A0A087YB17_POEFO Loading...

Transmembrane protein 267

AlphaFold DB , UniProt , Accession A0A087YB17, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 247 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	35.8	Very low	233 Å²	233	158 Å²	158	100%	1.148	83%	0.831	S	S	*	*				0	120.8	0	-86.5	174.6	158	0	0	108.2
2	Q	33.4	Very low	36.9	Very low	202 Å²	202	155 Å²	155	94%	0.944	83%	0.827	S	S	*	*			trans	53.8	133.3	157.3	-67.3	165.9	-22.4	0	0	118.7
3	G	33.1	Very low	36.5	Very low	66 Å²	66	152.6 Å²	152.6	68%	0.68	83%	0.83	S	S	*	*			cis	-166.4	142.1	5.7	0	0	0	0	0	108.2
4	F	33.3	Very low	36.5	Very low	191 Å²	191	149.3 Å²	149.3	84%	0.838	82%	0.824	S	S	*	*				48.8	102.2	97.5	-97.4	-85.2	0	0	0	115.3
5	Y	41	Very low	36.4	Very low	234 Å²	234	147.5 Å²	147.5	92%	0.918	83%	0.826	S	S	*	*			trans	-143.7	108.3	136	-104.2	-78.7	0	0	0	109.4
6	S	34.8	Very low	36.9	Very low	82 Å²	82	145.2 Å²	145.2	57%	0.573	82%	0.819	S	S	*	*			trans	-86.7	141.9	162.4	48	0	0	0	0	109
7	K	40.8	Very low	36.7	Very low	212 Å²	212	145.9 Å²	145.9	92%	0.922	82%	0.82	S	S	*	*			trans	-133	121.2	150.5	-92.9	-164.2	176.1	-177.2	0	109.2
8	L	38.1	Very low	36.9	Very low	151 Å²	151	146.1 Å²	146.1	79%	0.791	82%	0.817	S	S	*	*			trans	-82.5	159.3	174.1	-75.6	152.5	0	0	0	111.2
9	N	33.6	Very low	36.7	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	82%	0.816	S	S	*	*			trans	138.8	97.7	142.1	-70.5	-7.5	0	0	0	110
10	S	34.2	Very low	37	Very low	101 Å²	101	141.9 Å²	141.9	71%	0.706	82%	0.815	S	S	*	*				78.5	100.2	77	70.3	0	0	0	0	115
11	S	35.7	Very low	36.9	Very low	118 Å²	118	138.5 Å²	138.5	83%	0.825	81%	0.811	S	S	*	*			trans	5.2	-180	144.1	-48.1	0	0	0	0	122.1
12	P	48.8	Very low	37	Very low	122 Å²	122	135.1 Å²	135.1	79%	0.792	80%	0.797	S	S	*	*			cis	-130.4	167.2	-35.4	29.9	-11.2	0	0	0	112.4
13	S	31.8	Very low	37.6	Very low	124 Å²	124	136 Å²	136	87%	0.867	79%	0.792	S	S	*	*			trans	-161.3	140.8	145.6	65.2	0	0	0	0	113.3
14	S	37.2	Very low	38	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	80%	0.796	S	S	*	*			trans	-76.2	147	-176.6	43.2	0	0	0	0	114.4
15	S	35.1	Very low	38.3	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	79%	0.789	S	S	*	*			trans	-156	122.8	142.1	-75.2	0	0	0	0	109.8
16	P	43.9	Very low	38.6	Very low	110 Å²	110	127.8 Å²	127.8	71%	0.714	78%	0.778	S	S	*	*			trans	-90.9	148.8	168.4	35.5	-28.1	0	0	0	109.6
17	L	34	Very low	39.5	Very low	157 Å²	157	128 Å²	128	82%	0.822	78%	0.784	S	S	*	*			trans	167.1	129.2	137.7	-89.7	154.5	0	0	0	112.1
18	L	38.9	Very low	40.2	Very low	149 Å²	149	128.7 Å²	128.7	78%	0.78	78%	0.781	S	S	*	*			trans	66.5	72.6	148.6	-78.3	146.9	0	0	0	118.5	V20	L18-V20 HydrophobicContact CD2-CG2 4.41Å
19	G	33.3	Very low	41.2	Very low	77 Å²	77	126 Å²	126	79%	0.794	77%	0.77	S	S	*	*			trans	-113.1	94.3	147.9	0	0	0	0	0	109.5	G21	G19-G21 PolarHBondContact O-N 3.23Å
20	V	42.7	Very low	43.1	Very low	132 Å²	132	122.2 Å²	122.2	80%	0.8	75%	0.754	S	S	*	*			trans	-66.8	87.3	165.8	173.1	0	0	0	0	106.9	L18 L22	L18-V20 HydrophobicContact CD2-CG2 4.41Å; V20-L22 PolarHBondContact O-N 3.1Å
21	G	35.7	Very low	44.6	Very low	71 Å²	71	124.6 Å²	124.6	73%	0.732	76%	0.758	S	S	*	*			trans	-82.1	105.6	173.6	0	0	0	0	0	109.4	G19	G19-G21 PolarHBondContact O-N 3.23Å
22	L	37.6	Very low	46.3	Very low	161 Å²	161	122.4 Å²	122.4	84%	0.843	74%	0.743	S	S	*	*			trans	-37.2	133.4	169.3	-80.3	125.9	0	0	0	113	V20 A24	V20-L22 PolarHBondContact O-N 3.1Å; L22-A24 PolarHBondContact O-N 2.91Å
23	R	45.3	Very low	47.6	Very low	221 Å²	221	121 Å²	121	83%	0.834	73%	0.728	S	S	*	*			trans	-22.4	105.8	152	-92.9	174.1	158.6	164.6	-0.6	111.9	D25	R23-D25 IonicContact NE-OD2 3.85Å
24	A	43.1	Very low	49.5	Very low	94 Å²	94	116.9 Å²	116.9	78%	0.777	70%	0.702	S	S	*	*			trans	-105.5	76.8	143.1	0	0	0	0	0	106	L22 S26	L22-A24 PolarHBondContact O-N 2.91Å; A24-S26 PolarHBondContact O-N 3.45Å
25	D	39.4	Very low	51.2	Low	128 Å²	128	114.6 Å²	114.6	68%	0.684	68%	0.683	S	S	*	*			trans	-63.8	80.4	153	-83.8	-36.5	0	0	0	105.6	R23 A27	R23-D25 IonicContact NE-OD2 3.85Å; D25-A27 PolarHBondContact O-N 3.1Å
26	S	46.5	Very low	53.1	Low	97 Å²	97	114.2 Å²	114.2	68%	0.678	67%	0.668	S	S	*	*			trans	-59.7	98.2	159.9	175.8	0	0	0	0	104.3	A24 R28	A24-S26 PolarHBondContact O-N 3.45Å; S26-R28 PolarHBondContact O-N 2.87Å
27	A	52.8	Low	54.4	Low	87 Å²	87	111.7 Å²	111.7	72%	0.719	66%	0.657	S	S	*	*			trans	-57.9	91.1	171.3	0	0	0	0	0	106.5	D25 V29	D25-A27 PolarHBondContact O-N 3.1Å; A27-V29 VanDerWaalsContact C-N 3.27Å; A27-V29 PolarHBondContact O-N 3.42Å
28	R	56.4	Low	56.1	Low	226 Å²	226	110 Å²	110	85%	0.853	65%	0.645	S	S	*	*			trans	-61.3	100.3	168.8	-73.7	-176.6	-176.6	173	1.6	104.8	S26 P30	S26-R28 PolarHBondContact O-N 2.87Å; R28-P30 WeakPolarHBondContact O-CD 3.38Å; R28-P30 VanDerWaalsContact O-N 3.12Å
29	V	60.1	Low	57.4	Low	93 Å²	93	107.9 Å²	107.9	56%	0.564	63%	0.629	S	S	*	*			trans	-50.4	123.2	169.2	177.6	0	0	0	0	105.7	A27 L31 L33 A34	A27-V29 VanDerWaalsContact C-N 3.27Å; A27-V29 PolarHBondContact O-N 3.42Å; V29-L31 PolarHBondContact O-N 2.95Å; V29-L33 HydrophobicContact CG1-CB 3.83Å; V29-A34 HydrophobicContact CG1-CB 4.09Å
30	P	71.8	Confident	58.9	Low	70 Å²	70	106.5 Å²	106.5	46%	0.455	61%	0.61	S	S	.	*			trans	-48.9	131	176.2	-26.7	32.3	0	0	0	108.9	R28 S32 L33 A34	R28-P30 WeakPolarHBondContact O-CD 3.38Å; R28-P30 VanDerWaalsContact O-N 3.12Å; P30-S32 PolarHBondContact O-N 3.26Å; P30-L33 HydrophobicContact CB-CB 4.43Å; P30-L33 HydrophobicContact CB-CD1 4.35Å; P30-L33 HydrophobicContact CB-CG 4.32Å; P30-L33 HydrophobicContact CG-CD1 3.87Å; P30-L33 HydrophobicContact CG-CG 4.39Å; P30-L33 WeakPolarHBondContact O-CA 3.45Å; P30-L33 PolarHBondContact O-N 2.88Å; P30-A34 PolarHBondContact O-N 3.3Å; P30-A34 VanDerWaalsContact O-N 3.08Å
31	L	66.5	Low	60.1	Low	150 Å²	150	106.2 Å²	106.2	79%	0.785	60%	0.6	S	S	*	*	H	α-helix	trans	-50.6	-31.7	-177	-170.8	72.5	0	0	0	111.9	V29 V35	V29-L31 PolarHBondContact O-N 2.95Å; L31-V35 WeakPolarHBondContact O-CB 3.34Å; L31-V35 WeakPolarHBondContact O-CG2 3.34Å; L31-V35 PolarHBondContact O-N 3.13Å
32	S	71.7	Confident	61.5	Low	73 Å²	73	104.2 Å²	104.2	51%	0.51	58%	0.576	S	S	.	*	H	α-helix	trans	-65.6	-42.3	174.3	66.7	0	0	0	0	113.6	P30 V35 E36	P30-S32 PolarHBondContact O-N 3.26Å; S32-V35 PolarHBondContact O-N 3.47Å; S32-E36 WeakPolarHBondContact O-CB 3.49Å; S32-E36 VanDerWaalsContact O-CG 3.28Å; S32-E36 WeakPolarHBondContact O-CG 3.2Å; S32-E36 PolarHBondContact O-N 3.41Å
33	L	76.1	Confident	62.9	Low	92 Å²	92	99.4 Å²	99.4	48%	0.482	55%	0.551	S	S	.	*	H	α-helix	trans	-71.2	-35	178.3	-72.5	179	0	0	0	111.7	V29 P30 E36 A37	V29-L33 HydrophobicContact CG1-CB 3.83Å; P30-L33 HydrophobicContact CB-CB 4.43Å; P30-L33 HydrophobicContact CB-CD1 4.35Å; P30-L33 HydrophobicContact CB-CG 4.32Å; P30-L33 HydrophobicContact CG-CD1 3.87Å; P30-L33 HydrophobicContact CG-CG 4.39Å; P30-L33 WeakPolarHBondContact O-CA 3.45Å; P30-L33 PolarHBondContact O-N 2.88Å; L33-E36 PolarHBondContact O-N 3.18Å; L33-A37 VanDerWaalsContact O-CB 3.28Å; L33-A37 WeakPolarHBondContact O-CB 3.48Å; L33-A37 PolarHBondContact O-N 3.04Å
