-F337 AromaticContact CE1-CZ 3.47Å; F268-F337 HydrophobicContact CE1-CZ 3.47Å; F268-F337 VanDerWaalsContact CE1-CZ 3.47Å; F268-F337 HydrophobicContact CE2-CE1 4.18Å; F268-F337 AromaticContact CZ-CD1 3.74Å; F268-F337 HydrophobicContact CZ-CD1 3.74Å; F268-F337 AromaticContact CZ-CE1 3.51Å; F268-F337 HydrophobicContact CZ-CE1 3.51Å; F268-F337 HydrophobicContact CZ-CG 4.43Å; F268-F337 HydrophobicContact CZ-CZ 4.05Å; F268-L343 HydrophobicContact CE2-CD2 4.16Å; F268-L343 HydrophobicContact CZ-CD2 4.12Å
269	Q	94.5	Very high	93.5	Very high	47 Å²	47	39.3 Å²	39.3	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-60.6	-40	178.3	-71.3	179	-77.6	0	0	111.6	Y112 F265 A266 Q273 L336	Y112-Q269 VanDerWaalsContact CD2-OE1 3.27Å; F265-Q269 VanDerWaalsContact CD1-OE1 3.29Å; F265-Q269 VanDerWaalsContact CE1-CD 3.49Å; F265-Q269 HydrophobicContact CE1-CG 4.26Å; F265-Q269 HydrophobicContact CE2-CG 4.3Å; F265-Q269 HydrophobicContact CZ-CG 4.1Å; F265-Q269 WeakPolarHBondContact O-CG 3.45Å; F265-Q269 PolarHBondContact O-N 3.12Å; A266-Q269 PolarHBondContact O-N 3.34Å; Q269-Q273 PolarHBondContact O-N 3.32Å; Q269-L336 HydrophobicContact CG-CD1 4.16Å
270	H	92.5	Very high	93.2	Very high	48 Å²	48	36.3 Å²	36.3	22%	0.222	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-47.9	178.8	-175.9	78	0	0	0	113	A266 F268 R284	A266-H270 VanDerWaalsContact O-CB 3.25Å; A266-H270 WeakPolarHBondContact O-CB 3.42Å; A266-H270 PolarHBondContact O-N 3.34Å; F268-H270 VanDerWaalsContact C-N 3.27Å; F268-H270 PolarHBondContact O-N 3.16Å; H270-R284 PolarHBondContact CD2-NH1 3.33Å; H270-R284 PolarHBondContact NE2-NH1 2.99Å; H270-R284 VanDerWaalsContact NE2-NH1 3.16Å
271	N	92.9	Very high	93.1	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-88.8	-22.5	-173.5	-67.8	-63.7	0	0	0	114.4	D267 F268 R284 M289 A293	D267-N271 WeakPolarHBondContact O-CB 3.45Å; D267-N271 PolarHBondContact O-N 3.47Å; D267-N271 PolarHBondContact O-ND2 2.94Å; D267-N271 PolarHBondContact OD1-ND2 3.38Å; F268-N271 PolarHBondContact O-N 3.01Å; N271-R284 PolarHBondContact OD1-NH1 3.15Å; N271-M289 HydrophobicContact CB-CB 4.21Å; N271-A293 HydrophobicContact CB-CB 3.9Å
272	C	95.3	Very high	92.9	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.014	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	16.6	176.9	-65.2	0	0	0	0	113.2	F268 Q274 C290 N340	F268-C272 HydrophobicContact CD2-CB 3.99Å; F268-C272 WeakPolarHBondContact CD2-SG 3.38Å; F268-C272 HydrophobicContact CE2-CB 3.76Å; F268-C272 WeakPolarHBondContact CE2-SG 3.49Å; F268-C272 HydrophobicContact CZ-CB 4.27Å; F268-C272 VanDerWaalsContact O-CB 3.23Å; F268-C272 WeakPolarHBondContact O-CB 3.41Å; F268-C272 PolarHBondContact O-N 3.49Å; C272-Q274 PolarHBondContact O-N 3.06Å; C272-C290 VanDerWaalsContact CA-SG 3.59Å; C272-C290 HydrophobicContact CB-CB 4.06Å; C272-C290 WeakPolarHBondContact CB-SG 3.36Å; C272-C290 VanDerWaalsContact SG-C 3.55Å; C272-C290 WeakPolarHBondContact SG-CA 3.44Å; C272-C290 WeakPolarHBondContact SG-CB 3.05Å; C272-C290 PolarHBondContact SG-O 3.34Å; C272-C290 CovalentContact SG-SG 2.05Å; C272-C290 PolarHBondContact SG-SG 3.31Å; C272-N340 PolarHBondContact O-ND2 2.98Å; C272-N340 PolarHBondContact O-OD1 3.17Å
273	Q	94	Very high	92.8	Very high	97 Å²	97	40.4 Å²	40.4	45%	0.453	23%	0.229	S	C	.	.			trans	-59.7	121.1	172.8	-170.5	172.8	8.9	0	0	110	Q269 M283	Q269-Q273 PolarHBondContact O-N 3.32Å; Q273-M283 HydrophobicContact CB-CB 4.19Å; Q273-M283 HydrophobicContact CG-CB 4.25Å; Q273-M283 HydrophobicContact CG-SD 4Å; Q273-M283 PolarHBondContact NE2-SD 2.78Å; Q273-M283 PolarHBondContact O-N 2.85Å; Q273-M283 PolarHBondContact OE1-SD 2.94Å
274	Q	93.7	Very high	92.4	Very high	101 Å²	101	44.1 Å²	44.1	47%	0.472	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-78.6	144.8	-177.7	61.5	-177	-19.3	0	0	112.3	C272 G281 L341 C342	C272-Q274 PolarHBondContact O-N 3.06Å; Q274-G281 WeakPolarHBondContact CA-O 3.06Å; Q274-L341 HydrophobicContact CB-CB 4.36Å; Q274-C342 HydrophobicContact CB-CB 4.3Å
275	S	92.2	Very high	91.9	Very high	30 Å²	30	50.5 Å²	50.5	21%	0.21	27%	0.273	C	S	.	.			trans	-140	120.8	171.6	175.8	0	0	0	0	109.3	L277 S278 G281	S275-L277 PolarHBondContact O-N 3.3Å; S275-L277 PolarHBondContact OG-N 2.93Å; S275-S278 PolarHBondContact O-N 2.92Å; S275-G281 PolarHBondContact N-O 3.16Å; S275-G281 CarbonylContact O-C 3.44Å
276	S	89.6	Confident	91.5	Very high	110 Å²	110	51.1 Å²	51.1	77%	0.769	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.4	175.8	54.5	0	0	0	0	113.1
277	L	90.8	Very high	91.3	Very high	164 Å²	164	55.2 Å²	55.2	86%	0.859	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.1	-179.2	-57.8	178.2	0	0	0	112.8	S275	S275-L277 PolarHBondContact O-N 3.3Å; S275-L277 PolarHBondContact OG-N 2.93Å
278	S	90.1	Very high	91	Very high	15 Å²	15	54.9 Å²	54.9	11%	0.105	29%	0.292	C	S	.	.	S	Bend	trans	-87	137.9	178.1	-179.3	0	0	0	0	111.3	S275 S280 G281 C282 E285	S275-S278 PolarHBondContact O-N 2.92Å; S278-S280 PolarHBondContact O-N 3.23Å; S278-S280 PolarHBondContact OG-N 3.4Å; S278-S280 PolarHBondContact OG-OG 2.05Å; S278-G281 PolarHBondContact O-N 3.36Å; S278-C282 WeakPolarHBondContact CB-O 3.43Å; S278-C282 PolarHBondContact OG-O 3.15Å; S278-E285 PolarHBondContact OG-OE1 3.03Å
279	A	87	Confident	90.8	Very high	93 Å²	93	55.5 Å²	55.5	77%	0.769	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.4	172.6	0	0	0	0	0	113	G281 R287	A279-G281 VanDerWaalsContact C-N 3.3Å; A279-R287 PolarHBondContact O-NH2 3.16Å
280	S	85.8	Confident	90.8	Very high	8 Å²	8	53.3 Å²	53.3	6%	0.056	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.1	175.8	71.5	0	0	0	0	112.9	S278 C282 E285 R287 N345	S278-S280 PolarHBondContact O-N 3.23Å; S278-S280 PolarHBondContact OG-N 3.4Å; S278-S280 PolarHBondContact OG-OG 2.05Å; S280-C282 WeakPolarHBondContact OG-CA 3.42Å; S280-C282 WeakPolarHBondContact OG-CB 3.23Å; S280-C282 PolarHBondContact OG-N 2.87Å; S280-C282 PolarHBondContact OG-O 3.42Å; S280-C282 VanDerWaalsContact OG-O 3.07Å; S280-E285 WeakPolarHBondContact OG-CA 3.37Å; S280-R287 PolarHBondContact O-NE 3.35Å; S280-R287 VanDerWaalsContact O-NE 3.16Å; S280-N345 WeakPolarHBondContact O-CB 3.35Å; S280-N345 PolarHBondContact O-ND2 2.89Å
281	G	92.2	Very high	90.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.01	27%	0.274	C	S	.	.	S	Bend	trans	82.3	-7.3	-162.7	0	0	0	0	0	113.9	Q274 S275 S278 A279 C342	Q274-G281 WeakPolarHBondContact CA-O 3.06Å; S275-G281 PolarHBondContact N-O 3.16Å; S275-G281 CarbonylContact O-C 3.44Å; S278-G281 PolarHBondContact O-N 3.36Å; A279-G281 VanDerWaalsContact C-N 3.3Å; G281-C342 WeakPolarHBondContact O-CA 3.4Å; G281-C342 WeakPolarHBondContact O-CB 3.13Å; G281-C342 PolarHBondContact O-N 3.37Å
282	C	93.1	Very high	91	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-108.1	140.9	-176.6	-53.9	0	0	0	0	111.1	S278 S280 R284 E285 C342	S278-C282 WeakPolarHBondContact CB-O 3.43Å; S278-C282 PolarHBondContact OG-O 3.15Å; S280-C282 WeakPolarHBondContact OG-CA 3.42Å; S280-C282 WeakPolarHBondContact OG-CB 3.23Å; S280-C282 PolarHBondContact OG-N 2.87Å; S280-C282 PolarHBondContact OG-O 3.42Å; S280-C282 VanDerWaalsContact OG-O 3.07Å; C282-R284 VanDerWaalsContact C-N 3.29Å; C282-R284 PolarHBondContact O-N 3.2Å; C282-E285 PolarHBondContact O-N 3.16Å; C282-E285 VanDerWaalsContact O-N 3.17Å; C282-C342 VanDerWaalsContact CA-SG 3.59Å; C282-C342 HydrophobicContact CB-CB 3.84Å; C282-C342 WeakPolarHBondContact CB-SG 3.47Å; C282-C342 VanDerWaalsContact SG-CA 3.53Å; C282-C342 WeakPolarHBondContact SG-CB 3.27Å; C282-C342 CovalentContact SG-SG 2.03Å; C282-C342 PolarHBondContact SG-SG 3.32Å
283	M	91.9	Very high	91	Very high	112 Å²	112	51.6 Å²	51.6	55%	0.552	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.4	179	-173.8	166.6	178.9	0	0	112.9	Q273 E285	Q273-M283 HydrophobicContact CB-CB 4.19Å; Q273-M283 HydrophobicContact CG-CB 4.25Å; Q273-M283 HydrophobicContact CG-SD 4Å; Q273-M283 PolarHBondContact NE2-SD 2.78Å; Q273-M283 PolarHBondContact O-N 2.85Å; Q273-M283 PolarHBondContact OE1-SD 2.94Å; M283-E285 VanDerWaalsContact C-N 3.31Å
284	R	86.6	Confident	91.1	Very high	79 Å²	79	47.2 Å²	47.2	30%	0.298	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	6.6	178.4	-56.9	-165.4	67.7	-179.9	11.5	114.4	E119 H270 N271 C282 S286	E119-R284 IonicContact OE1-CZ 3.16Å; E119-R284 IonicContact OE1-NH1 3.37Å; E119-R284 IonicContact OE1-NH2 3.93Å; E119-R284 PolarHBondContact OE1-NH2 2.97Å; E119-R284 IonicContact OE2-NH2 3.68Å; E119-R284 PolarHBondContact OE2-NH2 2.9Å; H270-R284 PolarHBondContact CD2-NH1 3.33Å; H270-R284 PolarHBondContact NE2-NH1 2.99Å; H270-R284 VanDerWaalsContact NE2-NH1 3.16Å; N271-R284 PolarHBondContact OD1-NH1 3.15Å; C282-R284 VanDerWaalsContact C-N 3.29Å; C282-R284 PolarHBondContact O-N 3.2Å; R284-S286 PolarHBondContact O-N 3.23Å
285	E	86.4	Confident	91.3	Very high	135 Å²	135	42.5 Å²	42.5	63%	0.631	23%	0.234	S	C	*	.	S	Bend	trans	58.5	7.7	-179.3	-49.7	-145.5	124.3	0	0	117.1	S278 S280 C282 M283	S278-E285 PolarHBondContact OG-OE1 3.03Å; S280-E285 WeakPolarHBondContact OG-CA 3.37Å; C282-E285 PolarHBondContact O-N 3.16Å; C282-E285 VanDerWaalsContact O-N 3.17Å; M283-E285 VanDerWaalsContact C-N 3.31Å
286	S	87.9	Confident	91.5	Very high	12 Å²	12	41.2 Å²	41.2	8%	0.084	23%	0.225	C	C	.	.			trans	-118.3	113.5	178.9	-174.6	0	0	0	0	112.6	R284 M289	R284-S286 PolarHBondContact O-N 3.23Å; S286-M289 WeakPolarHBondContact OG-CG 3.49Å; S286-M289 PolarHBondContact OG-N 3.47Å
287	R	90.7	Very high	91.9	Very high	87 Å²	87	36 Å²	36	33%	0.328	19%	0.189	S	C	.	.	H	α-helix	trans	-69.7	-35.7	173.4	-67.4	-176.7	-164.4	109.4	-9.1	111.9	A279 S280 M289 C290 L291 A346	A279-R287 PolarHBondContact O-NH2 3.16Å; S280-R287 PolarHBondContact O-NE 3.35Å; S280-R287 VanDerWaalsContact O-NE 3.16Å; R287-M289 VanDerWaalsContact C-N 3.34Å; R287-M289 PolarHBondContact O-N 2.9Å; R287-C290 PolarHBondContact O-N 3.03Å; R287-L291 PolarHBondContact O-N 3.11Å; R287-A346 HydrophobicContact CB-CB 3.78Å; R287-A346 HydrophobicContact CG-CB 4.14Å
288	A	89	Confident	92.3	Very high	6 Å²	6	28.3 Å²	28.3	5%	0.05	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-41.8	178.7	0	0	0	0	0	112	V125 I128 E129 C290 L291 K292	V125-A288 HydrophobicContact CG1-CB 4.35Å; I128-A288 HydrophobicContact CB-CB 4.06Å; I128-A288 HydrophobicContact CG2-CB 3.6Å; E129-A288 HydrophobicContact CG-CB 4.08Å; A288-C290 VanDerWaalsContact C-N 3.33Å; A288-C290 PolarHBondContact O-N 3.35Å; A288-L291 PolarHBondContact O-N 3.45Å; A288-K292 WeakPolarHBondContact O-CB 3.49Å; A288-K292 PolarHBondContact O-N 3.37Å
289	M	90.9	Very high	92.6	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.074	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-44.8	174.5	-64.9	-65.6	-70	0	0	111.5	L120 V125 N271 S286 R287 K292 A293	L120-M289 HydrophobicContact CB-CE 4.12Å; L120-M289 HydrophobicContact CB-SD 3.6Å; L120-M289 HydrophobicContact CD1-CE 3.69Å; L120-M289 HydrophobicContact CD1-SD 3.27Å; L120-M289 WeakPolarHBondContact CD1-SD 3.48Å; L120-M289 HydrophobicContact CG-CE 4.29Å; L120-M289 HydrophobicContact CG-SD 3.98Å; V125-M289 HydrophobicContact CG2-CG 4.44Å; V125-M289 HydrophobicContact CG2-SD 3.68Å; N271-M289 HydrophobicContact CB-CB 4.21Å; S286-M289 WeakPolarHBondContact OG-CG 3.49Å; S286-M289 PolarHBondContact OG-N 3.47Å; R287-M289 VanDerWaalsContact C-N 3.34Å; R287-M289 PolarHBondContact O-N 2.9Å; M289-K292 PolarHBondContact O-N 3.27Å; M289-A293 WeakPolarHBondContact O-CB 3.25Å; M289-A293 PolarHBondContact O-N 3.49Å
290	C	94.8	Very high	93.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.5	-45.6	177.3	176	0	0	0	0	112.3	C272 R287 A288 K292 A293 Y294 C342 A346	C272-C290 VanDerWaalsContact CA-SG 3.59Å; C272-C290 HydrophobicContact CB-CB 4.06Å; C272-C290 WeakPolarHBondContact CB-SG 3.36Å; C272-C290 VanDerWaalsContact SG-C 3.55Å; C272-C290 WeakPolarHBondContact SG-CA 3.44Å; C272-C290 WeakPolarHBondContact SG-CB 3.05Å; C272-C290 PolarHBondContact SG-O 3.34Å; C272-C290 CovalentContact SG-SG 2.05Å; C272-C290 PolarHBondContact SG-SG 3.31Å; R287-C290 PolarHBondContact O-N 3.03Å; A288-C290 VanDerWaalsContact C-N 3.33Å; A288-C290 PolarHBondContact O-N 3.35Å; C290-K292 VanDerWaalsContact C-N 3.33Å; C290-K292 PolarHBondContact O-N 3.03Å; C290-A293 PolarHBondContact O-N 3.44Å; C290-Y294 WeakPolarHBondContact O-CB 3.29Å; C290-Y294 PolarHBondContact O-N 3.39Å; C290-C342 VanDerWaalsContact SG-SG 3.68Å; C290-A346 HydrophobicContact CB-CB 4.43Å
291	L	94.6	Very high	93.6	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-60.7	-43.1	175.4	-67.7	179.5	0	0	0	111.7	F207 F211 R287 A288 A293 Y294 T295 A346 I347 M350	F207-L291 HydrophobicContact CD2-CB 4.39Å; F207-L291 HydrophobicContact CD2-CD1 4.38Å; F207-L291 HydrophobicContact CE2-CB 3.87Å; F207-L291 HydrophobicContact CZ-CB 4.21Å; F211-L291 HydrophobicContact CD1-CD2 4.25Å; F211-L291 HydrophobicContact CD2-CD1 4.3Å; F211-L291 HydrophobicContact CD2-CD2 4.23Å; F211-L291 HydrophobicContact CE1-CD2 4.02Å; F211-L291 HydrophobicContact CE2-CB 4.15Å; F211-L291 HydrophobicContact CE2-CD1 4.46Å; F211-L291 HydrophobicContact CE2-CD2 4.01Å; F211-L291 HydrophobicContact CE2-CG 4.42Å; F211-L291 HydrophobicContact CG-CD2 4.35Å; F211-L291 HydrophobicContact CZ-CB 4.45Å; F211-L291 HydrophobicContact CZ-CD2 3.89Å; R287-L291 PolarHBondContact O-N 3.11Å; A288-L291 PolarHBondContact O-N 3.45Å; L291-A293 PolarHBondContact O-N 3.12Å; L291-Y294 PolarHBondContact O-N 3.09Å; L291-T295 WeakPolarHBondContact O-CG2 3.45Å; L291-T295 PolarHBondContact O-N 3.3Å; L291-T295 PolarHBondContact O-OG1 3.2Å; L291-A346 HydrophobicContact CD2-CB 3.89Å; L291-A346 HydrophobicContact CG-CB 3.92Å; L291-I347 HydrophobicContact CD2-CG1 3.88Å; L291-M350 HydrophobicContact CD1-CG 3.71Å; L291-M350 HydrophobicContact CD1-SD 3.69Å
292	K	93.7	Very high	93.8	Very high	15 Å²	15	26.6 Å²	26.6	7%	0.065	12%	0.124	C	C	.	.	H	α-helix	trans	-61.6	-46.1	177.1	-170	58.9	177.2	-170.7	0	110.5	R89 L120 E203 F207 A288 M289 C290 T295 G296	R89-K292 PolarHBondContact NH1-O 3.2Å; L120-K292 HydrophobicContact CD1-CB 4.08Å; L120-K292 HydrophobicContact CD1-CG 3.77Å; L120-K292 HydrophobicContact CD2-CG 4.4Å; E203-K292 HydrophobicContact CG-CD 4.44Å; E203-K292 WeakPolarHBondContact OE1-CE 3.24Å; E203-K292 IonicContact OE1-NZ 3.4Å; E203-K292 PolarHBondContact OE1-NZ 3.37Å; F207-K292 HydrophobicContact CE1-CD 4.44Å; F207-K292 HydrophobicContact CZ-CB 4.09Å; F207-K292 HydrophobicContact CZ-CD 4.01Å; A288-K292 WeakPolarHBondContact O-CB 3.49Å; A288-K292 PolarHBondContact O-N 3.37Å; M289-K292 PolarHBondContact O-N 3.27Å; C290-K292 VanDerWaalsContact C-N 3.33Å; C290-K292 PolarHBondContact O-N 3.03Å; K292-T295 PolarHBondContact O-N 3.49Å; K292-T295 PolarHBondContact O-OG1 2.72Å; K292-G296 PolarHBondContact O-N 2.87Å; K292-G296 VanDerWaalsContact O-N 3.15Å
293	A	95.4	Very high	94	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-43.6	177	0	0	0	0	0	112.4	D267 F268 N271 M289 C290 L291 T295 G296	D267-A293 WeakPolarHBondContact OD2-CB 3.43Å; F268-A293 HydrophobicContact CB-CB 4.44Å; N271-A293 HydrophobicContact CB-CB 3.9Å; M289-A293 WeakPolarHBondContact O-CB 3.25Å; M289-A293 PolarHBondContact O-N 3.49Å; C290-A293 PolarHBondContact O-N 3.44Å; L291-A293 PolarHBondContact O-N 3.12Å; A293-T295 PolarHBondContact O-N 3.21Å; A293-G296 WeakPolarHBondContact O-CA 3.42Å; A293-G296 PolarHBondContact O-N 3.29Å
294	Y	97.8	Very high	94.3	Very high	5 Å²	5	21.5 Å²	21.5	2%	0.02	10%	0.099	C	C	.	.	H	α-helix	trans	-56.5	-48.1	173.9	174.3	-85.4	0	0	0	112.2	F211 F268 C290 L291 G296 L297 I298 P304 V314 F337 L343	F211-Y294 AromaticContact CE1-CD1 3.77Å; F211-Y294 HydrophobicContact CE1-CD1 3.77Å; F211-Y294 AromaticContact CE1-CE1 3.7Å; F211-Y294 HydrophobicContact CE1-CE1 3.7Å; F211-Y294 AromaticContact CZ-CD1 3.69Å; F211-Y294 HydrophobicContact CZ-CD1 3.69Å; F211-Y294 HydrophobicContact CZ-CE1 4.02Å; F268-Y294 HydrophobicContact CE2-CD2 4.11Å; C290-Y294 WeakPolarHBondContact O-CB 3.29Å; C290-Y294 PolarHBondContact O-N 3.39Å; L291-Y294 PolarHBondContact O-N 3.09Å; Y294-G296 PolarHBondContact O-N 3.46Å; Y294-L297 WeakPolarHBondContact O-CB 3.43Å; Y294-L297 PolarHBondContact O-N 3.47Å; Y294-L297 VanDerWaalsContact O-N 3.1Å; Y294-I298 HydrophobicContact CE1-CD1 4.41Å; Y294-P304 HydrophobicContact CD2-CB 4.49Å; Y294-P304 HydrophobicContact CD2-CG 3.98Å; Y294-P304 HydrophobicContact CE1-CG 4.07Å; Y294-P304 HydrophobicContact CE2-CB 3.59Å; Y294-P304 HydrophobicContact CE2-CG 3.39Å; Y294-P304 VanDerWaalsContact CZ-CG 3.45Å; Y294-V314 HydrophobicContact CE2-CB 4.25Å; Y294-V314 HydrophobicContact CE2-CG1 4.48Å; Y294-V314 HydrophobicContact CE2-CG2 3.89Å; Y294-V314 WeakPolarHBondContact OH-CG1 3.44Å; Y294-F337 HydrophobicContact CE2-CD1 4.46Å; Y294-L343 HydrophobicContact CD2-CD1 3.79Å; Y294-L343 HydrophobicContact CD2-CD2 3.98Å; Y294-L343 HydrophobicContact CE2-CD1 4.48Å; Y294-L343 HydrophobicContact CE2-CD2 4.23Å; Y294-L343 HydrophobicContact CG-CD1 4.09Å
295	T	97.1	Very high	94.9	Very high	2 Å²	2	18 Å²	18	1%	0.012	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-23.2	176.6	60.1	0	0	0	0	112.9	F207 L210 F211 L291 K292 A293 L297 I298	F207-T295 HydrophobicContact CD1-CG2 4.07Å; F207-T295 HydrophobicContact CE1-CG2 3.63Å; F207-T295 HydrophobicContact CZ-CG2 4.44Å; L210-T295 HydrophobicContact CD1-CG2 3.58Å; F211-T295 HydrophobicContact CE2-CG2 3.69Å; F211-T295 HydrophobicContact CZ-CG2 3.57Å; L291-T295 WeakPolarHBondContact O-CG2 3.45Å; L291-T295 PolarHBondContact O-N 3.3Å; L291-T295 PolarHBondContact O-OG1 3.2Å; K292-T295 PolarHBondContact O-N 3.49Å; K292-T295 PolarHBondContact O-OG1 2.72Å; A293-T295 PolarHBondContact O-N 3.21Å; T295-L297 PolarHBondContact O-N 3.08Å; T295-I298 PolarHBondContact O-N 3.24Å