34	A	71.1	Confident	63.9	Low	37 Å²	37	94.9 Å²	94.9	31%	0.306	54%	0.543	S	S	.	.	H	α-helix	trans	-65.3	-46.2	173.4	0	0	0	0	0	111.2	V29 P30 A37 E38	V29-A34 HydrophobicContact CG1-CB 4.09Å; P30-A34 PolarHBondContact O-N 3.3Å; P30-A34 VanDerWaalsContact O-N 3.08Å; A34-A37 PolarHBondContact O-N 2.96Å; A34-E38 PolarHBondContact O-N 3.29Å
35	V	72.9	Confident	65	Low	59 Å²	59	95.5 Å²	95.5	36%	0.358	53%	0.529	S	S	.	.	H	α-helix	trans	-58.9	-50.1	173.8	167.7	0	0	0	0	110.2	L31 S32 A37 E38 K39	L31-V35 WeakPolarHBondContact O-CB 3.34Å; L31-V35 WeakPolarHBondContact O-CG2 3.34Å; L31-V35 PolarHBondContact O-N 3.13Å; S32-V35 PolarHBondContact O-N 3.47Å; V35-A37 VanDerWaalsContact C-N 3.32Å; V35-A37 PolarHBondContact O-N 3.19Å; V35-E38 WeakPolarHBondContact O-CB 3.48Å; V35-E38 PolarHBondContact O-N 2.85Å; V35-K39 HydrophobicContact CG1-CD 4.4Å; V35-K39 HydrophobicContact CG1-CG 4.24Å; V35-K39 WeakPolarHBondContact O-CG 3.39Å; V35-K39 PolarHBondContact O-N 2.92Å
36	E	75.2	Confident	66.4	Low	114 Å²	114	89.6 Å²	89.6	53%	0.533	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-37.6	178.2	-76.8	174.4	-178.5	0	0	113.5	S32 L33 K39 A40	S32-E36 WeakPolarHBondContact O-CB 3.49Å; S32-E36 VanDerWaalsContact O-CG 3.28Å; S32-E36 WeakPolarHBondContact O-CG 3.2Å; S32-E36 PolarHBondContact O-N 3.41Å; L33-E36 PolarHBondContact O-N 3.18Å; E36-K39 WeakPolarHBondContact O-CB 3.37Å; E36-K39 PolarHBondContact O-N 3.29Å; E36-A40 WeakPolarHBondContact O-CB 3.48Å; E36-A40 PolarHBondContact O-N 3.47Å
37	A	71.5	Confident	68	Low	58 Å²	58	89.8 Å²	89.8	48%	0.479	49%	0.487	S	S	.	.	H	α-helix	trans	-65.9	-42.8	174.6	0	0	0	0	0	111.9	L33 A34 V35 K39 A40 Q41	L33-A37 VanDerWaalsContact O-CB 3.28Å; L33-A37 WeakPolarHBondContact O-CB 3.48Å; L33-A37 PolarHBondContact O-N 3.04Å; A34-A37 PolarHBondContact O-N 2.96Å; V35-A37 VanDerWaalsContact C-N 3.32Å; V35-A37 PolarHBondContact O-N 3.19Å; A37-K39 VanDerWaalsContact C-N 3.32Å; A37-K39 PolarHBondContact O-N 3.02Å; A37-A40 PolarHBondContact O-N 3.22Å; A37-Q41 WeakPolarHBondContact O-CB 3.41Å; A37-Q41 PolarHBondContact O-N 3.22Å
38	E	69.5	Low	69.7	Low	122 Å²	122	87.5 Å²	87.5	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-61.5	-40.9	172.5	-72.9	-177.9	164	0	0	111.5	A34 V35 Q41 A42	A34-E38 PolarHBondContact O-N 3.29Å; V35-E38 WeakPolarHBondContact O-CB 3.48Å; V35-E38 PolarHBondContact O-N 2.85Å; E38-Q41 PolarHBondContact O-N 3.36Å; E38-A42 WeakPolarHBondContact O-CB 3.11Å; E38-A42 PolarHBondContact O-N 3.49Å
39	K	66.6	Low	71.2	Confident	103 Å²	103	81.8 Å²	81.8	45%	0.448	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-48.5	174.8	-57.9	-150.2	170	156.1	0	111.4	V35 E36 A37 Q41 A42 L43 Y229	V35-K39 HydrophobicContact CG1-CD 4.4Å; V35-K39 HydrophobicContact CG1-CG 4.24Å; V35-K39 WeakPolarHBondContact O-CG 3.39Å; V35-K39 PolarHBondContact O-N 2.92Å; E36-K39 WeakPolarHBondContact O-CB 3.37Å; E36-K39 PolarHBondContact O-N 3.29Å; A37-K39 VanDerWaalsContact C-N 3.32Å; A37-K39 PolarHBondContact O-N 3.02Å; K39-Q41 VanDerWaalsContact C-N 3.35Å; K39-A42 PolarHBondContact O-N 2.71Å; K39-L43 WeakPolarHBondContact O-CG 3.26Å; K39-L43 PolarHBondContact O-N 3.4Å; K39-L43 VanDerWaalsContact O-N 3.07Å; K39-Y229 WeakPolarHBondContact CA-OH 3.27Å; K39-Y229 WeakPolarHBondContact CB-OH 3.49Å; K39-Y229 WeakPolarHBondContact CD-OH 3.45Å; K39-Y229 WeakPolarHBondContact CG-OH 3.22Å
40	A	65.4	Low	72.6	Confident	48 Å²	48	80.9 Å²	80.9	40%	0.397	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-42.1	178.9	0	0	0	0	0	111.2	E36 A37 L43 L44	E36-A40 WeakPolarHBondContact O-CB 3.48Å; E36-A40 PolarHBondContact O-N 3.47Å; A37-A40 PolarHBondContact O-N 3.22Å; A40-L43 PolarHBondContact O-N 3.08Å; A40-L44 WeakPolarHBondContact O-CB 3.25Å; A40-L44 VanDerWaalsContact O-CG 3.28Å; A40-L44 WeakPolarHBondContact O-CG 3.47Å; A40-L44 PolarHBondContact O-N 3Å
41	Q	67.1	Low	73.5	Confident	127 Å²	127	78.2 Å²	78.2	59%	0.593	45%	0.446	S	S	*	.	H	α-helix	trans	-66.9	-40.3	178.7	-171.5	155.6	-37.9	0	0	112.4	A37 E38 K39 L43 L44 Q45	A37-Q41 WeakPolarHBondContact O-CB 3.41Å; A37-Q41 PolarHBondContact O-N 3.22Å; E38-Q41 PolarHBondContact O-N 3.36Å; K39-Q41 VanDerWaalsContact C-N 3.35Å; Q41-L43 VanDerWaalsContact C-N 3.35Å; Q41-L43 PolarHBondContact O-N 2.9Å; Q41-L44 PolarHBondContact O-N 2.73Å; Q41-Q45 VanDerWaalsContact O-CG 3.28Å; Q41-Q45 WeakPolarHBondContact O-CG 3.45Å; Q41-Q45 PolarHBondContact O-N 3.25Å
42	A	64.6	Low	74.8	Confident	28 Å²	28	75.2 Å²	75.2	23%	0.231	43%	0.43	C	S	.	.	H	α-helix	trans	-65.1	-36.5	174.8	0	0	0	0	0	112.8	E38 K39 T46 Y229	E38-A42 WeakPolarHBondContact O-CB 3.11Å; E38-A42 PolarHBondContact O-N 3.49Å; K39-A42 PolarHBondContact O-N 2.71Å; A42-T46 PolarHBondContact O-N 2.88Å; A42-T46 PolarHBondContact O-OG1 3.43Å; A42-T46 VanDerWaalsContact O-OG1 3.11Å; A42-Y229 HydrophobicContact CB-CD2 4.31Å; A42-Y229 HydrophobicContact CB-CE2 4.01Å
43	L	66.8	Low	76	Confident	61 Å²	61	78 Å²	78	32%	0.319	44%	0.438	S	S	.	.	H	α-helix	trans	-67.2	-45.4	171.9	-72.3	173.4	0	0	0	111.2	K39 A40 Q41 Q45 T46 F47 V226 Y229	K39-L43 WeakPolarHBondContact O-CG 3.26Å; K39-L43 PolarHBondContact O-N 3.4Å; K39-L43 VanDerWaalsContact O-N 3.07Å; A40-L43 PolarHBondContact O-N 3.08Å; Q41-L43 VanDerWaalsContact C-N 3.35Å; Q41-L43 PolarHBondContact O-N 2.9Å; L43-Q45 VanDerWaalsContact C-N 3.28Å; L43-Q45 PolarHBondContact O-N 2.95Å; L43-T46 WeakPolarHBondContact O-CA 3.49Å; L43-T46 WeakPolarHBondContact O-CB 3.39Å; L43-T46 PolarHBondContact O-N 3.28Å; L43-F47 VanDerWaalsContact O-CD2 3.28Å; L43-F47 WeakPolarHBondContact O-CD2 3.47Å; L43-F47 PolarHBondContact O-N 3.28Å; L43-V226 HydrophobicContact CD2-CG2 4.2Å; L43-Y229 HydrophobicContact CD2-CD1 3.93Å; L43-Y229 HydrophobicContact CD2-CE1 4.32Å; L43-Y229 HydrophobicContact CG-CD1 4.36Å; L43-Y229 HydrophobicContact CG-CE1 4.28Å
44	L	65.9	Low	76.9	Confident	125 Å²	125	75 Å²	75	65%	0.654	43%	0.427	S	S	*	.	H	α-helix	trans	-60.2	-37.9	176.2	-72.8	170.3	0	0	0	112.2	A40 Q41 T46 F47 S48	A40-L44 WeakPolarHBondContact O-CB 3.25Å; A40-L44 VanDerWaalsContact O-CG 3.28Å; A40-L44 WeakPolarHBondContact O-CG 3.47Å; A40-L44 PolarHBondContact O-N 3Å; Q41-L44 PolarHBondContact O-N 2.73Å; L44-T46 VanDerWaalsContact C-N 3.26Å; L44-T46 PolarHBondContact O-N 3.02Å; L44-F47 CarbonylContact O-C 3.24Å; L44-F47 VanDerWaalsContact O-C 3.24Å; L44-F47 PolarHBondContact O-N 3.24Å; L44-S48 PolarHBondContact O-N 2.86Å; L44-S48 VanDerWaalsContact O-N 3.11Å
45	Q	66.6	Low	78.2	Confident	107 Å²	107	73.5 Å²	73.5	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-63.2	-31.5	173.5	-73	-71.3	-32.4	0	0	112.5	Q41 L43 F47 S48	Q41-Q45 VanDerWaalsContact O-CG 3.28Å; Q41-Q45 WeakPolarHBondContact O-CG 3.45Å; Q41-Q45 PolarHBondContact O-N 3.25Å; L43-Q45 VanDerWaalsContact C-N 3.28Å; L43-Q45 PolarHBondContact O-N 2.95Å; Q45-F47 PolarHBondContact O-N 2.66Å; Q45-S48 PolarHBondContact O-N 3.03Å