296	G	96.9	Very high	95.4	Very high	3 Å²	3	11.9 Å²	11.9	3%	0.031	6%	0.058	C	C	.	.	H	α-helix	trans	-67.5	-22.4	175.4	0	0	0	0	0	114.4	R264 K292 A293 Y294	R264-G296 WeakPolarHBondContact CD-O 3.29Å; R264-G296 WeakPolarHBondContact CG-O 3.45Å; R264-G296 PolarHBondContact NE-O 2.89Å; K292-G296 PolarHBondContact O-N 2.87Å; K292-G296 VanDerWaalsContact O-N 3.15Å; A293-G296 WeakPolarHBondContact O-CA 3.42Å; A293-G296 PolarHBondContact O-N 3.29Å; Y294-G296 PolarHBondContact O-N 3.46Å
297	L	98.2	Very high	95.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-77.1	-23.6	175.7	-70.2	172	0	0	0	113	R264 F265 F268 Y294 T295 G299 T300 M302 T303 P304 F337	R264-L297 HydrophobicContact CB-CD2 4.02Å; F265-L297 HydrophobicContact CB-CD2 4.1Å; F265-L297 HydrophobicContact CD2-CD2 4.27Å; F268-L297 HydrophobicContact CB-CD1 3.82Å; F268-L297 HydrophobicContact CB-CG 4.27Å; F268-L297 HydrophobicContact CD1-CD1 3.93Å; F268-L297 HydrophobicContact CD2-CD1 4.03Å; F268-L297 HydrophobicContact CG-CD1 3.65Å; Y294-L297 WeakPolarHBondContact O-CB 3.43Å; Y294-L297 PolarHBondContact O-N 3.47Å; Y294-L297 VanDerWaalsContact O-N 3.1Å; T295-L297 PolarHBondContact O-N 3.08Å; L297-G299 PolarHBondContact O-N 2.76Å; L297-T300 WeakPolarHBondContact O-CB 3.43Å; L297-T300 PolarHBondContact O-N 2.68Å; L297-T300 PolarHBondContact O-OG1 2.69Å; L297-M302 HydrophobicContact CD2-CB 4.5Å; L297-T303 PolarHBondContact O-OG1 3.3Å; L297-P304 HydrophobicContact CB-CG 4.24Å; L297-F337 HydrophobicContact CD1-CE1 3.59Å; L297-F337 HydrophobicContact CD1-CZ 3.76Å
298	I	98.6	Very high	95.9	Very high	4 Å²	4	12.2 Å²	12.2	2%	0.021	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	125.6	-178.1	-60.8	171.7	0	0	0	109.5	L194 L198 L210 I227 Y294 T295 T303 P304	L194-I298 HydrophobicContact CD1-CG2 4.5Å; L198-I298 HydrophobicContact CD1-CB 3.57Å; L198-I298 HydrophobicContact CD1-CD1 4.01Å; L198-I298 HydrophobicContact CD1-CG1 4.35Å; L198-I298 HydrophobicContact CD1-CG2 3.67Å; L210-I298 HydrophobicContact CD1-CD1 4.05Å; L210-I298 HydrophobicContact CD2-CD1 4.07Å; I227-I298 HydrophobicContact CG2-CD1 4.37Å; I227-I298 HydrophobicContact CG2-CG2 3.99Å; Y294-I298 HydrophobicContact CE1-CD1 4.41Å; T295-I298 PolarHBondContact O-N 3.24Å; I298-T303 HydrophobicContact CG2-CG2 4.31Å; I298-P304 HydrophobicContact CG1-CG 4.49Å
299	G	97	Very high	96.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	13.6	-173.2	0	0	0	0	0	113.6	H191 R195 L297 T303	H191-G299 WeakPolarHBondContact CB-O 3.33Å; R195-G299 PolarHBondContact NH1-O 3.44Å; L297-G299 PolarHBondContact O-N 2.76Å; G299-T303 PolarHBondContact N-OG1 3.48Å
300	T	97.4	Very high	96.2	Very high	6 Å²	6	18.4 Å²	18.4	4%	0.037	11%	0.11	C	C	.	.	S	Bend	trans	-105.6	177.3	162.5	74.6	0	0	0	0	110.1	H191 C261 R264 L297 M302 T303	H191-T300 PolarHBondContact CE1-O 3.24Å; H191-T300 VanDerWaalsContact CE1-O 3.31Å; C261-T300 HydrophobicContact CB-CG2 4.4Å; R264-T300 HydrophobicContact CB-CG2 4.42Å; R264-T300 HydrophobicContact CG-CG2 4.24Å; L297-T300 WeakPolarHBondContact O-CB 3.43Å; L297-T300 PolarHBondContact O-N 2.68Å; L297-T300 PolarHBondContact O-OG1 2.69Å; T300-M302 PolarHBondContact O-N 3.13Å; T300-M302 PolarHBondContact OG1-N 2.97Å; T300-T303 PolarHBondContact N-OG1 2.94Å; T300-T303 PolarHBondContact O-N 3.02Å; T300-T303 PolarHBondContact O-OG1 3.4Å
301	I	95.4	Very high	96.1	Very high	74 Å²	74	20.1 Å²	20.1	38%	0.379	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.4	173.9	-160.7	169.4	0	0	0	112.2	L251 Y254 C255 T303	L251-I301 HydrophobicContact CD1-CD1 4.29Å; L251-I301 HydrophobicContact CD1-CG1 3.78Å; Y254-I301 HydrophobicContact CD2-CD1 4.46Å; Y254-I301 HydrophobicContact CG-CD1 4.32Å; C255-I301 HydrophobicContact CB-CG2 3.96Å; I301-T303 VanDerWaalsContact C-N 3.35Å; I301-T303 PolarHBondContact O-N 3.37Å
302	M	96.1	Very high	96	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	48.8	172.7	-66.1	-173.2	76.2	0	0	112	L251 C255 F265 L297 T300 P304 Q316 I333	L251-M302 HydrophobicContact CD2-CG 4.27Å; L251-M302 HydrophobicContact CG-CG 4.07Å; C255-M302 HydrophobicContact CB-CG 3.74Å; C255-M302 HydrophobicContact CB-SD 3.45Å; C255-M302 WeakPolarHBondContact CB-SD 3.31Å; C255-M302 PolarHBondContact SG-SD 3.4Å; F265-M302 HydrophobicContact CD1-SD 4.39Å; F265-M302 HydrophobicContact CD2-CE 3.76Å; F265-M302 HydrophobicContact CD2-SD 3.95Å; F265-M302 HydrophobicContact CE1-CE 4.46Å; F265-M302 HydrophobicContact CE2-CE 3.51Å; F265-M302 HydrophobicContact CE2-SD 4.26Å; F265-M302 HydrophobicContact CG-CE 4.35Å; F265-M302 HydrophobicContact CG-SD 4.03Å; F265-M302 HydrophobicContact CZ-CE 3.89Å; L297-M302 HydrophobicContact CD2-CB 4.5Å; T300-M302 PolarHBondContact O-N 3.13Å; T300-M302 PolarHBondContact OG1-N 2.97Å; M302-P304 WeakPolarHBondContact O-CD 3.25Å; M302-Q316 VanDerWaalsContact CA-OE1 3.25Å; M302-Q316 VanDerWaalsContact O-CD 3.3Å; M302-Q316 PolarHBondContact O-NE2 3.27Å; M302-Q316 PolarHBondContact O-OE1 3.45Å; M302-I333 HydrophobicContact CE-CG2 4.3Å
303	T	98	Very high	96.1	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.018	15%	0.154	C	C	.	.			trans	-71.2	115.4	174.7	-69.4	0	0	0	0	110.9	I227 F233 L297 I298 G299 T300 I301 Q316	I227-T303 HydrophobicContact CD1-CG2 3.86Å; F233-T303 VanDerWaalsContact CD2-O 3.22Å; F233-T303 WeakPolarHBondContact CD2-O 3.43Å; F233-T303 WeakPolarHBondContact CE2-O 3.49Å; L297-T303 PolarHBondContact O-OG1 3.3Å; I298-T303 HydrophobicContact CG2-CG2 4.31Å; G299-T303 PolarHBondContact N-OG1 3.48Å; T300-T303 PolarHBondContact N-OG1 2.94Å; T300-T303 PolarHBondContact O-N 3.02Å; T300-T303 PolarHBondContact O-OG1 3.4Å; I301-T303 VanDerWaalsContact C-N 3.35Å; I301-T303 PolarHBondContact O-N 3.37Å; T303-Q316 PolarHBondContact O-OE1 2.96Å; T303-Q316 VanDerWaalsContact O-OE1 3.09Å
304	P	98	Very high	96.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	16%	0.155	C	C	.	.			trans	-81.1	156	174.1	33.8	-34.3	0	0	0	111.6	Y294 L297 I298 M302 S315 F337	Y294-P304 HydrophobicContact CD2-CB 4.49Å; Y294-P304 HydrophobicContact CD2-CG 3.98Å; Y294-P304 HydrophobicContact CE1-CG 4.07Å; Y294-P304 HydrophobicContact CE2-CB 3.59Å; Y294-P304 HydrophobicContact CE2-CG 3.39Å; Y294-P304 VanDerWaalsContact CZ-CG 3.45Å; L297-P304 HydrophobicContact CB-CG 4.24Å; I298-P304 HydrophobicContact CG1-CG 4.49Å; M302-P304 WeakPolarHBondContact O-CD 3.25Å; P304-S315 WeakPolarHBondContact CA-O 3.22Å; P304-F337 HydrophobicContact CB-CD1 4.03Å; P304-F337 HydrophobicContact CB-CE1 4.12Å; P304-F337 HydrophobicContact CG-CE1 4.42Å
305	N	98.3	Very high	96.2	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.032	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	169.3	166.9	-160.5	15.8	0	0	0	111.9	R224 I227 F233 V314 S315	R224-N305 PolarHBondContact O-ND2 3.07Å; I227-N305 HydrophobicContact CD1-CB 4.07Å; F233-N305 HydrophobicContact CB-CB 4.46Å; F233-N305 HydrophobicContact CD1-CB 3.96Å; F233-N305 HydrophobicContact CD2-CB 3.71Å; F233-N305 HydrophobicContact CE1-CB 4.05Å; F233-N305 HydrophobicContact CE2-CB 3.81Å; F233-N305 HydrophobicContact CG-CB 3.79Å; F233-N305 HydrophobicContact CZ-CB 3.99Å; N305-V314 CarbonylContact O-C 3.59Å; N305-V314 VanDerWaalsContact O-CA 3.25Å; N305-V314 WeakPolarHBondContact O-CA 3.02Å; N305-S315 PolarHBondContact N-O 3.05Å; N305-S315 PolarHBondContact O-N 3.43Å
306	Y	97.8	Very high	96.1	Very high	7 Å²	7	27.4 Å²	27.4	3%	0.027	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	134.1	171	-66	-83.2	0	0	0	111.5	L210 R223 E313 V314	L210-Y306 WeakPolarHBondContact O-CE2 3.18Å; L210-Y306 PolarHBondContact O-OH 3.33Å; R223-Y306 HydrophobicContact CG-CD2 4.01Å; R223-Y306 HydrophobicContact CG-CE2 3.49Å; R223-Y306 VanDerWaalsContact CG-CE2 3.49Å; Y306-E313 WeakPolarHBondContact CA-O 3.12Å; Y306-V314 HydrophobicContact CD1-CG1 3.82Å; Y306-V314 HydrophobicContact CE1-CG1 3.9Å; Y306-V314 HydrophobicContact CG-CG1 4.24Å
307	V	94.4	Very high	96	Very high	71 Å²	71	29.9 Å²	29.9	43%	0.43	17%	0.171	S	C	.	.	S	Bend	trans	-72.9	-39.4	-178.4	-177	0	0	0	0	111.7	E313 S315	V307-E313 HydrophobicContact CG2-CG 4.21Å; V307-E313 PolarHBondContact N-O 3.42Å; V307-S315 VanDerWaalsContact CG2-OG 3.29Å; V307-S315 WeakPolarHBondContact CG2-OG 3.2Å
308	S	94	Very high	95.9	Very high	34 Å²	34	30.4 Å²	30.4	24%	0.238	17%	0.174	C	C	.	.			trans	-136.9	171.1	179.6	79.4	0	0	0	0	111.4	S310 S311	S308-S310 VanDerWaalsContact C-N 3.29Å; S308-S310 PolarHBondContact OG-N 3.47Å; S308-S310 PolarHBondContact OG-OG 3.43Å; S308-S311 PolarHBondContact OG-N 2.05Å; S308-S311 PolarHBondContact OG-OG 3.44Å
309	N	94.9	Very high	95.8	Very high	57 Å²	57	31.1 Å²	31.1	31%	0.305	18%	0.18	S	C	.	.	S	Bend	trans	-85.2	-0.3	172.7	63.5	1	0	0	0	113.4	G220 E221	G220-N309 WeakPolarHBondContact CA-O 3.49Å; E221-N309 HydrophobicContact CB-CB 3.96Å
310	S	92.8	Very high	95.7	Very high	95 Å²	95	32.2 Å²	32.2	66%	0.664	19%	0.187	S	C	*	.	S	Bend	trans	-111.1	-15.8	-175.3	58.7	0	0	0	0	113.6	S308	S308-S310 VanDerWaalsContact C-N 3.29Å; S308-S310 PolarHBondContact OG-N 3.47Å; S308-S310 PolarHBondContact OG-OG 3.43Å
311	S	92.4	Very high	95.6	Very high	36 Å²	36	39.3 Å²	39.3	25%	0.252	22%	0.22	S	C	.	.			trans	-120.9	167.7	-179.7	82.4	0	0	0	0	112	R223 S308 E313	R223-S311 PolarHBondContact NH2-O 3.41Å; S308-S311 PolarHBondContact OG-N 2.05Å; S308-S311 PolarHBondContact OG-OG 3.44Å; S311-E313 VanDerWaalsContact C-N 3.33Å; S311-E313 WeakPolarHBondContact OG-CB 3.46Å; S311-E313 PolarHBondContact OG-N 2.01Å; S311-E313 VanDerWaalsContact OG-N 3.16Å
312	T	92.4	Very high	95.5	Very high	53 Å²	53	39.9 Å²	39.9	33%	0.325	24%	0.243	S	C	.	.			trans	-96.7	12.4	167.4	59.6	0	0	0	0	111.8
313	E	95.7	Very high	95.5	Very high	92 Å²	92	40.4 Å²	40.4	43%	0.43	25%	0.247	S	C	.	.			trans	-70.6	134.6	178.2	-171.1	-177.3	172.6	0	0	109.6	Y306 V307 S311 S338	Y306-E313 WeakPolarHBondContact CA-O 3.12Å; V307-E313 HydrophobicContact CG2-CG 4.21Å; V307-E313 PolarHBondContact N-O 3.42Å; S311-E313 VanDerWaalsContact C-N 3.33Å; S311-E313 WeakPolarHBondContact OG-CB 3.46Å; S311-E313 PolarHBondContact OG-N 2.01Å; S311-E313 VanDerWaalsContact OG-N 3.16Å; E313-S338 WeakPolarHBondContact OE1-CB 3.36Å
314	V	97.7	Very high	95.4	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	146.5	-179.3	-63	0	0	0	0	109.8	Y294 N305 Y306 F337 S338 L343 I347	Y294-V314 HydrophobicContact CE2-CB 4.25Å; Y294-V314 HydrophobicContact CE2-CG1 4.48Å; Y294-V314 HydrophobicContact CE2-CG2 3.89Å; Y294-V314 WeakPolarHBondContact OH-CG1 3.44Å; N305-V314 CarbonylContact O-C 3.59Å; N305-V314 VanDerWaalsContact O-CA 3.25Å; N305-V314 WeakPolarHBondContact O-CA 3.02Å; Y306-V314 HydrophobicContact CD1-CG1 3.82Å; Y306-V314 HydrophobicContact CE1-CG1 3.9Å; Y306-V314 HydrophobicContact CG-CG1 4.24Å; V314-F337 HydrophobicContact CG2-CB 4.37Å; V314-F337 WeakPolarHBondContact CG2-O 3.36Å; V314-F337 CarbonylContact O-C 3.55Å; V314-F337 VanDerWaalsContact O-C 3.3Å; V314-S338 WeakPolarHBondContact O-CA 3.28Å; V314-S338 PolarHBondContact O-N 2.93Å; V314-L343 HydrophobicContact CG2-CD2 3.71Å; V314-I347 HydrophobicContact CG1-CD1 4.17Å; V314-I347 HydrophobicContact CG2-CD1 4.49Å
315	S	96.8	Very high	95.3	Very high	23 Å²	23	51.4 Å²	51.4	16%	0.161	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	171	173.7	69.3	0	0	0	0	111.5	F233 P304 N305 V307	F233-S315 WeakPolarHBondContact CE2-O 3.47Å; P304-S315 WeakPolarHBondContact CA-O 3.22Å; N305-S315 PolarHBondContact N-O 3.05Å; N305-S315 PolarHBondContact O-N 3.43Å; V307-S315 VanDerWaalsContact CG2-OG 3.29Å; V307-S315 WeakPolarHBondContact CG2-OG 3.2Å
316	Q	95.8	Very high	95.2	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.037	35%	0.348	C	S	.	.			trans	-85.7	160.5	169.4	-65.8	-66.3	-20.1	0	0	110.5	L251 M302 T303 C318 F337	L251-Q316 HydrophobicContact CD2-CB 4.17Å; M302-Q316 VanDerWaalsContact CA-OE1 3.25Å; M302-Q316 VanDerWaalsContact O-CD 3.3Å; M302-Q316 PolarHBondContact O-NE2 3.27Å; M302-Q316 PolarHBondContact O-OE1 3.45Å; T303-Q316 PolarHBondContact O-OE1 2.96Å; T303-Q316 VanDerWaalsContact O-OE1 3.09Å; Q316-C318 PolarHBondContact O-N 2.71Å; Q316-F337 HydrophobicContact CG-CD2 3.75Å; Q316-F337 HydrophobicContact CG-CE1 4.4Å; Q316-F337 HydrophobicContact CG-CE2 3.57Å; Q316-F337 HydrophobicContact CG-CG 4.25Å; Q316-F337 HydrophobicContact CG-CZ 3.94Å
317	W	94.9	Very high	95.1	Very high	55 Å²	55	60.4 Å²	60.4	21%	0.208	37%	0.365	C	S	.	.	S	Bend	trans	-77.8	65.4	172.2	-169	-107.9	0	0	0	111.4	F233 E234 K245 P246	F233-W317 AromaticContact CD1-CE3 3.96Å; F233-W317 HydrophobicContact CD1-CE3 3.96Å; F233-W317 HydrophobicContact CD2-CB 4.15Å; F233-W317 AromaticContact CE1-CE3 3.54Å; F233-W317 HydrophobicContact CE1-CE3 3.54Å; F233-W317 HydrophobicContact CE1-CZ3 4.14Å; F233-W317 HydrophobicContact CE2-CB 3.93Å; F233-W317 HydrophobicContact CZ-CB 4.18Å; F233-W317 AromaticContact CZ-CE3 3.99Å; F233-W317 HydrophobicContact CZ-CE3 3.99Å; E234-W317 HydrophobicContact CB-CH2 4.34Å; E234-W317 HydrophobicContact CB-CZ2 4.33Å; E234-W317 HydrophobicContact CG-CE3 4.18Å; E234-W317 HydrophobicContact CG-CH2 3.99Å; E234-W317 HydrophobicContact CG-CZ2 4.47Å; E234-W317 HydrophobicContact CG-CZ3 3.83Å; K245-W317 HydrophobicContact CD-CD2 4.44Å; K245-W317 HydrophobicContact CD-CE3 4.31Å; K245-W317 HydrophobicContact CD-CZ3 4.48Å; K245-W317 VanDerWaalsContact CE-CZ3 3.44Å; K245-W317 HydrophobicContact CG-CD2 4.06Å; K245-W317 HydrophobicContact CG-CE3 4.32Å; K245-W317 HydrophobicContact CG-CH2 4.32Å; K245-W317 HydrophobicContact CG-CZ2 4.04Å; K245-W317 HydrophobicContact CG-CZ3 4.46Å; P246-W317 WeakPolarHBondContact CD-O 3.44Å
318	C	95.4	Very high	95.2	Very high	10 Å²	10	64.4 Å²	64.4	7%	0.068	38%	0.379	C	S	.	.			trans	-149.1	166.5	178.3	67.2	0	0	0	0	112	K245 P246 C248 L251 Q316	K245-C318 WeakPolarHBondContact CD-O 3.01Å; P246-C318 CarbonylContact O-C 3.59Å; P246-C318 WeakPolarHBondContact O-CA 3.22Å; P246-C318 VanDerWaalsContact O-CB 3.22Å; P246-C318 WeakPolarHBondContact O-CB 3Å; C248-C318 VanDerWaalsContact CA-SG 3.5Å; C248-C318 HydrophobicContact CB-CB 3.83Å; C248-C318 WeakPolarHBondContact CB-SG 3.02Å; C248-C318 WeakPolarHBondContact SG-CB 3.37Å; C248-C318 CovalentContact SG-SG 2.04Å; C248-C318 PolarHBondContact SG-SG 3.47Å; L251-C318 HydrophobicContact CB-CB 4.5Å; L251-C318 HydrophobicContact CD2-CB 3.99Å; Q316-C318 PolarHBondContact O-N 2.71Å
319	S	95.6	Very high	95.3	Very high	20 Å²	20	63.5 Å²	63.5	14%	0.14	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-128.5	174.7	171.6	79.9	0	0	0	0	110.8	K245 P246 N247 C248 E321 Q334	K245-S319 PolarHBondContact O-OG 3.35Å; P246-S319 PolarHBondContact O-N 2.95Å; N247-S319 CarbonylContact C-O 3.3Å; N247-S319 WeakPolarHBondContact CA-O 3.39Å; C248-S319 PolarHBondContact N-O 3.17Å; C248-S319 PolarHBondContact SG-O 3.49Å; S319-E321 PolarHBondContact OG-N 2.75Å; S319-Q334 VanDerWaalsContact C-NE2 3.33Å
320	C	96.6	Very high	95.4	Very high	22 Å²	22	60.8 Å²	60.8	15%	0.149	36%	0.36	C	S	.	.			trans	-105.4	15.5	170.2	-70.2	0	0	0	0	112.9	S323 L327 C330 Q334	C320-S323 VanDerWaalsContact C-OG 3.31Å; C320-S323 WeakPolarHBondContact CA-OG 3.02Å; C320-S323 WeakPolarHBondContact O-CB 3.47Å; C320-S323 PolarHBondContact O-N 3.02Å; C320-S323 PolarHBondContact O-OG 3.31Å; C320-L327 HydrophobicContact CB-CD1 3.85Å; C320-C330 WeakPolarHBondContact CA-SG 3.48Å; C320-C330 HydrophobicContact CB-CB 3.89Å; C320-C330 WeakPolarHBondContact CB-SG 3.37Å; C320-C330 WeakPolarHBondContact SG-CB 3.07Å; C320-C330 CovalentContact SG-SG 2.03Å; C320-C330 PolarHBondContact SG-SG 3.33Å; C320-Q334 VanDerWaalsContact N-NE2 3.16Å; C320-Q334 PolarHBondContact SG-NE2 2.91Å
321	E	94.7	Very high	95.6	Very high	156 Å²	156	60.5 Å²	60.5	73%	0.729	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	138.5	172.3	-63.9	-178.3	168.1	0	0	109.5	N247 S319 S323	N247-E321 PolarHBondContact ND2-O 3.3Å; S319-E321 PolarHBondContact OG-N 2.75Å; E321-S323 VanDerWaalsContact C-N 3.32Å; E321-S323 PolarHBondContact O-N 3.37Å
322	G	93.4	Very high	95.8	Very high	85 Å²	85	67.6 Å²	67.6	88%	0.876	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	9.1	-178.7	0	0	0	0	0	116.1	G324	G322-G324 VanDerWaalsContact C-N 3.32Å; G322-G324 PolarHBondContact O-N 3.5Å
323	S	95.6	Very high	95.9	Very high	12 Å²	12	65.4 Å²	65.4	8%	0.084	36%	0.356	C	S	.	.			trans	-71.3	-20.3	-178.1	-51	0	0	0	0	114.9	N247 C320 E321 N325 E326 C330	N247-S323 PolarHBondContact ND2-OG 3.37Å; C320-S323 VanDerWaalsContact C-OG 3.31Å; C320-S323 WeakPolarHBondContact CA-OG 3.02Å; C320-S323 WeakPolarHBondContact O-CB 3.47Å; C320-S323 PolarHBondContact O-N 3.02Å; C320-S323 PolarHBondContact O-OG 3.31Å; E321-S323 VanDerWaalsContact C-N 3.32Å; E321-S323 PolarHBondContact O-N 3.37Å; S323-N325 PolarHBondContact O-N 2.94Å; S323-E326 PolarHBondContact O-N 3.08Å; S323-C330 WeakPolarHBondContact OG-CB 3.26Å
324	G	95.4	Very high	95.9	Very high	62 Å²	62	64.2 Å²	64.2	64%	0.639	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	52.4	-124.3	-177.1	0	0	0	0	0	112.9	G322 E326 L327	G322-G324 VanDerWaalsContact C-N 3.32Å; G322-G324 PolarHBondContact O-N 3.5Å; G324-E326 PolarHBondContact O-N 2.93Å; G324-L327 WeakPolarHBondContact O-CB 3.49Å; G324-L327 PolarHBondContact O-N 3.22Å