46	T	69.1	Low	79.3	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-65.7	-30.8	173.5	-58	0	0	0	0	112	A42 L43 L44 S51 H222 S225 V226 R234	A42-T46 PolarHBondContact O-N 2.88Å; A42-T46 PolarHBondContact O-OG1 3.43Å; A42-T46 VanDerWaalsContact O-OG1 3.11Å; L43-T46 WeakPolarHBondContact O-CA 3.49Å; L43-T46 WeakPolarHBondContact O-CB 3.39Å; L43-T46 PolarHBondContact O-N 3.28Å; L44-T46 VanDerWaalsContact C-N 3.26Å; L44-T46 PolarHBondContact O-N 3.02Å; T46-S51 PolarHBondContact O-OG 3.4Å; T46-H222 PolarHBondContact O-CE1 2.86Å; T46-H222 PolarHBondContact O-ND1 3.44Å; T46-S225 WeakPolarHBondContact CG2-OG 3.23Å; T46-S225 PolarHBondContact OG1-OG 3.07Å; T46-S225 VanDerWaalsContact OG1-OG 3.08Å; T46-V226 HydrophobicContact CG2-CG2 4.38Å; T46-R234 PolarHBondContact OG1-NH2 3.22Å
47	F	81.1	Confident	80.4	Confident	101 Å²	101	69.1 Å²	69.1	44%	0.443	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	30	-179.5	-62.3	-76.5	0	0	0	112.9	L43 L44 Q45 L52 H222 V226	L43-F47 VanDerWaalsContact O-CD2 3.28Å; L43-F47 WeakPolarHBondContact O-CD2 3.47Å; L43-F47 PolarHBondContact O-N 3.28Å; L44-F47 CarbonylContact O-C 3.24Å; L44-F47 VanDerWaalsContact O-C 3.24Å; L44-F47 PolarHBondContact O-N 3.24Å; Q45-F47 PolarHBondContact O-N 2.66Å; F47-L52 HydrophobicContact CD1-CD2 4.28Å; F47-H222 HydrophobicContact CD1-CB 4.46Å; F47-H222 HydrophobicContact CE1-CB 3.76Å; F47-H222 HydrophobicContact CZ-CB 4.26Å; F47-V226 HydrophobicContact CE2-CG2 4.05Å; F47-V226 HydrophobicContact CZ-CG2 4.08Å
48	S	86.9	Confident	81.7	Confident	38 Å²	38	66.4 Å²	66.4	27%	0.266	38%	0.384	S	S	.	.			trans	-54.5	151.8	172.9	73.3	0	0	0	0	111.7	L44 Q45 A50 S51 L52	L44-S48 PolarHBondContact O-N 2.86Å; L44-S48 VanDerWaalsContact O-N 3.11Å; Q45-S48 PolarHBondContact O-N 3.03Å; S48-A50 PolarHBondContact O-N 3.3Å; S48-A50 VanDerWaalsContact O-N 3.17Å; S48-S51 PolarHBondContact N-OG 3.31Å; S48-S51 VanDerWaalsContact N-OG 3.13Å; S48-S51 PolarHBondContact O-N 3.07Å; S48-S51 VanDerWaalsContact O-N 3.09Å; S48-S51 PolarHBondContact O-OG 3.25Å; S48-S51 WeakPolarHBondContact OG-CB 3.32Å; S48-S51 PolarHBondContact OG-N 2.89Å; S48-S51 PolarHBondContact OG-OG 3.05Å; S48-L52 WeakPolarHBondContact O-CG 3.17Å; S48-L52 PolarHBondContact O-N 2.89Å
49	S	88.1	Confident	83.1	Confident	106 Å²	106	60.9 Å²	60.9	74%	0.741	36%	0.36	S	S	*	.	H	α-helix	trans	-57	-34.2	176.3	-50.5	0	0	0	0	112.4	L53	S49-L53 VanDerWaalsContact O-CB 3.3Å; S49-L53 WeakPolarHBondContact O-CB 3.48Å; S49-L53 PolarHBondContact O-N 2.89Å
50	A	89.4	Confident	84.6	Confident	74 Å²	74	60.5 Å²	60.5	61%	0.612	37%	0.366	S	S	*	.	H	α-helix	trans	-67.5	-43.7	176.4	0	0	0	0	0	112.4	S48 L53 A54	S48-A50 PolarHBondContact O-N 3.3Å; S48-A50 VanDerWaalsContact O-N 3.17Å; A50-L53 PolarHBondContact O-N 2.87Å; A50-A54 VanDerWaalsContact O-CB 3.29Å; A50-A54 WeakPolarHBondContact O-CB 3.41Å; A50-A54 PolarHBondContact O-N 2.76Å
51	S	91.4	Very high	86.2	Confident	15 Å²	15	60.6 Å²	60.6	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-38.2	177.3	61.8	0	0	0	0	111.7	T46 S48 A54 S55	T46-S51 PolarHBondContact O-OG 3.4Å; S48-S51 PolarHBondContact N-OG 3.31Å; S48-S51 VanDerWaalsContact N-OG 3.13Å; S48-S51 PolarHBondContact O-N 3.07Å; S48-S51 VanDerWaalsContact O-N 3.09Å; S48-S51 PolarHBondContact O-OG 3.25Å; S48-S51 WeakPolarHBondContact OG-CB 3.32Å; S48-S51 PolarHBondContact OG-N 2.89Å; S48-S51 PolarHBondContact OG-OG 3.05Å; S51-A54 PolarHBondContact O-N 2.98Å; S51-S55 WeakPolarHBondContact O-CB 3.35Å; S51-S55 PolarHBondContact O-N 3.42Å; S51-S55 PolarHBondContact O-OG 3.3Å; S51-S55 VanDerWaalsContact O-OG 3.09Å
52	L	94.3	Very high	87.7	Confident	86 Å²	86	54.5 Å²	54.5	45%	0.45	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-44.1	173.7	-68.7	174.5	0	0	0	112.2	F47 S48 S55 A56	F47-L52 HydrophobicContact CD1-CD2 4.28Å; S48-L52 WeakPolarHBondContact O-CG 3.17Å; S48-L52 PolarHBondContact O-N 2.89Å; L52-S55 PolarHBondContact O-N 3.46Å; L52-A56 WeakPolarHBondContact O-CB 3.35Å; L52-A56 PolarHBondContact O-N 3.3Å
53	L	96.1	Very high	89.3	Confident	131 Å²	131	55.6 Å²	55.6	69%	0.686	33%	0.332	S	S	*	.	H	α-helix	trans	-64	-41.7	175.7	-178.1	64.3	0	0	0	111.4	S49 A50 S55 A56 G57	S49-L53 VanDerWaalsContact O-CB 3.3Å; S49-L53 WeakPolarHBondContact O-CB 3.48Å; S49-L53 PolarHBondContact O-N 2.89Å; A50-L53 PolarHBondContact O-N 2.87Å; L53-S55 VanDerWaalsContact C-N 3.35Å; L53-A56 PolarHBondContact O-N 3.48Å; L53-G57 PolarHBondContact O-N 3.22Å
54	A	96.1	Very high	90.8	Very high	30 Å²	30	57 Å²	57	25%	0.248	34%	0.343	C	S	.	.	H	α-helix	trans	-62.9	-40.8	176.3	0	0	0	0	0	111.9	A50 S51 G57 L58 W95 V99	A50-A54 VanDerWaalsContact O-CB 3.29Å; A50-A54 WeakPolarHBondContact O-CB 3.41Å; A50-A54 PolarHBondContact O-N 2.76Å; S51-A54 PolarHBondContact O-N 2.98Å; A54-G57 PolarHBondContact O-N 3.48Å; A54-L58 PolarHBondContact O-N 2.91Å; A54-W95 PolarHBondContact O-NE1 2.7Å; A54-V99 HydrophobicContact CB-CG2 3.84Å
55	S	96.8	Very high	92.4	Very high	6 Å²	6	51.6 Å²	51.6	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-38.9	174.9	-69.9	0	0	0	0	113.2	S51 L52 L53 G57 L58 G59 A218 H222	S51-S55 WeakPolarHBondContact O-CB 3.35Å; S51-S55 PolarHBondContact O-N 3.42Å; S51-S55 PolarHBondContact O-OG 3.3Å; S51-S55 VanDerWaalsContact O-OG 3.09Å; L52-S55 PolarHBondContact O-N 3.46Å; L53-S55 VanDerWaalsContact C-N 3.35Å; S55-G57 VanDerWaalsContact C-N 3.34Å; S55-L58 WeakPolarHBondContact O-CB 3.27Å; S55-L58 PolarHBondContact O-N 2.75Å; S55-G59 PolarHBondContact O-N 2.95Å; S55-A218 VanDerWaalsContact CB-O 3.3Å; S55-A218 WeakPolarHBondContact CB-O 3.43Å; S55-A218 PolarHBondContact OG-O 2.81Å; S55-H222 WeakPolarHBondContact CB-NE2 3.25Å; S55-H222 PolarHBondContact OG-CD2 3.34Å; S55-H222 PolarHBondContact OG-NE2 2.86Å
56	A	97.6	Very high	93.8	Very high	57 Å²	57	47.3 Å²	47.3	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-43.4	171.7	0	0	0	0	0	111	L52 L53 L58 G59 V60	L52-A56 WeakPolarHBondContact O-CB 3.35Å; L52-A56 PolarHBondContact O-N 3.3Å; L53-A56 PolarHBondContact O-N 3.48Å; A56-L58 VanDerWaalsContact C-N 3.33Å; A56-L58 PolarHBondContact O-N 3.45Å; A56-G59 PolarHBondContact O-N 3.18Å; A56-V60 WeakPolarHBondContact O-CG2 3.44Å; A56-V60 PolarHBondContact O-N 3.06Å
57	G	98.4	Very high	95.2	Very high	24 Å²	24	52.2 Å²	52.2	25%	0.247	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-40.6	173.8	0	0	0	0	0	113	L53 A54 S55 V60 F61	L53-G57 PolarHBondContact O-N 3.22Å; A54-G57 PolarHBondContact O-N 3.48Å; S55-G57 VanDerWaalsContact C-N 3.34Å; G57-V60 PolarHBondContact O-N 2.81Å; G57-F61 WeakPolarHBondContact O-CB 3.31Å; G57-F61 PolarHBondContact O-N 3.27Å
58	L	98.6	Very high	96	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-44.7	173.3	176.4	59.3	0	0	0	111.6	A54 S55 A56 F61 C62 V92 W95 S96 T217 P221	A54-L58 PolarHBondContact O-N 2.91Å; S55-L58 WeakPolarHBondContact O-CB 3.27Å; S55-L58 PolarHBondContact O-N 2.75Å; A56-L58 VanDerWaalsContact C-N 3.33Å; A56-L58 PolarHBondContact O-N 3.45Å; L58-F61 WeakPolarHBondContact O-CB 3.27Å; L58-F61 PolarHBondContact O-N 3.36Å; L58-C62 PolarHBondContact O-N 2.97Å; L58-C62 PolarHBondContact O-SG 3.36Å; L58-C62 VanDerWaalsContact O-SG 3.34Å; L58-V92 HydrophobicContact CD1-CG1 4.36Å; L58-V92 HydrophobicContact CD1-CG2 4.32Å; L58-W95 HydrophobicContact CB-CD2 4.39Å; L58-W95 HydrophobicContact CB-CG 4.47Å; L58-W95 HydrophobicContact CD1-CB 4Å; L58-W95 HydrophobicContact CD1-CD2 4.17Å; L58-W95 HydrophobicContact CD1-CE3 4.29Å; L58-W95 HydrophobicContact CD1-CG 4.05Å; L58-S96 WeakPolarHBondContact CD2-OG 3.39Å; L58-T217 HydrophobicContact CD2-CG2 4.23Å; L58-T217 HydrophobicContact CG-CG2 4.27Å; L58-P221 HydrophobicContact CD2-CG 4.32Å