325	N	96	Very high	95.8	Very high	173 Å²	173	67.5 Å²	67.5	93%	0.925	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.6	-179.7	-64.9	-23.6	0	0	0	113.5	S323 L327	S323-N325 PolarHBondContact O-N 2.94Å; N325-L327 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.45Å
326	E	96.1	Very high	95.8	Very high	128 Å²	128	68.6 Å²	68.6	60%	0.598	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-92.4	13.2	-178.6	-59.8	-171.3	92.8	0	0	113	L249 S323 G324 Q328 G329 C330	L249-E326 HydrophobicContact CD1-CB 3.49Å; L249-E326 VanDerWaalsContact CD1-CB 3.49Å; S323-E326 PolarHBondContact O-N 3.08Å; G324-E326 PolarHBondContact O-N 2.93Å; E326-Q328 PolarHBondContact O-N 3.48Å; E326-G329 WeakPolarHBondContact O-CA 3.24Å; E326-G329 PolarHBondContact O-N 2.97Å; E326-C330 PolarHBondContact O-N 3.06Å
327	L	97.3	Very high	95.9	Very high	75 Å²	75	68.6 Å²	68.6	39%	0.393	37%	0.372	S	S	.	.	H	α-helix	trans	-52.1	-41.7	-179.8	-179.1	63	0	0	0	112.8	C320 G324 N325 C330 Q331	C320-L327 HydrophobicContact CB-CD1 3.85Å; G324-L327 WeakPolarHBondContact O-CB 3.49Å; G324-L327 PolarHBondContact O-N 3.22Å; N325-L327 VanDerWaalsContact C-N 3.3Å; N325-L327 PolarHBondContact O-N 3.45Å; L327-C330 PolarHBondContact O-N 2.84Å; L327-Q331 HydrophobicContact CD1-CG 4.3Å; L327-Q331 HydrophobicContact CG-CG 4.45Å; L327-Q331 WeakPolarHBondContact O-CB 3.39Å; L327-Q331 VanDerWaalsContact O-CG 3.31Å; L327-Q331 WeakPolarHBondContact O-CG 3.09Å; L327-Q331 PolarHBondContact O-N 2.03Å
328	Q	96.5	Very high	95.9	Very high	155 Å²	155	67.8 Å²	67.8	72%	0.724	37%	0.374	S	S	*	.	H	α-helix	trans	-65.8	-37.5	176.9	-66.6	-176.8	7	0	0	112.2	E326 R332	E326-Q328 PolarHBondContact O-N 3.48Å; Q328-R332 WeakPolarHBondContact O-CG 3.33Å; Q328-R332 PolarHBondContact O-N 3.38Å
329	G	95.2	Very high	95.9	Very high	15 Å²	15	72.6 Å²	72.6	16%	0.155	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-48.5	172.8	0	0	0	0	0	111.3	E326 Q331 R332 I333	E326-G329 WeakPolarHBondContact O-CA 3.24Å; E326-G329 PolarHBondContact O-N 2.97Å; G329-Q331 PolarHBondContact O-N 3.38Å; G329-R332 WeakPolarHBondContact O-CB 3.33Å; G329-R332 PolarHBondContact O-N 3.5Å; G329-I333 PolarHBondContact O-N 3.21Å
330	C	97.4	Very high	96	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-45.6	177.5	-177.7	0	0	0	0	112.8	L249 C320 S323 E326 L327 R332 I333 Q334	L249-C330 HydrophobicContact CD1-CB 3.94Å; L249-C330 HydrophobicContact CG-CB 3.89Å; C320-C330 WeakPolarHBondContact CA-SG 3.48Å; C320-C330 HydrophobicContact CB-CB 3.89Å; C320-C330 WeakPolarHBondContact CB-SG 3.37Å; C320-C330 WeakPolarHBondContact SG-CB 3.07Å; C320-C330 CovalentContact SG-SG 2.03Å; C320-C330 PolarHBondContact SG-SG 3.33Å; S323-C330 WeakPolarHBondContact OG-CB 3.26Å; E326-C330 PolarHBondContact O-N 3.06Å; L327-C330 PolarHBondContact O-N 2.84Å; C330-R332 VanDerWaalsContact C-N 3.29Å; C330-R332 PolarHBondContact O-N 3.28Å; C330-I333 WeakPolarHBondContact O-CB 3.32Å; C330-I333 PolarHBondContact O-N 2.98Å; C330-I333 VanDerWaalsContact O-N 3.09Å; C330-Q334 PolarHBondContact O-N 2.9Å; C330-Q334 VanDerWaalsContact O-N 3.11Å
331	Q	97.4	Very high	95.9	Very high	89 Å²	89	74 Å²	74	42%	0.416	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-35.2	178.2	-75.7	175.1	-20.5	0	0	112	L327 G329 I333 Q334 N335	L327-Q331 HydrophobicContact CD1-CG 4.3Å; L327-Q331 HydrophobicContact CG-CG 4.45Å; L327-Q331 WeakPolarHBondContact O-CB 3.39Å; L327-Q331 VanDerWaalsContact O-CG 3.31Å; L327-Q331 WeakPolarHBondContact O-CG 3.09Å; L327-Q331 PolarHBondContact O-N 2.03Å; G329-Q331 PolarHBondContact O-N 3.38Å; Q331-I333 VanDerWaalsContact C-N 3.31Å; Q331-I333 PolarHBondContact O-N 3.16Å; Q331-Q334 PolarHBondContact O-N 3.18Å; Q331-N335 VanDerWaalsContact O-CB 3.29Å; Q331-N335 WeakPolarHBondContact O-CB 3Å; Q331-N335 PolarHBondContact O-N 3.34Å; Q331-N335 PolarHBondContact O-ND2 2.86Å
332	R	95.3	Very high	96	Very high	184 Å²	184	66.5 Å²	66.5	69%	0.694	37%	0.369	S	S	*	.	H	α-helix	trans	-57.9	-44.8	172.3	-78.1	-175.2	-67.1	162.1	-0.4	111.1	Q328 G329 C330 N335 L336	Q328-R332 WeakPolarHBondContact O-CG 3.33Å; Q328-R332 PolarHBondContact O-N 3.38Å; G329-R332 WeakPolarHBondContact O-CB 3.33Å; G329-R332 PolarHBondContact O-N 3.5Å; C330-R332 VanDerWaalsContact C-N 3.29Å; C330-R332 PolarHBondContact O-N 3.28Å; R332-N335 PolarHBondContact O-N 2.86Å; R332-L336 WeakPolarHBondContact O-CG 3.24Å; R332-L336 PolarHBondContact O-N 3.49Å; R332-L336 VanDerWaalsContact O-N 3.16Å
333	I	95.3	Very high	96.2	Very high	8 Å²	8	62.6 Å²	62.6	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-46.9	178.2	-59.3	162.6	0	0	0	111	C248 L249 Q252 M302 G329 C330 Q331 N335 L336 F337	C248-I333 HydrophobicContact CB-CB 4.4Å; C248-I333 HydrophobicContact CB-CD1 4.48Å; C248-I333 HydrophobicContact CB-CG2 4.19Å; L249-I333 HydrophobicContact CD2-CD1 3.75Å; L249-I333 HydrophobicContact CG-CD1 4.33Å; Q252-I333 HydrophobicContact CB-CD1 4.04Å; Q252-I333 HydrophobicContact CG-CD1 4.45Å; M302-I333 HydrophobicContact CE-CG2 4.3Å; G329-I333 PolarHBondContact O-N 3.21Å; C330-I333 WeakPolarHBondContact O-CB 3.32Å; C330-I333 PolarHBondContact O-N 2.98Å; C330-I333 VanDerWaalsContact O-N 3.09Å; Q331-I333 VanDerWaalsContact C-N 3.31Å; Q331-I333 PolarHBondContact O-N 3.16Å; I333-N335 PolarHBondContact O-N 3.43Å; I333-L336 WeakPolarHBondContact O-CB 3.23Å; I333-L336 PolarHBondContact O-N 2.98Å; I333-F337 WeakPolarHBondContact O-CD2 3.41Å
334	Q	95.9	Very high	96.1	Very high	66 Å²	66	69.6 Å²	69.6	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-45.4	177.6	-70.1	-165.8	22.1	0	0	112	C248 S319 C320 C330 Q331 L336 F337 S338	C248-Q334 VanDerWaalsContact SG-CG 3.51Å; S319-Q334 VanDerWaalsContact C-NE2 3.33Å; C320-Q334 VanDerWaalsContact N-NE2 3.16Å; C320-Q334 PolarHBondContact SG-NE2 2.91Å; C330-Q334 PolarHBondContact O-N 2.9Å; C330-Q334 VanDerWaalsContact O-N 3.11Å; Q331-Q334 PolarHBondContact O-N 3.18Å; Q334-L336 PolarHBondContact O-N 3Å; Q334-F337 PolarHBondContact O-N 3.28Å; Q334-S338 PolarHBondContact O-N 3.38Å; Q334-S338 PolarHBondContact O-OG 3.15Å
335	N	96.3	Very high	96	Very high	72 Å²	72	68.8 Å²	68.8	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-23	-177.2	-72	-22.8	0	0	0	113.3	Q331 R332 I333 F337 N339	Q331-N335 VanDerWaalsContact O-CB 3.29Å; Q331-N335 WeakPolarHBondContact O-CB 3Å; Q331-N335 PolarHBondContact O-N 3.34Å; Q331-N335 PolarHBondContact O-ND2 2.86Å; R332-N335 PolarHBondContact O-N 2.86Å; I333-N335 PolarHBondContact O-N 3.43Å; N335-F337 PolarHBondContact O-N 3.19Å; N335-F337 VanDerWaalsContact O-N 3.15Å; N335-N339 HydrophobicContact CB-CB 4.34Å; N335-N339 CarbonylContact O-C 3.16Å; N335-N339 PolarHBondContact O-N 3.24Å; N335-N339 VanDerWaalsContact O-N 3.15Å
336	L	95.8	Very high	95.8	Very high	46 Å²	46	60.5 Å²	60.5	24%	0.241	29%	0.289	C	S	.	.	H	α-helix	trans	-56.6	-27.8	171.2	-69.7	171.8	0	0	0	112.3	F265 F268 Q269 R332 I333 Q334 N340	F265-L336 HydrophobicContact CE2-CD1 4.08Å; F265-L336 HydrophobicContact CZ-CD1 3.7Å; F268-L336 HydrophobicContact CE1-CB 4.04Å; F268-L336 WeakPolarHBondContact CZ-O 3.32Å; Q269-L336 HydrophobicContact CG-CD1 4.16Å; R332-L336 WeakPolarHBondContact O-CG 3.24Å; R332-L336 PolarHBondContact O-N 3.49Å; R332-L336 VanDerWaalsContact O-N 3.16Å; I333-L336 WeakPolarHBondContact O-CB 3.23Å; I333-L336 PolarHBondContact O-N 2.98Å; Q334-L336 PolarHBondContact O-N 3Å; L336-N340 VanDerWaalsContact O-CB 3.24Å; L336-N340 WeakPolarHBondContact O-CB 3.48Å; L336-N340 PolarHBondContact O-ND2 3.25Å
337	F	97.3	Very high	95.7	Very high	7 Å²	7	54.7 Å²	54.7	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-105.5	-52.2	-178.5	-61.4	-84.2	0	0	0	112.6	F265 F268 Y294 L297 P304 V314 Q316 I333 Q334 N335	F265-F337 HydrophobicContact CE2-CE2 4.19Å; F265-F337 HydrophobicContact CE2-CZ 4.1Å; F268-F337 HydrophobicContact CD1-CE1 4.07Å; F268-F337 AromaticContact CD1-CZ 3.92Å; F268-F337 HydrophobicContact CD1-CZ 3.92Å; F268-F337 AromaticContact CE1-CD1 4Å; F268-F337 HydrophobicContact CE1-CD1 4Å; F268-F337 AromaticContact CE1-CE1 3.44Å; F268-F337 HydrophobicContact CE1-CE1 3.44Å; F268-F337 VanDerWaalsContact CE1-CE1 3.44Å; F268-F337 HydrophobicContact CE1-CE2 4.06Å; F268-F337 AromaticContact CE1-CZ 3.47Å; F268-F337 HydrophobicContact CE1-CZ 3.47Å; F268-F337 VanDerWaalsContact CE1-CZ 3.47Å; F268-F337 HydrophobicContact CE2-CE1 4.18Å; F268-F337 AromaticContact CZ-CD1 3.74Å; F268-F337 HydrophobicContact CZ-CD1 3.74Å; F268-F337 AromaticContact CZ-CE1 3.51Å; F268-F337 HydrophobicContact CZ-CE1 3.51Å; F268-F337 HydrophobicContact CZ-CG 4.43Å; F268-F337 HydrophobicContact CZ-CZ 4.05Å; Y294-F337 HydrophobicContact CE2-CD1 4.46Å; L297-F337 HydrophobicContact CD1-CE1 3.59Å; L297-F337 HydrophobicContact CD1-CZ 3.76Å; P304-F337 HydrophobicContact CB-CD1 4.03Å; P304-F337 HydrophobicContact CB-CE1 4.12Å; P304-F337 HydrophobicContact CG-CE1 4.42Å; V314-F337 HydrophobicContact CG2-CB 4.37Å; V314-F337 WeakPolarHBondContact CG2-O 3.36Å; V314-F337 CarbonylContact O-C 3.55Å; V314-F337 VanDerWaalsContact O-C 3.3Å; Q316-F337 HydrophobicContact CG-CD2 3.75Å; Q316-F337 HydrophobicContact CG-CE1 4.4Å; Q316-F337 HydrophobicContact CG-CE2 3.57Å; Q316-F337 HydrophobicContact CG-CG 4.25Å; Q316-F337 HydrophobicContact CG-CZ 3.94Å; I333-F337 WeakPolarHBondContact O-CD2 3.41Å; Q334-F337 PolarHBondContact O-N 3.28Å; N335-F337 PolarHBondContact O-N 3.19Å; N335-F337 VanDerWaalsContact O-N 3.15Å
338	S	95.8	Very high	95.3	Very high	38 Å²	38	53.3 Å²	53.3	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-77.8	-31.4	-172.7	57.6	0	0	0	0	113.3	E313 V314 Q334	E313-S338 WeakPolarHBondContact OE1-CB 3.36Å; V314-S338 WeakPolarHBondContact O-CA 3.28Å; V314-S338 PolarHBondContact O-N 2.93Å; Q334-S338 PolarHBondContact O-N 3.38Å; Q334-S338 PolarHBondContact O-OG 3.15Å
339	N	95.7	Very high	94.7	Very high	111 Å²	111	46.9 Å²	46.9	59%	0.594	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.5	56.9	-173.1	-167.6	20.4	0	0	0	112.2	N335	N335-N339 HydrophobicContact CB-CB 4.34Å; N335-N339 CarbonylContact O-C 3.16Å; N335-N339 PolarHBondContact O-N 3.24Å; N335-N339 VanDerWaalsContact O-N 3.15Å
340	N	96.5	Very high	94	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.053	24%	0.236	C	C	.	.			trans	-119.6	113.8	178.3	-177.7	-35.1	0	0	0	110.6	C272 L336 C342 L343 R344	C272-N340 PolarHBondContact O-ND2 2.98Å; C272-N340 PolarHBondContact O-OD1 3.17Å; L336-N340 VanDerWaalsContact O-CB 3.24Å; L336-N340 WeakPolarHBondContact O-CB 3.48Å; L336-N340 PolarHBondContact O-ND2 3.25Å; N340-C342 PolarHBondContact O-N 3.18Å; N340-C342 WeakPolarHBondContact OD1-CB 3.35Å; N340-C342 PolarHBondContact OD1-N 3.12Å; N340-L343 HydrophobicContact CB-CB 3.99Å; N340-L343 PolarHBondContact O-N 3.26Å; N340-L343 PolarHBondContact OD1-N 3.31Å; N340-R344 WeakPolarHBondContact O-CB 3.38Å; N340-R344 PolarHBondContact O-N 3.47Å
341	L	95.9	Very high	92.3	Very high	61 Å²	61	50.7 Å²	50.7	32%	0.319	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-41.7	-178	179.7	63.5	0	0	0	112.5	Q274 N345	Q274-L341 HydrophobicContact CB-CB 4.36Å; L341-N345 WeakPolarHBondContact O-CB 3.34Å; L341-N345 PolarHBondContact O-N 3.16Å; L341-N345 PolarHBondContact O-ND2 3.07Å
342	C	96.4	Very high	90.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-52.4	178	172.1	0	0	0	0	110.6	Q274 G281 C282 C290 N340 R344 N345 A346	Q274-C342 HydrophobicContact CB-CB 4.3Å; G281-C342 WeakPolarHBondContact O-CA 3.4Å; G281-C342 WeakPolarHBondContact O-CB 3.13Å; G281-C342 PolarHBondContact O-N 3.37Å; C282-C342 VanDerWaalsContact CA-SG 3.59Å; C282-C342 HydrophobicContact CB-CB 3.84Å; C282-C342 WeakPolarHBondContact CB-SG 3.47Å; C282-C342 VanDerWaalsContact SG-CA 3.53Å; C282-C342 WeakPolarHBondContact SG-CB 3.27Å; C282-C342 CovalentContact SG-SG 2.03Å; C282-C342 PolarHBondContact SG-SG 3.32Å; C290-C342 VanDerWaalsContact SG-SG 3.68Å; N340-C342 PolarHBondContact O-N 3.18Å; N340-C342 WeakPolarHBondContact OD1-CB 3.35Å; N340-C342 PolarHBondContact OD1-N 3.12Å; C342-R344 PolarHBondContact O-N 3.45Å; C342-N345 PolarHBondContact O-N 3.35Å; C342-A346 VanDerWaalsContact O-CB 3.24Å; C342-A346 WeakPolarHBondContact O-CB 3.46Å; C342-A346 PolarHBondContact O-N 3.44Å
343	L	96.3	Very high	87.9	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-44.3	-177.9	-177.8	59.3	0	0	0	111.8	F268 Y294 V314 N340 N345 A346 I347	F268-L343 HydrophobicContact CE2-CD2 4.16Å; F268-L343 HydrophobicContact CZ-CD2 4.12Å; Y294-L343 HydrophobicContact CD2-CD1 3.79Å; Y294-L343 HydrophobicContact CD2-CD2 3.98Å; Y294-L343 HydrophobicContact CE2-CD1 4.48Å; Y294-L343 HydrophobicContact CE2-CD2 4.23Å; Y294-L343 HydrophobicContact CG-CD1 4.09Å; V314-L343 HydrophobicContact CG2-CD2 3.71Å; N340-L343 HydrophobicContact CB-CB 3.99Å; N340-L343 PolarHBondContact O-N 3.26Å; N340-L343 PolarHBondContact OD1-N 3.31Å; L343-N345 PolarHBondContact O-N 3.29Å; L343-A346 PolarHBondContact O-N 2.91Å; L343-I347 HydrophobicContact CD1-CD1 4.02Å; L343-I347 HydrophobicContact CD1-CG1 4.24Å; L343-I347 HydrophobicContact CG-CD1 4.03Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 2.77Å
344	R	94.8	Very high	85.3	Confident	159 Å²	159	47.9 Å²	47.9	60%	0.6	27%	0.268	S	S	*	.	H	α-helix	trans	-59.4	-46.2	177	-179.1	-179.9	174.1	-126.3	-0.6	111.8	N340 C342 A346 S348	N340-R344 WeakPolarHBondContact O-CB 3.38Å; N340-R344 PolarHBondContact O-N 3.47Å; C342-R344 PolarHBondContact O-N 3.45Å; R344-A346 VanDerWaalsContact C-N 3.34Å; R344-S348 WeakPolarHBondContact O-CB 3.42Å; R344-S348 PolarHBondContact O-N 3.03Å; R344-S348 PolarHBondContact O-OG 3.02Å
345	N	92.8	Very high	82.4	Confident	45 Å²	45	50 Å²	50	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-37.9	177.7	-72.6	-8.2	0	0	0	111.5	S280 L341 C342 L343 S348 S349	S280-N345 WeakPolarHBondContact O-CB 3.35Å; S280-N345 PolarHBondContact O-ND2 2.89Å; L341-N345 WeakPolarHBondContact O-CB 3.34Å; L341-N345 PolarHBondContact O-N 3.16Å; L341-N345 PolarHBondContact O-ND2 3.07Å; C342-N345 PolarHBondContact O-N 3.35Å; L343-N345 PolarHBondContact O-N 3.29Å; N345-S348 PolarHBondContact O-N 2.98Å; N345-S349 VanDerWaalsContact O-CB 3.27Å; N345-S349 WeakPolarHBondContact O-CB 3.18Å; N345-S349 PolarHBondContact O-N 3.5Å; N345-S349 PolarHBondContact O-OG 2.92Å
346	A	92.9	Very high	79.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-49.9	177.9	0	0	0	0	0	111.6	R287 C290 L291 C342 L343 R344 S348 S349	R287-A346 HydrophobicContact CB-CB 3.78Å; R287-A346 HydrophobicContact CG-CB 4.14Å; C290-A346 HydrophobicContact CB-CB 4.43Å; L291-A346 HydrophobicContact CD2-CB 3.89Å; L291-A346 HydrophobicContact CG-CB 3.92Å; C342-A346 VanDerWaalsContact O-CB 3.24Å; C342-A346 WeakPolarHBondContact O-CB 3.46Å; C342-A346 PolarHBondContact O-N 3.44Å; L343-A346 PolarHBondContact O-N 2.91Å; R344-A346 VanDerWaalsContact C-N 3.34Å; A346-S348 PolarHBondContact O-N 2.89Å; A346-S349 PolarHBondContact O-N 3.19Å; A346-S349 PolarHBondContact O-OG 3.25Å
347	I	93.1	Very high	76.9	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-46.9	176.2	-65.6	169.8	0	0	0	110.5	F211 L291 V314 L343 S349 M350	F211-I347 HydrophobicContact CD1-CG1 4.07Å; F211-I347 HydrophobicContact CD1-CG2 4.44Å; F211-I347 HydrophobicContact CE1-CG1 4.3Å; L291-I347 HydrophobicContact CD2-CG1 3.88Å; V314-I347 HydrophobicContact CG1-CD1 4.17Å; V314-I347 HydrophobicContact CG2-CD1 4.49Å; L343-I347 HydrophobicContact CD1-CD1 4.02Å; L343-I347 HydrophobicContact CD1-CG1 4.24Å; L343-I347 HydrophobicContact CG-CD1 4.03Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 2.77Å; I347-S349 VanDerWaalsContact C-N 3.25Å; I347-S349 PolarHBondContact O-N 3.31Å; I347-M350 PolarHBondContact O-N 2.95Å
348	S	88.9	Confident	74.2	Confident	46 Å²	46	60.6 Å²	60.6	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-29.5	-178.7	-55.2	0	0	0	0	112.9	R344 N345 A346 M350 G351	R344-S348 WeakPolarHBondContact O-CB 3.42Å; R344-S348 PolarHBondContact O-N 3.03Å; R344-S348 PolarHBondContact O-OG 3.02Å; N345-S348 PolarHBondContact O-N 2.98Å; A346-S348 PolarHBondContact O-N 2.89Å; S348-M350 PolarHBondContact O-N 3.48Å; S348-G351 PolarHBondContact O-N 3.36Å
349	S	84.9	Confident	71.6	Confident	20 Å²	20	67.6 Å²	67.6	14%	0.14	39%	0.39	C	S	.	.	H	α-helix	trans	-68.5	-17.5	-178.6	72.2	0	0	0	0	114.3	N345 A346 I347 G351	N345-S349 VanDerWaalsContact O-CB 3.27Å; N345-S349 WeakPolarHBondContact O-CB 3.18Å; N345-S349 PolarHBondContact O-N 3.5Å; N345-S349 PolarHBondContact O-OG 2.92Å; A346-S349 PolarHBondContact O-N 3.19Å; A346-S349 PolarHBondContact O-OG 3.25Å; I347-S349 VanDerWaalsContact C-N 3.25Å; I347-S349 PolarHBondContact O-N 3.31Å; S349-G351 PolarHBondContact O-N 3.48Å
350	M	79.8	Confident	69	Low	54 Å²	54	70.2 Å²	70.2	27%	0.266	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.1	177.3	-67.2	-60.4	-59.9	0	0	113.2	F207 F211 L291 I347 S348	F207-M350 HydrophobicContact CB-CE 3.86Å; F211-M350 HydrophobicContact CB-CB 4.16Å; F211-M350 HydrophobicContact CB-CG 3.85Å; L291-M350 HydrophobicContact CD1-CG 3.71Å; L291-M350 HydrophobicContact CD1-SD 3.69Å; I347-M350 PolarHBondContact O-N 2.95Å; S348-M350 PolarHBondContact O-N 3.48Å
351	G	61.8	Low	66	Low	41 Å²	41	75.4 Å²	75.4	42%	0.423	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-1.7	-179.9	0	0	0	0	0	115.9	S348 S349	S348-G351 PolarHBondContact O-N 3.36Å; S349-G351 PolarHBondContact O-N 3.48Å