59	G	98.3	Very high	96.5	Very high	7 Å²	7	47.7 Å²	47.7	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-43.4	174.9	0	0	0	0	0	112.9	S55 A56 C62 V63	S55-G59 PolarHBondContact O-N 2.95Å; A56-G59 PolarHBondContact O-N 3.18Å; G59-C62 WeakPolarHBondContact O-CB 3.48Å; G59-C62 PolarHBondContact O-N 3.34Å; G59-V63 WeakPolarHBondContact O-CG2 3.37Å; G59-V63 PolarHBondContact O-N 3.42Å
60	V	98.6	Very high	96.9	Very high	94 Å²	94	48.7 Å²	48.7	57%	0.57	30%	0.295	S	S	*	.	H	α-helix	trans	-63	-42.7	174.7	172.8	0	0	0	0	111.1	A56 G57 C62 V63 V64	A56-V60 WeakPolarHBondContact O-CG2 3.44Å; A56-V60 PolarHBondContact O-N 3.06Å; G57-V60 PolarHBondContact O-N 2.81Å; V60-C62 VanDerWaalsContact C-N 3.34Å; V60-C62 PolarHBondContact O-N 3.46Å; V60-V63 PolarHBondContact O-N 3.33Å; V60-V64 HydrophobicContact CG1-CG2 4.26Å; V60-V64 WeakPolarHBondContact O-CG2 3.38Å; V60-V64 PolarHBondContact O-N 2.92Å
61	F	98.7	Very high	97.2	Very high	50 Å²	50	50.1 Å²	50.1	22%	0.219	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-45.9	176.4	170.3	-99.2	0	0	0	111.5	G57 L58 V63 V64 A65 T88 L91 V92 W95	G57-F61 WeakPolarHBondContact O-CB 3.31Å; G57-F61 PolarHBondContact O-N 3.27Å; L58-F61 WeakPolarHBondContact O-CB 3.27Å; L58-F61 PolarHBondContact O-N 3.36Å; F61-V63 VanDerWaalsContact C-N 3.33Å; F61-V63 PolarHBondContact O-N 3.49Å; F61-V64 PolarHBondContact O-N 3.49Å; F61-A65 HydrophobicContact CE1-CB 4.34Å; F61-A65 HydrophobicContact CE2-CB 4.33Å; F61-A65 HydrophobicContact CZ-CB 4.13Å; F61-A65 VanDerWaalsContact O-CB 3.22Å; F61-A65 WeakPolarHBondContact O-CB 3.38Å; F61-A65 PolarHBondContact O-N 3.12Å; F61-T88 HydrophobicContact CE1-CG2 4.27Å; F61-L91 HydrophobicContact CE1-CB 4.04Å; F61-L91 HydrophobicContact CE2-CD1 4.34Å; F61-L91 HydrophobicContact CZ-CB 3.89Å; F61-L91 HydrophobicContact CZ-CD1 3.78Å; F61-V92 HydrophobicContact CD1-CG2 4.25Å; F61-V92 HydrophobicContact CE1-CG2 4Å; F61-W95 HydrophobicContact CB-CE3 4.35Å; F61-W95 HydrophobicContact CB-CH2 4.26Å; F61-W95 HydrophobicContact CB-CZ3 3.68Å; F61-W95 HydrophobicContact CD1-CE3 4.39Å; F61-W95 HydrophobicContact CD1-CZ3 4.4Å; F61-W95 HydrophobicContact CD2-CZ3 4.1Å; F61-W95 HydrophobicContact CG-CE3 4.23Å; F61-W95 AromaticContact CG-CZ3 3.79Å; F61-W95 HydrophobicContact CG-CZ3 3.79Å
62	C	98.4	Very high	97.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-53	-49.8	174.6	-75.7	0	0	0	0	112.1	L58 G59 V60 A65 D66 Y213	L58-C62 PolarHBondContact O-N 2.97Å; L58-C62 PolarHBondContact O-SG 3.36Å; L58-C62 VanDerWaalsContact O-SG 3.34Å; G59-C62 WeakPolarHBondContact O-CB 3.48Å; G59-C62 PolarHBondContact O-N 3.34Å; V60-C62 VanDerWaalsContact C-N 3.34Å; V60-C62 PolarHBondContact O-N 3.46Å; C62-A65 PolarHBondContact O-N 3.24Å; C62-D66 WeakPolarHBondContact O-CB 3.11Å; C62-D66 VanDerWaalsContact O-CG 3.24Å; C62-D66 PolarHBondContact O-N 3.09Å; C62-Y213 HydrophobicContact CB-CE1 4.3Å; C62-Y213 WeakPolarHBondContact CB-OH 3.45Å; C62-Y213 PolarHBondContact SG-OH 2.85Å
63	V	98.5	Very high	97.5	Very high	50 Å²	50	52.5 Å²	52.5	30%	0.303	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-49.3	178.2	175.1	0	0	0	0	111.6	G59 V60 F61 H67 Y210 V214	G59-V63 WeakPolarHBondContact O-CG2 3.37Å; G59-V63 PolarHBondContact O-N 3.42Å; V60-V63 PolarHBondContact O-N 3.33Å; F61-V63 VanDerWaalsContact C-N 3.33Å; F61-V63 PolarHBondContact O-N 3.49Å; V63-H67 WeakPolarHBondContact O-CB 3.22Å; V63-H67 PolarHBondContact O-CD2 3.39Å; V63-H67 PolarHBondContact O-N 3.49Å; V63-H67 VanDerWaalsContact O-N 3.08Å; V63-Y210 WeakPolarHBondContact CA-OH 3.44Å; V63-Y210 HydrophobicContact CG2-CE1 4.22Å; V63-V214 HydrophobicContact CG2-CG1 4.27Å; V63-V214 HydrophobicContact CG2-CG2 4.02Å
64	V	98.5	Very high	97.5	Very high	90 Å²	90	47.3 Å²	47.3	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-45.4	-178.7	172.9	0	0	0	0	111.5	V60 F61 H67 A68	V60-V64 HydrophobicContact CG1-CG2 4.26Å; V60-V64 WeakPolarHBondContact O-CG2 3.38Å; V60-V64 PolarHBondContact O-N 2.92Å; F61-V64 PolarHBondContact O-N 3.49Å; V64-H67 PolarHBondContact O-N 3.49Å; V64-A68 WeakPolarHBondContact O-CB 3.45Å; V64-A68 PolarHBondContact O-N 2.92Å
65	A	98.2	Very high	97.5	Very high	12 Å²	12	49.4 Å²	49.4	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-178.8	0	0	0	0	0	111.6	F61 C62 A68 L69 T88	F61-A65 HydrophobicContact CE1-CB 4.34Å; F61-A65 HydrophobicContact CE2-CB 4.33Å; F61-A65 HydrophobicContact CZ-CB 4.13Å; F61-A65 VanDerWaalsContact O-CB 3.22Å; F61-A65 WeakPolarHBondContact O-CB 3.38Å; F61-A65 PolarHBondContact O-N 3.12Å; C62-A65 PolarHBondContact O-N 3.24Å; A65-A68 PolarHBondContact O-N 3.39Å; A65-L69 WeakPolarHBondContact O-CG 3.27Å; A65-L69 PolarHBondContact O-N 3.14Å; A65-T88 HydrophobicContact CB-CG2 3.83Å
66	D	97.7	Very high	97.5	Very high	17 Å²	17	56.3 Å²	56.3	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-67.2	-39.4	178.1	-70.5	-20.6	0	0	0	112.1	C62 L69 Q70 R190 Y210 Y213	C62-D66 WeakPolarHBondContact O-CB 3.11Å; C62-D66 VanDerWaalsContact O-CG 3.24Å; C62-D66 PolarHBondContact O-N 3.09Å; D66-L69 PolarHBondContact O-N 2.83Å; D66-Q70 WeakPolarHBondContact O-CG 3.44Å; D66-Q70 PolarHBondContact O-N 2.86Å; D66-R190 IonicContact OD1-CZ 3.42Å; D66-R190 IonicContact OD1-NE 3.14Å; D66-R190 PolarHBondContact OD1-NE 3.08Å; D66-R190 VanDerWaalsContact OD1-NE 3.14Å; D66-R190 IonicContact OD1-NH2 3.19Å; D66-R190 PolarHBondContact OD1-NH2 3.06Å; D66-Y210 HydrophobicContact CB-CE2 4.49Å; D66-Y210 WeakPolarHBondContact CB-OH 3.33Å; D66-Y210 WeakPolarHBondContact OD2-CE2 3.24Å; D66-Y210 PolarHBondContact OD2-OH 3.43Å; D66-Y213 VanDerWaalsContact OD2-CE1 3.23Å; D66-Y213 WeakPolarHBondContact OD2-CE1 3.49Å; D66-Y213 PolarHBondContact OD2-OH 3.2Å
67	H	97.4	Very high	97.4	Very high	108 Å²	108	59 Å²	59	50%	0.5	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-40	173	-80.2	-58.3	0	0	0	112.2	V63 V64 L69 Q70	V63-H67 WeakPolarHBondContact O-CB 3.22Å; V63-H67 PolarHBondContact O-CD2 3.39Å; V63-H67 PolarHBondContact O-N 3.49Å; V63-H67 VanDerWaalsContact O-N 3.08Å; V64-H67 PolarHBondContact O-N 3.49Å; H67-L69 VanDerWaalsContact C-N 3.32Å; H67-L69 PolarHBondContact O-N 2.73Å; H67-Q70 WeakPolarHBondContact O-CB 3.46Å; H67-Q70 PolarHBondContact O-N 2.94Å; H67-Q70 VanDerWaalsContact O-N 3.13Å
68	A	97.8	Very high	97.3	Very high	38 Å²	38	60.6 Å²	60.6	31%	0.314	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-43.8	174.4	0	0	0	0	0	110.9	V64 A65 Q70 L71 I74	V64-A68 WeakPolarHBondContact O-CB 3.45Å; V64-A68 PolarHBondContact O-N 2.92Å; A65-A68 PolarHBondContact O-N 3.39Å; A68-Q70 PolarHBondContact O-N 3.47Å; A68-L71 VanDerWaalsContact O-CB 3.27Å; A68-L71 WeakPolarHBondContact O-CB 3.49Å; A68-L71 WeakPolarHBondContact O-CG 3.36Å; A68-L71 PolarHBondContact O-N 3.29Å; A68-I74 WeakPolarHBondContact O-CD1 3.41Å