352	I	54.9	Low	63.2	Low	107 Å²	107	78.4 Å²	78.4	55%	0.549	45%	0.453	S	S	.	.			trans	-105.5	119.4	-174.1	-59.3	170.2	0	0	0	109.6	R132 A354	R132-I352 PolarHBondContact NH1-O 3.41Å; I352-A354 PolarHBondContact O-N 3.21Å
353	S	45.3	Very low	60.2	Low	80 Å²	80	84.4 Å²	84.4	56%	0.559	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-61	127.8	165.6	47.9	0	0	0	0	109.7
354	A	40.8	Very low	57.4	Low	36 Å²	36	89.9 Å²	89.9	30%	0.298	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-64.8	143.3	165.9	0	0	0	0	0	109.3	I352	I352-A354 PolarHBondContact O-N 3.21Å
355	P	34.9	Very low	54.4	Low	110 Å²	110	88.9 Å²	88.9	71%	0.714	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-57	143	165.6	25	-31	0	0	0	108.7
356	P	36.9	Very low	51.6	Low	105 Å²	105	92 Å²	92	68%	0.682	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-55.3	145.3	173.9	24.3	-32.4	0	0	0	109.2	V358	P356-V358 PolarHBondContact O-N 3.47Å; P356-V358 VanDerWaalsContact O-N 3.09Å
357	P	40.2	Very low	48.9	Very low	128 Å²	128	100.8 Å²	100.8	83%	0.831	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-56	122.5	174.6	22	-29.6	0	0	0	108.6	E359	P357-E359 PolarHBondContact O-N 3.44Å; P357-E359 VanDerWaalsContact O-N 3.17Å
358	V	38.8	Very low	46.1	Very low	114 Å²	114	106.5 Å²	106.5	69%	0.691	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-63.5	117	177.4	-178.9	0	0	0	0	107.5	P356 H360	P356-V358 PolarHBondContact O-N 3.47Å; P356-V358 VanDerWaalsContact O-N 3.09Å; V358-H360 HydrophobicContact CG1-CB 4.17Å; V358-H360 PolarHBondContact O-N 3.4Å
359	E	41.4	Very low	43.4	Very low	185 Å²	185	109.6 Å²	109.6	86%	0.864	66%	0.662	S	S	*	*	S	Bend	trans	-73.5	53.8	-179.3	-161.9	175.8	-169.4	0	0	111.6	P357	P357-E359 PolarHBondContact O-N 3.44Å; P357-E359 VanDerWaalsContact O-N 3.17Å
360	H	41.6	Very low	41	Very low	166 Å²	166	114.6 Å²	114.6	77%	0.769	69%	0.694	S	S	*	*			trans	-131.4	63.2	175.8	-65.2	-37.2	0	0	0	110	V358	V358-H360 HydrophobicContact CG1-CB 4.17Å; V358-H360 PolarHBondContact O-N 3.4Å
361	T	33.8	Very low	38.7	Very low	120 Å²	120	123.4 Å²	123.4	74%	0.736	73%	0.725	S	S	*	*	S	Bend	trans	-148.6	125.6	156.7	-31.6	0	0	0	0	108.4	V363	T361-V363 PolarHBondContact O-N 3.47Å
362	P	36.8	Very low	37.2	Very low	123 Å²	123	128.2 Å²	128.2	80%	0.799	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-61.7	128.7	179.1	-16.9	28.7	0	0	0	110.5
363	V	34.3	Very low	35.9	Very low	126 Å²	126	132.4 Å²	132.4	76%	0.764	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.8	130	175.9	-176.5	0	0	0	0	109.7	T361 V365	T361-V363 PolarHBondContact O-N 3.47Å; V363-V365 PolarHBondContact O-N 3.48Å
364	P	35.9	Very low	35.3	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67.4	127.4	167.2	-10.1	25	0	0	0	109.1	S366	P364-S366 PolarHBondContact O-N 2.79Å
365	V	33	Very low	34.6	Very low	139 Å²	139	145.1 Å²	145.1	84%	0.842	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-52.5	122.5	179.3	179.9	0	0	0	0	110.7	V363 Q367	V363-V365 PolarHBondContact O-N 3.48Å; V365-Q367 PolarHBondContact O-N 2.84Å
366	S	32.8	Very low	34.5	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.7	122.2	172.6	35.3	0	0	0	0	110.7	P364	P364-S366 PolarHBondContact O-N 2.79Å
367	Q	37.6	Very low	34	Very low	184 Å²	184	151.8 Å²	151.8	86%	0.86	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.1	140.9	167.4	-81.8	-179.5	-41.1	0	0	110.4	V365	V365-Q367 PolarHBondContact O-N 2.84Å
368	P	33.6	Very low	33.6	Very low	125 Å²	125	153.9 Å²	153.9	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.5	142.7	-179.6	28.4	-31.3	0	0	0	112.2
369	S	31.9	Very low	33.2	Very low	111 Å²	111	155.1 Å²	155.1	78%	0.776	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.1	178.1	-38	0	0	0	0	112.1
370	P	34.3	Very low	32.5	Very low	125 Å²	125	151.7 Å²	151.7	81%	0.812	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.4	132.9	174	14.4	-7.6	0	0	0	111.2	V372	P370-V372 PolarHBondContact O-N 2.98Å
371	R	31.2	Very low	32.1	Very low	240 Å²	240	149.2 Å²	149.2	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-65.3	123.7	174.8	-67.7	-176.3	176.9	-170.4	-0.7	110.3
372	V	31.4	Very low	31.9	Very low	141 Å²	141	151 Å²	151	86%	0.855	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.6	117.1	170.4	177.2	0	0	0	0	108.7	P370	P370-V372 PolarHBondContact O-N 2.98Å
373	F	28.1	Very low	31.6	Very low	195 Å²	195	150.3 Å²	150.3	86%	0.855	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.7	129.1	165.3	-101.6	-96.9	0	0	0	109.1	E375	F373-E375 PolarHBondContact O-N 3.46Å
374	Q	31.5	Very low	31.3	Very low	202 Å²	202	150.9 Å²	150.9	94%	0.944	81%	0.811	S	S	*	*			trans	-72.1	111.2	167.6	-96.5	171.6	-37.4	0	0	109.1
375	E	26.2	Very low	31.4	Very low	182 Å²	182	150 Å²	150	85%	0.85	81%	0.805	S	S	*	*			trans	-115.6	124.7	162.9	-162.1	158.8	-161.9	0	0	109.4	F373	F373-E375 PolarHBondContact O-N 3.46Å
376	R	32.2	Very low	31.2	Very low	228 Å²	228	151 Å²	151	86%	0.86	80%	0.8	S	S	*	*			trans	-88.4	116.2	-171.5	-172.1	-171.6	-80.9	163.3	-7.9	107.9
377	V	27	Very low	31	Very low	127 Å²	127	155.7 Å²	155.7	77%	0.77	81%	0.807	S	S	*	*			trans	-130.6	121.8	169.3	-177.1	0	0	0	0	110.1
378	H	31.8	Very low	30.5	Very low	171 Å²	171	153.6 Å²	153.6	79%	0.792	80%	0.802	S	S	*	*			trans	-66.8	137.1	178.3	-82.6	-90.2	0	0	0	112
379	V	30.1	Very low	30.4	Very low	140 Å²	140	153.6 Å²	153.6	85%	0.848	81%	0.805	S	S	*	*			trans	-127.9	130.3	163.8	-179.6	0	0	0	0	109.8
380	S	28.3	Very low	30.3	Very low	113 Å²	113	157 Å²	157	79%	0.79	81%	0.811	S	S	*	*			trans	-65.1	145.7	-177.1	-178.5	0	0	0	0	113.3
381	V	32.4	Very low	30.1	Very low	114 Å²	114	159.7 Å²	159.7	69%	0.691	81%	0.813	S	S	*	*			trans	-68.4	139.4	171.7	176.2	0	0	0	0	110.8
382	N	29.9	Very low	30.2	Very low	158 Å²	158	155.6 Å²	155.6	85%	0.845	81%	0.809	S	S	*	*			trans	-147.1	112.8	141.5	-92.6	-15.8	0	0	0	109
383	T	29.6	Very low	30.1	Very low	108 Å²	108	153.6 Å²	153.6	66%	0.663	80%	0.801	S	S	*	*			trans	-26.3	154.5	151.5	28.8	0	0	0	0	115.4
384	L	28.5	Very low	30.4	Very low	138 Å²	138	150.7 Å²	150.7	72%	0.723	79%	0.794	S	S	*	*			cis	-175.8	179.6	6.5	-107.6	153	0	0	0	104.6
385	P	38.9	Very low	30.3	Very low	100 Å²	100	150 Å²	150	65%	0.649	79%	0.792	S	S	*	*			cis	-130.9	168	-8.7	29.4	-6.9	0	0	0	116.1
386	E	28	Very low	30.6	Very low	158 Å²	158	150 Å²	150	74%	0.738	79%	0.791	S	S	*	*			trans	-49.3	145.7	168	-69.2	153.7	131.6	0	0	114.7
387	F	28	Very low	30.5	Very low	209 Å²	209	148.4 Å²	148.4	92%	0.917	79%	0.794	S	S	*	*			trans	-119.7	126.7	147.7	-85.9	-81	0	0	0	108.9
388	N	28.7	Very low	30.5	Very low	140 Å²	140	151.1 Å²	151.1	75%	0.749	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-55	135.3	-172.6	-68.5	-36.8	0	0	0	113.4	M390	N388-M390 PolarHBondContact O-N 2.83Å
389	S	30.1	Very low	30.4	Very low	126 Å²	126	152.1 Å²	152.1	88%	0.881	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-64.9	116.5	153.1	-83.7	0	0	0	0	108
390	M	29.9	Very low	30.4	Very low	182 Å²	182	154.2 Å²	154.2	90%	0.897	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.2	125.3	166.4	-109.3	148.4	174.5	0	0	108.3	N388	N388-M390 PolarHBondContact O-N 2.83Å
391	E	30.7	Very low	30.4	Very low	181 Å²	181	158.4 Å²	158.4	85%	0.846	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-59.7	140.6	178.3	-70.1	165.3	139.6	0	0	111.5	S393	E391-S393 PolarHBondContact O-N 3.19Å
392	D	32	Very low	30.2	Very low	155 Å²	155	156.5 Å²	156.5	83%	0.829	81%	0.814	S	S	*	*			trans	-64.2	113.2	175.1	-146.9	7.2	0	0	0	108.3
393	S	30.9	Very low	30.1	Very low	98 Å²	98	154 Å²	154	69%	0.685	82%	0.816	S	S	*	*			trans	-124.5	100.4	170.7	40.6	0	0	0	0	108.3	E391 Q395	E391-S393 PolarHBondContact O-N 3.19Å; S393-Q395 PolarHBondContact O-N 3.19Å
394	D	34	Very low	30.2	Very low	134 Å²	134	156.5 Å²	156.5	72%	0.717	83%	0.825	S	S	*	*			trans	-62.5	115.7	167.1	-71.8	-50.7	0	0	0	108.6
395	Q	30.2	Very low	30.3	Very low	189 Å²	189	159.5 Å²	159.5	88%	0.883	84%	0.835	S	S	*	*			trans	-94.9	107.3	163.1	-76.1	-177.6	8.2	0	0	107.8	S393	S393-Q395 PolarHBondContact O-N 3.19Å
396	E	31.6	Very low	29.8	Very low	180 Å²	180	163 Å²	163	84%	0.841	84%	0.843	S	S	*	*			trans	-79.5	132.5	166.1	-65.5	-173.8	156	0	0	108.9	E398	E396-E398 PolarHBondContact O-N 3.26Å
397	E	29.7	Very low	29.8	Very low	195 Å²	195	164.5 Å²	164.5	91%	0.911	85%	0.847	S	S	*	*			trans	-74.8	109.5	169.6	-69.8	-178.5	170.3	0	0	108.7
398	E	27.6	Very low	29.8	Very low	184 Å²	184	161.5 Å²	161.5	86%	0.86	84%	0.841	S	S	*	*			trans	-70.1	126.2	170.5	-71.4	179.8	160.9	0	0	110.5	E396	E396-E398 PolarHBondContact O-N 3.26Å
399	Q	28.7	Very low	30	Very low	193 Å²	193	160 Å²	160	90%	0.902	84%	0.836	S	S	*	*			trans	-117.9	115.5	154.5	-83.8	-176.8	-9.6	0	0	108.2
400	E	31.5	Very low	30.2	Very low	184 Å²	184	161.2 Å²	161.2	86%	0.86	83%	0.832	S	S	*	*			trans	-70.9	138.4	170.9	-73.2	-174.2	143	0	0	111.7