69	L	97	Very high	97.2	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.037	37%	0.365	C	S	.	.	H	α-helix	trans	-61	-25.2	176.4	-78.4	167.9	0	0	0	113.2	A65 D66 H67 L71 I74 Q75 L84 D85	A65-L69 WeakPolarHBondContact O-CG 3.27Å; A65-L69 PolarHBondContact O-N 3.14Å; D66-L69 PolarHBondContact O-N 2.83Å; H67-L69 VanDerWaalsContact C-N 3.32Å; H67-L69 PolarHBondContact O-N 2.73Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-I74 HydrophobicContact CD2-CG2 4.19Å; L69-Q75 PolarHBondContact O-NE2 3.31Å; L69-L84 HydrophobicContact CD2-CB 3.5Å; L69-L84 VanDerWaalsContact CD2-CB 3.5Å; L69-D85 HydrophobicContact CD1-CB 4.45Å; L69-D85 WeakPolarHBondContact CD1-OD1 3.37Å; L69-D85 HydrophobicContact CD2-CB 4.46Å
70	Q	96.6	Very high	97.1	Very high	127 Å²	127	72 Å²	72	59%	0.593	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-9.7	176.8	-69.4	173.1	13.3	0	0	114	D66 H67 A68 S72	D66-Q70 WeakPolarHBondContact O-CG 3.44Å; D66-Q70 PolarHBondContact O-N 2.86Å; H67-Q70 WeakPolarHBondContact O-CB 3.46Å; H67-Q70 PolarHBondContact O-N 2.94Å; H67-Q70 VanDerWaalsContact O-N 3.13Å; A68-Q70 PolarHBondContact O-N 3.47Å; Q70-S72 PolarHBondContact O-N 2.84Å
71	L	97.4	Very high	97	Very high	103 Å²	103	71.7 Å²	71.7	54%	0.539	37%	0.369	S	S	.	.	S	Bend	trans	-60.8	136.8	178.7	-64.3	173.4	0	0	0	111.1	A68 L69 A73 I74 Q75	A68-L71 VanDerWaalsContact O-CB 3.27Å; A68-L71 WeakPolarHBondContact O-CB 3.49Å; A68-L71 WeakPolarHBondContact O-CG 3.36Å; A68-L71 PolarHBondContact O-N 3.29Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 2.73Å; L71-I74 HydrophobicContact CB-CD1 4.49Å; L71-I74 PolarHBondContact O-N 2.82Å; L71-Q75 PolarHBondContact O-N 3.41Å
72	S	95.8	Very high	97	Very high	86 Å²	86	70.6 Å²	70.6	60%	0.601	37%	0.369	S	S	*	.	H	α-helix	trans	-57.4	-36.8	-177.7	-50.9	0	0	0	0	112.7	Q70 I74 Q75 Q76	Q70-S72 PolarHBondContact O-N 2.84Å; S72-I74 PolarHBondContact O-N 3.31Å; S72-Q75 PolarHBondContact O-N 3.4Å; S72-Q76 WeakPolarHBondContact O-CB 3.3Å; S72-Q76 VanDerWaalsContact O-CG 3.26Å; S72-Q76 WeakPolarHBondContact O-CG 3.42Å; S72-Q76 PolarHBondContact O-N 2.98Å
73	A	95.6	Very high	96.9	Very high	66 Å²	66	73.4 Å²	73.4	55%	0.545	39%	0.392	S	S	.	.	H	α-helix	trans	-59.4	-33	175.8	0	0	0	0	0	112.8	L71 H77	L71-A73 PolarHBondContact O-N 2.73Å; A73-H77 PolarHBondContact O-CD2 3.12Å; A73-H77 VanDerWaalsContact O-CD2 3.27Å
74	I	96.4	Very high	96.9	Very high	21 Å²	21	74.1 Å²	74.1	11%	0.108	39%	0.394	C	S	.	.	H	α-helix	trans	-83.2	-44	176.2	-71	163.8	0	0	0	110.4	A68 L69 L71 S72 Q76 H77 L80 R81 L84	A68-I74 WeakPolarHBondContact O-CD1 3.41Å; L69-I74 HydrophobicContact CD2-CG2 4.19Å; L71-I74 HydrophobicContact CB-CD1 4.49Å; L71-I74 PolarHBondContact O-N 2.82Å; S72-I74 PolarHBondContact O-N 3.31Å; I74-Q76 VanDerWaalsContact C-N 3.25Å; I74-Q76 PolarHBondContact O-N 2.88Å; I74-H77 PolarHBondContact O-N 3.42Å; I74-H77 VanDerWaalsContact O-N 3.09Å; I74-L80 HydrophobicContact CG1-CD2 4.03Å; I74-L80 HydrophobicContact CG1-CG 4.42Å; I74-R81 HydrophobicContact CG2-CB 4.06Å; I74-R81 HydrophobicContact CG2-CG 4.32Å; I74-L84 HydrophobicContact CD1-CD1 3.65Å; I74-L84 HydrophobicContact CG1-CD1 3.9Å; I74-L84 HydrophobicContact CG2-CD1 4.09Å
75	Q	95.8	Very high	96.8	Very high	75 Å²	75	71.1 Å²	71.1	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-63.1	-28.6	-177.4	-71.8	-65.4	-30.9	0	0	113.9	L69 L71 S72 H77 R81	L69-Q75 PolarHBondContact O-NE2 3.31Å; L71-Q75 PolarHBondContact O-N 3.41Å; S72-Q75 PolarHBondContact O-N 3.4Å; Q75-H77 VanDerWaalsContact C-N 3.31Å; Q75-H77 PolarHBondContact O-N 3.18Å; Q75-R81 VanDerWaalsContact OE1-CD 3.23Å
76	Q	95.8	Very high	96.9	Very high	151 Å²	151	72.5 Å²	72.5	71%	0.706	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.4	176.7	-73.3	174.6	-3.1	0	0	113.5	S72 I74	S72-Q76 WeakPolarHBondContact O-CB 3.3Å; S72-Q76 VanDerWaalsContact O-CG 3.26Å; S72-Q76 WeakPolarHBondContact O-CG 3.42Å; S72-Q76 PolarHBondContact O-N 2.98Å; I74-Q76 VanDerWaalsContact C-N 3.25Å; I74-Q76 PolarHBondContact O-N 2.88Å
77	H	96.1	Very high	96.9	Very high	112 Å²	112	73.8 Å²	73.8	52%	0.519	39%	0.394	S	S	.	.			trans	-111.5	99.7	-176.6	-68.7	-59.9	0	0	0	111.3	A73 I74 Q75 W79 L80 R81	A73-H77 PolarHBondContact O-CD2 3.12Å; A73-H77 VanDerWaalsContact O-CD2 3.27Å; I74-H77 PolarHBondContact O-N 3.42Å; I74-H77 VanDerWaalsContact O-N 3.09Å; Q75-H77 VanDerWaalsContact C-N 3.31Å; Q75-H77 PolarHBondContact O-N 3.18Å; H77-W79 VanDerWaalsContact C-N 3.33Å; H77-W79 PolarHBondContact O-N 3.13Å; H77-L80 HydrophobicContact CB-CB 3.79Å; H77-L80 HydrophobicContact CB-CD2 4.47Å; H77-L80 PolarHBondContact O-N 3.4Å; H77-L80 VanDerWaalsContact O-N 3.12Å; H77-R81 PolarHBondContact O-N 3.29Å
78	L	95.9	Very high	97	Very high	58 Å²	58	69.2 Å²	69.2	30%	0.304	37%	0.373	S	S	.	.	H	α-helix	trans	-54.3	-45.5	-174.4	-178.8	61.5	0	0	0	113.6	R81 A82 L135 K136 V139	L78-R81 PolarHBondContact O-N 2.68Å; L78-A82 WeakPolarHBondContact O-CB 3.44Å; L78-A82 PolarHBondContact O-N 3.31Å; L78-L135 HydrophobicContact CD2-CD2 4.28Å; L78-L135 HydrophobicContact CD2-CG 4.2Å; L78-L135 HydrophobicContact CG-CD2 3.81Å; L78-L135 HydrophobicContact CG-CG 4.14Å; L78-K136 HydrophobicContact CD2-CB 4.45Å; L78-V139 HydrophobicContact CD1-CG1 4.45Å; L78-V139 HydrophobicContact CD1-CG2 4.11Å; L78-V139 HydrophobicContact CD2-CG2 4.29Å
79	W	96.1	Very high	97	Very high	173 Å²	173	67.5 Å²	67.5	66%	0.655	36%	0.359	S	S	*	.	H	α-helix	trans	-63.8	-45.7	178.2	-84.7	102.3	0	0	0	112.7	H77 R81 A82 A83 L135	H77-W79 VanDerWaalsContact C-N 3.33Å; H77-W79 PolarHBondContact O-N 3.13Å; W79-R81 VanDerWaalsContact C-N 3.34Å; W79-R81 PolarHBondContact O-N 3.44Å; W79-A82 PolarHBondContact O-N 3.28Å; W79-A83 VanDerWaalsContact O-CB 3.25Å; W79-A83 WeakPolarHBondContact O-CB 3.34Å; W79-A83 PolarHBondContact O-N 3.32Å; W79-L135 VanDerWaalsContact CA-CD2 3.5Å; W79-L135 HydrophobicContact CB-CD2 4.15Å; W79-L135 HydrophobicContact CD2-CB 4.32Å; W79-L135 HydrophobicContact CD2-CD2 3.39Å; W79-L135 HydrophobicContact CD2-CG 4.47Å; W79-L135 HydrophobicContact CE3-CD2 3.65Å; W79-L135 HydrophobicContact CG-CD2 3.62Å; W79-L135 HydrophobicContact CH2-CB 4.01Å; W79-L135 HydrophobicContact CZ2-CB 3.7Å; W79-L135 HydrophobicContact CZ2-CD2 4.33Å; W79-L135 HydrophobicContact CZ3-CB 4.44Å; W79-L135 HydrophobicContact CZ3-CD2 4.21Å
80	L	96.8	Very high	97.1	Very high	75 Å²	75	67.5 Å²	67.5	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-62.3	-45.5	179	-179.3	60.6	0	0	0	110.5	I74 H77 A83 L84	I74-L80 HydrophobicContact CG1-CD2 4.03Å; I74-L80 HydrophobicContact CG1-CG 4.42Å; H77-L80 HydrophobicContact CB-CB 3.79Å; H77-L80 HydrophobicContact CB-CD2 4.47Å; H77-L80 PolarHBondContact O-N 3.4Å; H77-L80 VanDerWaalsContact O-N 3.12Å; L80-A83 PolarHBondContact O-N 3.09Å; L80-L84 HydrophobicContact CD1-CD1 3.76Å; L80-L84 HydrophobicContact CD1-CG 3.96Å; L80-L84 HydrophobicContact CG-CD1 3.88Å; L80-L84 HydrophobicContact CG-CG 4.41Å; L80-L84 WeakPolarHBondContact O-CB 3.32Å; L80-L84 VanDerWaalsContact O-CG 3.28Å; L80-L84 WeakPolarHBondContact O-CG 3.46Å; L80-L84 PolarHBondContact O-N 2.97Å
81	R	97.4	Very high	97.2	Very high	87 Å²	87	65.4 Å²	65.4	33%	0.328	35%	0.353	S	S	.	.	H	α-helix	trans	-58	-52.1	176.5	-172.8	-180	72.3	174.2	3.8	111.5	I74 Q75 H77 L78 W79 A83 L84 D85	I74-R81 HydrophobicContact CG2-CB 4.06Å; I74-R81 HydrophobicContact CG2-CG 4.32Å; Q75-R81 VanDerWaalsContact OE1-CD 3.23Å; H77-R81 PolarHBondContact O-N 3.29Å; L78-R81 PolarHBondContact O-N 2.68Å; W79-R81 VanDerWaalsContact C-N 3.34Å; W79-R81 PolarHBondContact O-N 3.44Å; R81-A83 PolarHBondContact O-N 2.96Å; R81-L84 PolarHBondContact O-N 3.1Å; R81-D85 VanDerWaalsContact O-CB 3.27Å; R81-D85 WeakPolarHBondContact O-CB 3.18Å; R81-D85 PolarHBondContact O-N 2.76Å
82	A	96.9	Very high	97.2	Very high	27 Å²	27	60.5 Å²	60.5	22%	0.223	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-41	-178.8	0	0	0	0	0	112.4	L78 W79 D85 N86 L135	L78-A82 WeakPolarHBondContact O-CB 3.44Å; L78-A82 PolarHBondContact O-N 3.31Å; W79-A82 PolarHBondContact O-N 3.28Å; A82-D85 PolarHBondContact O-N 2.93Å; A82-N86 WeakPolarHBondContact O-CB 3.28Å; A82-N86 PolarHBondContact O-N 3.44Å; A82-L135 HydrophobicContact CB-CD1 3.74Å; A82-L135 HydrophobicContact CB-CD2 3.89Å; A82-L135 HydrophobicContact CB-CG 4.4Å
83	A	97.2	Very high	97.4	Very high	59 Å²	59	56.4 Å²	56.4	49%	0.488	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-43.5	178	0	0	0	0	0	112	W79 L80 R81 A87	W79-A83 VanDerWaalsContact O-CB 3.25Å; W79-A83 WeakPolarHBondContact O-CB 3.34Å; W79-A83 PolarHBondContact O-N 3.32Å; L80-A83 PolarHBondContact O-N 3.09Å; R81-A83 PolarHBondContact O-N 2.96Å; A83-A87 WeakPolarHBondContact O-CB 3.47Å; A83-A87 PolarHBondContact O-N 2.8Å
84	L	98.1	Very high	97.5	Very high	64 Å²	64	55.4 Å²	55.4	34%	0.335	28%	0.284	S	S	.	.	H	α-helix	trans	-70.1	-35.5	177.9	-70.1	176.9	0	0	0	112.4	L69 I74 L80 R81 T88	L69-L84 HydrophobicContact CD2-CB 3.5Å; L69-L84 VanDerWaalsContact CD2-CB 3.5Å; I74-L84 HydrophobicContact CD1-CD1 3.65Å; I74-L84 HydrophobicContact CG1-CD1 3.9Å; I74-L84 HydrophobicContact CG2-CD1 4.09Å; L80-L84 HydrophobicContact CD1-CD1 3.76Å; L80-L84 HydrophobicContact CD1-CG 3.96Å; L80-L84 HydrophobicContact CG-CD1 3.88Å; L80-L84 HydrophobicContact CG-CG 4.41Å; L80-L84 WeakPolarHBondContact O-CB 3.32Å; L80-L84 VanDerWaalsContact O-CG 3.28Å; L80-L84 WeakPolarHBondContact O-CG 3.46Å; L80-L84 PolarHBondContact O-N 2.97Å; R81-L84 PolarHBondContact O-N 3.1Å; L84-T88 WeakPolarHBondContact O-CB 3.45Å; L84-T88 PolarHBondContact O-N 2.73Å; L84-T88 PolarHBondContact O-OG1 2.87Å
85	D	97.8	Very high	97.6	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-51.8	176.3	-154.5	38.7	0	0	0	110	L69 R81 A82 A87 T88 H89 R190 R194	L69-D85 HydrophobicContact CD1-CB 4.45Å; L69-D85 WeakPolarHBondContact CD1-OD1 3.37Å; L69-D85 HydrophobicContact CD2-CB 4.46Å; R81-D85 VanDerWaalsContact O-CB 3.27Å; R81-D85 WeakPolarHBondContact O-CB 3.18Å; R81-D85 PolarHBondContact O-N 2.76Å; A82-D85 PolarHBondContact O-N 2.93Å; D85-A87 PolarHBondContact O-N 2.95Å; D85-T88 WeakPolarHBondContact O-CA 3.28Å; D85-T88 VanDerWaalsContact O-CB 3.31Å; D85-T88 WeakPolarHBondContact O-CB 3.47Å; D85-T88 PolarHBondContact O-N 3.44Å; D85-T88 VanDerWaalsContact O-N 3.08Å; D85-H89 PolarHBondContact O-CD2 2.91Å; D85-H89 PolarHBondContact O-N 2.86Å; D85-H89 VanDerWaalsContact O-N 3.09Å; D85-R190 IonicContact OD1-CZ 3.26Å; D85-R190 VanDerWaalsContact OD1-CZ 3.26Å; D85-R190 IonicContact OD1-NH1 2.86Å; D85-R190 PolarHBondContact OD1-NH1 3.15Å; D85-R190 IonicContact OD1-NH2 2.83Å; D85-R190 PolarHBondContact OD1-NH2 3.32Å; D85-R194 IonicContact OD1-NH2 3.96Å; D85-R194 IonicContact OD2-NH1 3.62Å
86	N	98.4	Very high	97.7	Very high	41 Å²	41	55 Å²	55	22%	0.219	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-39.4	176.5	-171	6.8	0	0	0	112.5	A82 T88 H89 G90 S120 D123	A82-N86 WeakPolarHBondContact O-CB 3.28Å; A82-N86 PolarHBondContact O-N 3.44Å; N86-T88 PolarHBondContact O-N 3.4Å; N86-H89 WeakPolarHBondContact O-CB 3.4Å; N86-H89 PolarHBondContact O-N 3.38Å; N86-G90 PolarHBondContact O-N 3.17Å; N86-S120 PolarHBondContact ND2-O 3.39Å; N86-S120 PolarHBondContact O-OG 2.89Å; N86-S120 VanDerWaalsContact O-OG 3.09Å; N86-S120 WeakPolarHBondContact OD1-CA 3.46Å; N86-S120 WeakPolarHBondContact OD1-CB 3.15Å; N86-S120 PolarHBondContact OD1-O 3.35Å; N86-S120 PolarHBondContact OD1-OG 2.92Å; N86-D123 VanDerWaalsContact CB-OD2 3.31Å; N86-D123 WeakPolarHBondContact CB-OD2 3.17Å; N86-D123 PolarHBondContact OD1-OD2 2.95Å
87	A	98.6	Very high	97.8	Very high	45 Å²	45	47.9 Å²	47.9	37%	0.372	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-35.2	173.8	0	0	0	0	0	111.8	A83 D85 G90 L91	A83-A87 WeakPolarHBondContact O-CB 3.47Å; A83-A87 PolarHBondContact O-N 2.8Å; D85-A87 PolarHBondContact O-N 2.95Å; A87-G90 PolarHBondContact O-N 3.09Å; A87-L91 WeakPolarHBondContact O-CB 3.44Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.43Å; A87-L91 PolarHBondContact O-N 3.09Å
88	T	98.6	Very high	97.8	Very high	11 Å²	11	43.2 Å²	43.2	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-44.5	174.6	-57.5	0	0	0	0	110.7	F61 A65 L84 D85 N86 G90 L91 V92	F61-T88 HydrophobicContact CE1-CG2 4.27Å; A65-T88 HydrophobicContact CB-CG2 3.83Å; L84-T88 WeakPolarHBondContact O-CB 3.45Å; L84-T88 PolarHBondContact O-N 2.73Å; L84-T88 PolarHBondContact O-OG1 2.87Å; D85-T88 WeakPolarHBondContact O-CA 3.28Å; D85-T88 VanDerWaalsContact O-CB 3.31Å; D85-T88 WeakPolarHBondContact O-CB 3.47Å; D85-T88 PolarHBondContact O-N 3.44Å; D85-T88 VanDerWaalsContact O-N 3.08Å; N86-T88 PolarHBondContact O-N 3.4Å; T88-G90 VanDerWaalsContact C-N 3.34Å; T88-G90 PolarHBondContact O-N 2.92Å; T88-L91 PolarHBondContact O-N 3.45Å; T88-V92 HydrophobicContact CG2-CG2 4.39Å; T88-V92 WeakPolarHBondContact O-CB 3.44Å; T88-V92 VanDerWaalsContact O-CG2 3.27Å; T88-V92 WeakPolarHBondContact O-CG2 3.38Å; T88-V92 PolarHBondContact O-N 3.47Å
89	H	98.6	Very high	97.7	Very high	3 Å²	3	41.3 Å²	41.3	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-56.7	-47.7	173	-71	-74	0	0	0	112	D85 N86 V92 G93 A119 D123 H187 R190 D191	D85-H89 PolarHBondContact O-CD2 2.91Å; D85-H89 PolarHBondContact O-N 2.86Å; D85-H89 VanDerWaalsContact O-N 3.09Å; N86-H89 WeakPolarHBondContact O-CB 3.4Å; N86-H89 PolarHBondContact O-N 3.38Å; H89-V92 PolarHBondContact O-N 2.93Å; H89-G93 PolarHBondContact O-N 2.75Å; H89-A119 WeakPolarHBondContact O-CB 3.3Å; H89-D123 IonicContact CD2-OD2 3.71Å; H89-H187 AromaticContact CG-CE1 3.84Å; H89-H187 AromaticContact CG-ND1 3.58Å; H89-H187 AromaticContact ND1-CD2 3.99Å; H89-H187 AromaticContact ND1-CE1 3.85Å; H89-H187 AromaticContact ND1-CG 3.56Å; H89-H187 AromaticContact ND1-ND1 3.5Å; H89-H187 PolarHBondContact ND1-ND1 2.82Å; H89-R190 PolarHBondContact CD2-NH1 3.12Å; H89-R190 PolarHBondContact CE1-NH1 3.44Å; H89-R190 PolarHBondContact NE2-NH1 3.33Å; H89-D191 IonicContact CE1-OD1 2.73Å; H89-D191 PolarHBondContact CE1-OD1 3.35Å; H89-D191 IonicContact NE2-OD1 3.81Å; H89-D191 PolarHBondContact NE2-OD1 2.91Å