401	E	28.5	Very low	30.3	Very low	200 Å²	200	157.1 Å²	157.1	94%	0.935	82%	0.818	S	S	*	*			trans	148.9	122	149.8	-85.8	-176.5	-171.1	0	0	106.1
402	G	26.5	Very low	30.4	Very low	74 Å²	74	154.4 Å²	154.4	76%	0.763	82%	0.816	S	S	*	*			cis	140.6	124.8	20.9	0	0	0	0	0	106.5
403	A	27.8	Very low	30.3	Very low	107 Å²	107	158 Å²	158	88%	0.884	82%	0.82	S	S	*	*			trans	87.6	121.1	169.8	0	0	0	0	0	119.7
404	N	32.3	Very low	30.2	Very low	160 Å²	160	158.7 Å²	158.7	86%	0.856	83%	0.825	S	S	*	*			trans	-46.4	131.7	169.2	-62.1	-37.1	0	0	0	113.7
405	E	31	Very low	30.2	Very low	200 Å²	200	161 Å²	161	94%	0.935	83%	0.831	S	S	*	*			trans	-147.5	153.7	143.9	-78	-157.3	159.8	0	0	111.7
406	E	28.6	Very low	30.1	Very low	174 Å²	174	161.6 Å²	161.6	81%	0.813	83%	0.831	S	S	*	*			trans	-67.8	144.1	-156.1	-168.6	170.9	-178.4	0	0	115.6	N408	E406-N408 PolarHBondContact O-N 3.39Å
407	F	27.8	Very low	30	Very low	189 Å²	189	160.3 Å²	160.3	83%	0.829	83%	0.83	S	S	*	*			trans	-73.7	90.5	-175.5	-151.2	-92.6	0	0	0	110.9	V409	F407-V409 HydrophobicContact CD1-CG2 3.66Å; F407-V409 HydrophobicContact CE1-CG2 3.98Å; F407-V409 PolarHBondContact O-N 3.09Å; F407-V409 VanDerWaalsContact O-N 3.1Å
408	N	28	Very low	30	Very low	147 Å²	147	156.6 Å²	156.6	79%	0.786	83%	0.825	S	S	*	*			trans	-80.2	91.7	172.8	-84.6	-45.5	0	0	0	111.1	E406 I410	E406-N408 PolarHBondContact O-N 3.39Å; N408-I410 PolarHBondContact O-N 3.17Å
409	V	33.3	Very low	30.1	Very low	108 Å²	108	155.3 Å²	155.3	66%	0.655	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-63.2	118.2	164.5	-178.6	0	0	0	0	108.5	F407 P411	F407-V409 HydrophobicContact CD1-CG2 3.66Å; F407-V409 HydrophobicContact CE1-CG2 3.98Å; F407-V409 PolarHBondContact O-N 3.09Å; F407-V409 VanDerWaalsContact O-N 3.1Å; V409-P411 WeakPolarHBondContact O-CD 3.37Å
410	I	34.3	Very low	30.1	Very low	152 Å²	152	153 Å²	153	78%	0.779	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-67.7	119.7	170	-59.1	170	0	0	0	107.7	N408	N408-I410 PolarHBondContact O-N 3.17Å
411	P	32.1	Very low	30.1	Very low	95 Å²	95	152.3 Å²	152.3	62%	0.617	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-75.5	146.8	175.7	24.7	-21.3	0	0	0	110.5	V409 Y413	V409-P411 WeakPolarHBondContact O-CD 3.37Å; P411-Y413 PolarHBondContact O-N 3.31Å
412	P	32.7	Very low	30.3	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.5	134.1	171.5	28.2	-30.8	0	0	0	109.2	S414	P412-S414 PolarHBondContact O-N 2.81Å
413	Y	29.1	Very low	30.2	Very low	231 Å²	231	148.2 Å²	148.2	91%	0.906	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-57.9	124.5	175.7	-87.6	-96.1	0	0	0	110.5	P411	P411-Y413 PolarHBondContact O-N 3.31Å
414	S	29.7	Very low	30.3	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.9	123.1	169.2	-172.3	0	0	0	0	109.2	P412	P412-S414 PolarHBondContact O-N 2.81Å
415	E	32.3	Very low	30.2	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-60.6	140.7	160.7	-70.3	173.3	156	0	0	109
416	K	29.6	Very low	30.1	Very low	202 Å²	202	146.6 Å²	146.6	88%	0.878	81%	0.813	S	S	*	*			trans	-134.7	106.5	167.3	-164.1	170.2	-173.4	173.5	0	108.4
417	D	28.1	Very low	30	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	82%	0.817	S	S	*	*			trans	-59.7	143.4	168.8	-65.3	-50.3	0	0	0	111.4
418	S	31	Very low	30.2	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	82%	0.82	S	S	*	*			trans	-155	96.8	149.5	62.3	0	0	0	0	110.1
419	D	29.8	Very low	30.3	Very low	157 Å²	157	149.5 Å²	149.5	84%	0.84	83%	0.828	S	S	*	*			trans	-76.3	136	146.9	-82.4	-36.8	0	0	0	108.4
420	T	28.9	Very low	30	Very low	144 Å²	144	148.1 Å²	148.1	88%	0.883	84%	0.836	S	S	*	*				175	139	118.9	-52.3	0	0	0	0	110.6
421	E	30.5	Very low	29.7	Very low	170 Å²	170	150.5 Å²	150.5	79%	0.794	84%	0.843	S	S	*	*			trans	-52.3	157.1	-178.8	-111.5	-175.7	98.4	0	0	120.9
422	S	31.9	Very low	29.5	Very low	105 Å²	105	151 Å²	151	73%	0.734	86%	0.856	S	S	*	*			trans	66.9	118.9	133.9	-66	0	0	0	0	121.7
423	G	26.1	Very low	29.4	Very low	83 Å²	83	150.3 Å²	150.3	86%	0.856	85%	0.854	S	S	*	*			trans	-178.1	98.7	162.8	0	0	0	0	0	114.4
424	A	29.7	Very low	29.6	Very low	100 Å²	100	148.4 Å²	148.4	83%	0.826	85%	0.853	S	S	*	*			trans	-74	139.9	174.7	0	0	0	0	0	113.2
425	R	30.2	Very low	29.5	Very low	249 Å²	249	147.8 Å²	147.8	94%	0.94	86%	0.855	S	S	*	*				166.1	126.8	129.1	-97.1	174.5	174.2	-176	-0.7	113.2
426	G	27.4	Very low	29.6	Very low	84 Å²	84	147.4 Å²	147.4	87%	0.866	85%	0.853	S	S	*	*			trans	58.4	108.5	131	0	0	0	0	0	119.7
427	S	27.8	Very low	29.6	Very low	129 Å²	129	145.3 Å²	145.3	90%	0.902	85%	0.851	S	S	*	*			trans	-113.8	110.9	158.3	-160.6	0	0	0	0	110
428	Q	31	Very low	29.7	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	85%	0.848	S	S	*	*			trans	-80.9	156.1	166.9	-81.5	-178.8	-14.9	0	0	110.8
429	R	30.4	Very low	29.8	Very low	253 Å²	253	144.7 Å²	144.7	96%	0.955	85%	0.85	S	S	*	*			trans	-53.9	152.8	170.5	-68.6	171.2	170.4	177.3	-5.3	113
430	G	26.8	Very low	30.4	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	84%	0.843	S	S	*	*			trans	-172	97.9	161.5	0	0	0	0	0	111.2
431	E	29.1	Very low	30.6	Very low	202 Å²	202	143.4 Å²	143.4	94%	0.944	84%	0.843	S	S	*	*			trans	-59.1	149.6	167.4	-72.7	160.8	119.6	0	0	111.9
432	A	28.4	Very low	30.9	Very low	106 Å²	106	143.3 Å²	143.3	88%	0.876	85%	0.847	S	S	*	*			trans	-151.3	126.4	144.1	0	0	0	0	0	110.6
433	S	29	Very low	30.9	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	85%	0.85	S	S	*	*			trans	-80.7	144.1	-168.1	40.7	0	0	0	0	115.8
434	Q	33.8	Very low	31.2	Very low	190 Å²	190	148.8 Å²	148.8	89%	0.888	85%	0.847	S	S	*	*			trans	19.2	138.4	130.3	-87.7	173.7	-34.2	0	0	121.7
435	A	28.7	Very low	32.1	Very low	100 Å²	100	149.8 Å²	149.8	83%	0.826	85%	0.845	S	S	*	*				178	144.2	125.3	0	0	0	0	0	108.6
436	E	32.7	Very low	32.2	Very low	174 Å²	174	141 Å²	141	81%	0.813	83%	0.832	S	S	*	*			cis	-178	-177.9	-18.7	-135.8	-151.3	171.7	0	0	107.4
437	L	29.8	Very low	32.4	Very low	159 Å²	159	144.1 Å²	144.1	83%	0.832	83%	0.828	S	S	*	*			trans	89.8	127.5	168.2	-62	148.6	0	0	0	116.8
438	A	30	Very low	32.7	Very low	92 Å²	92	146.5 Å²	146.5	76%	0.76	82%	0.823	S	S	*	*			cis	-167.3	140.1	-9.9	0	0	0	0	0	107.7
439	L	33.4	Very low	32.9	Very low	163 Å²	163	145.6 Å²	145.6	85%	0.853	82%	0.823	S	S	*	*			trans	-71.4	-177.1	168	-109.9	97.3	0	0	0	111.2
440	P	43	Very low	33.2	Very low	105 Å²	105	141 Å²	141	68%	0.682	82%	0.817	S	S	*	*			cis	-140.9	172.8	8.7	28.2	-4.4	0	0	0	115.4
441	L	33.2	Very low	33.5	Very low	169 Å²	169	149.1 Å²	149.1	89%	0.885	82%	0.823	S	S	*	*			trans	-148	143.2	147.6	-102.9	164.3	0	0	0	110.6
442	L	35.9	Very low	34	Very low	169 Å²	169	147.2 Å²	147.2	89%	0.885	81%	0.814	S	S	*	*			trans	-77.8	162.1	-155.8	-75.7	133.9	0	0	0	116.5
443	L	32.3	Very low	34.4	Very low	152 Å²	152	146.7 Å²	146.7	80%	0.796	80%	0.803	S	S	*	*			trans	-87.2	137.9	177.8	-79.4	161.9	0	0	0	114.5
444	L	32.7	Very low	34.8	Very low	150 Å²	150	152.5 Å²	152.5	79%	0.785	81%	0.809	S	S	*	*			trans	68.4	166.9	139.1	-71.7	166.5	0	0	0	120.9
445	P	47.9	Very low	34.9	Very low	121 Å²	121	149.6 Å²	149.6	79%	0.786	80%	0.799	S	S	*	*			cis	-140.6	-176.5	-17.7	29.4	-5.8	0	0	0	115.9
446	G	32.5	Very low	35.6	Very low	65 Å²	65	155.7 Å²	155.7	67%	0.67	82%	0.818	S	S	*	*			trans	126.4	104.8	151.4	0	0	0	0	0	116.1
447	L	32.3	Very low	35.7	Very low	150 Å²	150	154.8 Å²	154.8	79%	0.785	82%	0.818	S	S	*	*				88.1	119.5	83.1	-77.8	169.6	0	0	0	115.8
448	F	33.2	Very low	36	Very low	179 Å²	179	154.6 Å²	154.6	79%	0.785	82%	0.817	S	S	*	*			trans	55.3	123.8	151.1	-62.7	-67.8	0	0	0	121.1
449	L	35.8	Very low	36.3	Very low	170 Å²	170	158.1 Å²	158.1	89%	0.89	82%	0.821	S	S	*	*				-179.7	131.2	101.1	-90.5	164.1	0	0	0	111.6
450	N	36.4	Very low	36.5	Very low	156 Å²	156	157.8 Å²	157.8	83%	0.834	82%	0.819	S	S	*	*			trans	-60	143.1	159.7	-82.6	-19.2	0	0	0	110.3
451	W	33.1	Very low	36.1	Very low	250 Å²	250	161.1 Å²	161.1	95%	0.947	83%	0.827	S	S	*	*			trans	-149.2	117.9	146.6	-169.3	-90.3	0	0	0	109.8
452	E	39.9	Very low	36.3	Very low	161 Å²	161	160.5 Å²	160.5	75%	0.752	82%	0.823	S	S	*	*			trans	-73.7	172.1	173.1	-69.7	170.1	123.5	0	0	112.3
453	C	36.4	Very low	36.3	Very low	95 Å²	95	159.9 Å²	159.9	64%	0.642	82%	0.819	S	S	*	*			trans	98.9	106.7	154.2	-65.3	0	0	0	0	118.8
454	W	38.7	Very low	36.7	Very low	233 Å²	233	160.5 Å²	160.5	88%	0.883	82%	0.821	S	S	*	*				69.2	132.4	119.8	-70	3.8	0	0	0	116.8
455	N	35.9	Very low	37	Very low	128 Å²	128	161.4 Å²	161.4	68%	0.684	82%	0.824	S	S	*	*			cis	-164	161.1	45.9	-107.5	-19.3	0	0	0	110.4
456	D	41.7	Very low	36	Very low	229 Å²	229	165.1 Å²	165.1	100%	1.225	83%	0.827	S	S	*	*			trans	72.1	0	159.9	-60.8	-26.3	0	0	0	120.7

Retrieved 456 of 456 residues in 77.3 ms (Link to these results)

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