90	G	98.6	Very high	97.6	Very high	7 Å²	7	33.2 Å²	33.2	7%	0.072	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-46.6	178	0	0	0	0	0	112.9	N86 A87 T88 V92 G93 L94 G116 S120	N86-G90 PolarHBondContact O-N 3.17Å; A87-G90 PolarHBondContact O-N 3.09Å; T88-G90 VanDerWaalsContact C-N 3.34Å; T88-G90 PolarHBondContact O-N 2.92Å; G90-V92 PolarHBondContact O-N 2.88Å; G90-G93 PolarHBondContact O-N 2.89Å; G90-L94 WeakPolarHBondContact O-CB 3.3Å; G90-L94 PolarHBondContact O-N 3.4Å; G90-G116 WeakPolarHBondContact CA-O 3.35Å; G90-G116 WeakPolarHBondContact O-CA 3.27Å; G90-S120 WeakPolarHBondContact CA-OG 3.29Å; G90-S120 PolarHBondContact N-OG 3.08Å
91	L	98.7	Very high	97.2	Very high	82 Å²	82	30.9 Å²	30.9	43%	0.429	17%	0.174	S	C	.	.	H	α-helix	trans	-65.6	-38.4	178.8	-72.9	173.3	0	0	0	112.4	F61 A87 T88 W95	F61-L91 HydrophobicContact CE1-CB 4.04Å; F61-L91 HydrophobicContact CE2-CD1 4.34Å; F61-L91 HydrophobicContact CZ-CB 3.89Å; F61-L91 HydrophobicContact CZ-CD1 3.78Å; A87-L91 WeakPolarHBondContact O-CB 3.44Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.43Å; A87-L91 PolarHBondContact O-N 3.09Å; T88-L91 PolarHBondContact O-N 3.45Å; L91-W95 VanDerWaalsContact O-CB 3.24Å; L91-W95 WeakPolarHBondContact O-CB 3.44Å; L91-W95 PolarHBondContact O-N 3.06Å
92	V	98.8	Very high	96.8	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-46.2	175.3	169.9	0	0	0	0	110.8	L58 F61 T88 H89 G90 W95 S96 T217	L58-V92 HydrophobicContact CD1-CG1 4.36Å; L58-V92 HydrophobicContact CD1-CG2 4.32Å; F61-V92 HydrophobicContact CD1-CG2 4.25Å; F61-V92 HydrophobicContact CE1-CG2 4Å; T88-V92 HydrophobicContact CG2-CG2 4.39Å; T88-V92 WeakPolarHBondContact O-CB 3.44Å; T88-V92 VanDerWaalsContact O-CG2 3.27Å; T88-V92 WeakPolarHBondContact O-CG2 3.38Å; T88-V92 PolarHBondContact O-N 3.47Å; H89-V92 PolarHBondContact O-N 2.93Å; G90-V92 PolarHBondContact O-N 2.88Å; V92-W95 PolarHBondContact O-N 3.31Å; V92-S96 WeakPolarHBondContact O-CB 3.42Å; V92-S96 PolarHBondContact O-N 3.43Å; V92-S96 PolarHBondContact O-OG 3.38Å; V92-T217 HydrophobicContact CG1-CG2 3.57Å
93	G	98.5	Very high	96.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-45	177.6	0	0	0	0	0	112.5	H89 G90 S96 W97	H89-G93 PolarHBondContact O-N 2.75Å; G90-G93 PolarHBondContact O-N 2.89Å; G93-S96 PolarHBondContact O-N 2.89Å; G93-W97 PolarHBondContact O-N 2.92Å
94	L	98.3	Very high	95.6	Very high	45 Å²	45	35.6 Å²	35.6	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-56.5	174.9	-177.4	157.6	0	0	0	111.2	G90 S96 W97 A98 V112 L113	G90-L94 WeakPolarHBondContact O-CB 3.3Å; G90-L94 PolarHBondContact O-N 3.4Å; L94-S96 VanDerWaalsContact C-N 3.35Å; L94-S96 PolarHBondContact O-N 3.49Å; L94-W97 PolarHBondContact O-N 2.99Å; L94-A98 PolarHBondContact O-N 3.19Å; L94-V112 HydrophobicContact CB-CG1 4.42Å; L94-V112 HydrophobicContact CD1-CG1 4.28Å; L94-V112 HydrophobicContact CD2-CG1 3.31Å; L94-V112 HydrophobicContact CG-CG1 3.36Å; L94-V112 WeakPolarHBondContact CG-O 3.31Å; L94-L113 HydrophobicContact CD1-CD2 3.98Å
95	W	98.4	Very high	95	Very high	88 Å²	88	37.2 Å²	37.2	33%	0.333	19%	0.194	S	C	.	.	H	α-helix	trans	-64.9	-41.3	-176.5	-163.1	-24.8	0	0	0	110.9	A54 L58 F61 L91 V92 W97 A98 V99	A54-W95 PolarHBondContact O-NE1 2.7Å; L58-W95 HydrophobicContact CB-CD2 4.39Å; L58-W95 HydrophobicContact CB-CG 4.47Å; L58-W95 HydrophobicContact CD1-CB 4Å; L58-W95 HydrophobicContact CD1-CD2 4.17Å; L58-W95 HydrophobicContact CD1-CE3 4.29Å; L58-W95 HydrophobicContact CD1-CG 4.05Å; F61-W95 HydrophobicContact CB-CE3 4.35Å; F61-W95 HydrophobicContact CB-CH2 4.26Å; F61-W95 HydrophobicContact CB-CZ3 3.68Å; F61-W95 HydrophobicContact CD1-CE3 4.39Å; F61-W95 HydrophobicContact CD1-CZ3 4.4Å; F61-W95 HydrophobicContact CD2-CZ3 4.1Å; F61-W95 HydrophobicContact CG-CE3 4.23Å; F61-W95 AromaticContact CG-CZ3 3.79Å; F61-W95 HydrophobicContact CG-CZ3 3.79Å; L91-W95 VanDerWaalsContact O-CB 3.24Å; L91-W95 WeakPolarHBondContact O-CB 3.44Å; L91-W95 PolarHBondContact O-N 3.06Å; V92-W95 PolarHBondContact O-N 3.31Å; W95-W97 VanDerWaalsContact C-N 3.31Å; W95-W97 PolarHBondContact O-N 3.43Å; W95-A98 WeakPolarHBondContact O-CB 3.5Å; W95-A98 PolarHBondContact O-N 3.49Å; W95-A98 VanDerWaalsContact O-N 3.13Å; W95-V99 WeakPolarHBondContact O-CG2 3.17Å; W95-V99 PolarHBondContact O-N 3.04Å
96	S	98.3	Very high	94.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-55.9	-46.4	175.1	-64	0	0	0	0	111.6	L58 V92 G93 L94 V99 V100	L58-S96 WeakPolarHBondContact CD2-OG 3.39Å; V92-S96 WeakPolarHBondContact O-CB 3.42Å; V92-S96 PolarHBondContact O-N 3.43Å; V92-S96 PolarHBondContact O-OG 3.38Å; G93-S96 PolarHBondContact O-N 2.89Å; L94-S96 VanDerWaalsContact C-N 3.35Å; L94-S96 PolarHBondContact O-N 3.49Å; S96-V99 PolarHBondContact O-N 3.36Å; S96-V100 WeakPolarHBondContact O-CG2 3.28Å; S96-V100 PolarHBondContact O-N 3.13Å; S96-V100 VanDerWaalsContact O-N 3.16Å
97	W	97.3	Very high	93.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-37.8	177.7	-168.6	-109.7	0	0	0	112.6	G93 L94 W95 V99 V100 I101 A115 W178 M179 I182 M228	G93-W97 PolarHBondContact O-N 2.92Å; L94-W97 PolarHBondContact O-N 2.99Å; W95-W97 VanDerWaalsContact C-N 3.31Å; W95-W97 PolarHBondContact O-N 3.43Å; W97-V99 VanDerWaalsContact C-N 3.25Å; W97-V99 PolarHBondContact O-N 3.44Å; W97-V100 HydrophobicContact CE3-CB 4.16Å; W97-V100 HydrophobicContact CE3-CG1 4.19Å; W97-V100 HydrophobicContact CE3-CG2 4.31Å; W97-V100 HydrophobicContact CH2-CG1 4.25Å; W97-V100 HydrophobicContact CZ3-CB 4.38Å; W97-V100 HydrophobicContact CZ3-CG1 3.9Å; W97-V100 WeakPolarHBondContact O-CB 3.28Å; W97-V100 PolarHBondContact O-N 3.44Å; W97-I101 HydrophobicContact CD2-CG2 4.24Å; W97-I101 HydrophobicContact CH2-CG2 4.38Å; W97-I101 HydrophobicContact CZ2-CG2 3.58Å; W97-I101 WeakPolarHBondContact O-CG1 3.25Å; W97-I101 PolarHBondContact O-N 2.95Å; W97-I101 VanDerWaalsContact O-N 3.08Å; W97-A115 HydrophobicContact CB-CB 3.43Å; W97-A115 VanDerWaalsContact CB-CB 3.43Å; W97-A115 HydrophobicContact CG-CB 3.74Å; W97-W178 HydrophobicContact CH2-CB 3.97Å; W97-W178 HydrophobicContact CZ3-CB 3.93Å; W97-M179 HydrophobicContact CD2-CB 4.25Å; W97-M179 HydrophobicContact CD2-CE 4.5Å; W97-M179 HydrophobicContact CD2-CG 4.04Å; W97-M179 HydrophobicContact CE3-CB 4.12Å; W97-M179 HydrophobicContact CE3-CG 4.29Å; W97-M179 HydrophobicContact CG-CG 4.4Å; W97-M179 HydrophobicContact CH2-CB 4.08Å; W97-M179 HydrophobicContact CZ2-CB 4.21Å; W97-M179 HydrophobicContact CZ2-CE 4.01Å; W97-M179 HydrophobicContact CZ3-CB 4.03Å; W97-I182 HydrophobicContact CE3-CB 4.37Å; W97-I182 HydrophobicContact CE3-CG1 4.44Å; W97-I182 HydrophobicContact CE3-CG2 4.48Å; W97-M228 HydrophobicContact CH2-CE 4.1Å; W97-M228 HydrophobicContact CH2-SD 4.24Å; W97-M228 HydrophobicContact CZ3-SD 4.36Å
98	A	95.5	Very high	93.2	Very high	15 Å²	15	43.5 Å²	43.5	12%	0.124	22%	0.217	C	C	.	.	H	α-helix	trans	-59	-37.2	175.4	0	0	0	0	0	112.3	L94 W95 G102 L103 V112	L94-A98 PolarHBondContact O-N 3.19Å; W95-A98 WeakPolarHBondContact O-CB 3.5Å; W95-A98 PolarHBondContact O-N 3.49Å; W95-A98 VanDerWaalsContact O-N 3.13Å; A98-G102 WeakPolarHBondContact O-CA 3.28Å; A98-G102 PolarHBondContact O-N 3.09Å; A98-L103 HydrophobicContact CB-CD1 4.19Å; A98-L103 HydrophobicContact CB-CG 4.17Å; A98-V112 HydrophobicContact CB-CG1 4.05Å; A98-V112 HydrophobicContact CB-CG2 3.8Å
99	V	94.8	Very high	92.8	Very high	17 Å²	17	47.2 Å²	47.2	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-40.8	173.6	175.8	0	0	0	0	111.6	A54 W95 S96 W97 P221	A54-V99 HydrophobicContact CB-CG2 3.84Å; W95-V99 WeakPolarHBondContact O-CG2 3.17Å; W95-V99 PolarHBondContact O-N 3.04Å; S96-V99 PolarHBondContact O-N 3.36Å; W97-V99 VanDerWaalsContact C-N 3.25Å; W97-V99 PolarHBondContact O-N 3.44Å; V99-P221 HydrophobicContact CB-CB 3.76Å; V99-P221 HydrophobicContact CB-CG 4.29Å; V99-P221 HydrophobicContact CG1-CB 3.58Å; V99-P221 HydrophobicContact CG1-CG 4.37Å
100	V	93	Very high	92.5	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-48.9	-179.9	171.7	0	0	0	0	111.8	S96 W97 I182 P221 C224 M228 R234	S96-V100 WeakPolarHBondContact O-CG2 3.28Å; S96-V100 PolarHBondContact O-N 3.13Å; S96-V100 VanDerWaalsContact O-N 3.16Å; W97-V100 HydrophobicContact CE3-CB 4.16Å; W97-V100 HydrophobicContact CE3-CG1 4.19Å; W97-V100 HydrophobicContact CE3-CG2 4.31Å; W97-V100 HydrophobicContact CH2-CG1 4.25Å; W97-V100 HydrophobicContact CZ3-CB 4.38Å; W97-V100 HydrophobicContact CZ3-CG1 3.9Å; W97-V100 WeakPolarHBondContact O-CB 3.28Å; W97-V100 PolarHBondContact O-N 3.44Å; V100-I182 HydrophobicContact CG2-CD1 4.15Å; V100-I182 HydrophobicContact CG2-CG1 4.26Å; V100-P221 HydrophobicContact CG2-CB 3.95Å; V100-P221 WeakPolarHBondContact CG2-O 3.33Å; V100-C224 HydrophobicContact CG2-CB 4.12Å; V100-M228 HydrophobicContact CG1-CE 4.28Å; V100-M228 HydrophobicContact CG1-SD 3.5Å; V100-M228 WeakPolarHBondContact CG1-SD 3.35Å; V100-R234 PolarHBondContact O-NH1 3.09Å; V100-R234 VanDerWaalsContact O-NH1 3.15Å
101	I	89.9	Confident	92.2	Very high	27 Å²	27	56.4 Å²	56.4	14%	0.138	27%	0.271	C	S	.	.	H	α-helix	trans	-87.5	-26.9	-173.6	69.2	177.6	0	0	0	113.1	W97 L103 D108 E111 V112	W97-I101 HydrophobicContact CD2-CG2 4.24Å; W97-I101 HydrophobicContact CH2-CG2 4.38Å; W97-I101 HydrophobicContact CZ2-CG2 3.58Å; W97-I101 WeakPolarHBondContact O-CG1 3.25Å; W97-I101 PolarHBondContact O-N 2.95Å; W97-I101 VanDerWaalsContact O-N 3.08Å; I101-L103 HydrophobicContact CD1-CD2 4.39Å; I101-D108 HydrophobicContact CD1-CB 3.85Å; I101-E111 HydrophobicContact CD1-CB 4.48Å; I101-V112 HydrophobicContact CD1-CG2 3.75Å; I101-V112 HydrophobicContact CG1-CG2 4.43Å
102	G	88.9	Confident	92.1	Very high	33 Å²	33	52.8 Å²	52.8	34%	0.34	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	94.4	-172.5	0	0	0	0	0	111.4	A98 R104	A98-G102 WeakPolarHBondContact O-CA 3.28Å; A98-G102 PolarHBondContact O-N 3.09Å; G102-R104 WeakPolarHBondContact O-CG 3.49Å; G102-R104 PolarHBondContact O-N 3.03Å
103	L	85.4	Confident	92	Very high	89 Å²	89	57.8 Å²	57.8	47%	0.466	28%	0.278	S	S	.	.			trans	-51.3	122.3	-176.8	-67.4	176	0	0	0	112.8	A98 I101 D108 L109 V112	A98-L103 HydrophobicContact CB-CD1 4.19Å; A98-L103 HydrophobicContact CB-CG 4.17Å; I101-L103 HydrophobicContact CD1-CD2 4.39Å; L103-D108 HydrophobicContact CD2-CB 3.74Å; L103-L109 HydrophobicContact CD2-CD2 4.38Å; L103-V112 HydrophobicContact CD2-CG2 3.79Å
104	R	83.3	Confident	91.9	Very high	149 Å²	149	60.4 Å²	60.4	56%	0.562	29%	0.292	S	S	*	.			trans	-131.4	-32.7	177.8	-71.9	170.6	-175.5	-176.1	0.6	112.9	G102 D108	G102-R104 WeakPolarHBondContact O-CG 3.49Å; G102-R104 PolarHBondContact O-N 3.03Å; R104-D108 PolarHBondContact N-OD2 3.11Å
105	K	85.8	Confident	91.9	Very high	99 Å²	99	58.2 Å²	58.2	43%	0.43	28%	0.281	S	S	.	.	S	Bend	trans	-126.7	160.8	-174.5	-60	178.6	-176	177.3	0	111	S107 D108 H241	K105-S107 PolarHBondContact O-N 2.94Å; K105-D108 PolarHBondContact N-OD2 3.4Å; K105-D108 VanDerWaalsContact O-CB 3.29Å; K105-D108 WeakPolarHBondContact O-CB 3.45Å; K105-D108 PolarHBondContact O-N 3.47Å; K105-D108 VanDerWaalsContact O-N 3.15Å; K105-H241 WeakPolarHBondContact CE-O 3.27Å; K105-H241 VanDerWaalsContact NZ-C 3.27Å; K105-H241 PolarHBondContact NZ-O 3.27Å
106	K	83.6	Confident	91.9	Very high	181 Å²	181	54.3 Å²	54.3	79%	0.787	27%	0.268	S	S	*	.	H	α-helix	trans	-62.1	-31.7	175.7	-66.9	-174.7	179.6	-179.8	0	112.8	D108 L109	K106-D108 PolarHBondContact O-N 2.88Å; K106-L109 WeakPolarHBondContact O-CB 3.46Å; K106-L109 PolarHBondContact O-N 3.11Å
107	S	83.4	Confident	91.9	Very high	60 Å²	60	58.8 Å²	58.8	42%	0.42	29%	0.291	S	S	.	.	H	α-helix	trans	-57.9	-33.6	175.7	46.7	0	0	0	0	112.6	K105 L109 Y110	K105-S107 PolarHBondContact O-N 2.94Å; S107-L109 PolarHBondContact O-N 3.22Å; S107-Y110 WeakPolarHBondContact O-CB 3.19Å; S107-Y110 PolarHBondContact O-N 3.15Å; S107-Y110 VanDerWaalsContact O-N 3.08Å
108	D	88.8	Confident	92	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-26.5	-176.5	-49.6	-6.6	0	0	0	110.9	I101 L103 R104 K105 K106 Y110 E111 V112 H241	I101-D108 HydrophobicContact CD1-CB 3.85Å; L103-D108 HydrophobicContact CD2-CB 3.74Å; R104-D108 PolarHBondContact N-OD2 3.11Å; K105-D108 PolarHBondContact N-OD2 3.4Å; K105-D108 VanDerWaalsContact O-CB 3.29Å; K105-D108 WeakPolarHBondContact O-CB 3.45Å; K105-D108 PolarHBondContact O-N 3.47Å; K105-D108 VanDerWaalsContact O-N 3.15Å; K106-D108 PolarHBondContact O-N 2.88Å; D108-Y110 VanDerWaalsContact C-N 3.28Å; D108-Y110 PolarHBondContact O-N 2.75Å; D108-E111 PolarHBondContact O-N 3.41Å; D108-V112 WeakPolarHBondContact O-CB 3.37Å; D108-V112 WeakPolarHBondContact O-CG2 3.36Å; D108-V112 PolarHBondContact O-N 2.98Å; D108-H241 IonicContact OD1-CD2 3.9Å; D108-H241 PolarHBondContact OD1-CD2 3.35Å; D108-H241 IonicContact OD1-NE2 3.61Å
109	L	91.1	Very high	92.1	Very high	90 Å²	90	59.9 Å²	59.9	47%	0.471	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-36.6	174.1	-62.7	175.7	0	0	0	111.6	L103 K106 S107 V112 L113	L103-L109 HydrophobicContact CD2-CD2 4.38Å; K106-L109 WeakPolarHBondContact O-CB 3.46Å; K106-L109 PolarHBondContact O-N 3.11Å; S107-L109 PolarHBondContact O-N 3.22Å; L109-V112 PolarHBondContact O-N 3.43Å; L109-L113 WeakPolarHBondContact O-CB 3.45Å; L109-L113 WeakPolarHBondContact O-CG 3.31Å; L109-L113 PolarHBondContact O-N 3.39Å
110	Y	92.4	Very high	92.3	Very high	177 Å²	177	60.2 Å²	60.2	69%	0.694	30%	0.298	S	S	*	.	H	α-helix	trans	-67.4	-38.8	177.1	-63.5	-68.8	0	0	0	111.7	S107 D108 L114	S107-Y110 WeakPolarHBondContact O-CB 3.19Å; S107-Y110 PolarHBondContact O-N 3.15Å; S107-Y110 VanDerWaalsContact O-N 3.08Å; D108-Y110 VanDerWaalsContact C-N 3.28Å; D108-Y110 PolarHBondContact O-N 2.75Å; Y110-L114 VanDerWaalsContact O-CB 3.26Å; Y110-L114 WeakPolarHBondContact O-CB 3.45Å; Y110-L114 PolarHBondContact O-N 3.5Å
111	E	92.8	Very high	92.5	Very high	26 Å²	26	63.5 Å²	63.5	12%	0.121	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-41.1	176.4	-63.8	-160.7	-164.8	0	0	111.5	I101 D108 L114 A115 S175 M179 H241	I101-E111 HydrophobicContact CD1-CB 4.48Å; D108-E111 PolarHBondContact O-N 3.41Å; E111-L114 PolarHBondContact O-N 2.89Å; E111-A115 PolarHBondContact O-N 3.19Å; E111-S175 PolarHBondContact OE2-OG 3.33Å; E111-M179 HydrophobicContact CB-CE 3.86Å; E111-M179 HydrophobicContact CG-CE 4.34Å; E111-H241 IonicContact OE1-CE1 3.9Å; E111-H241 IonicContact OE1-NE2 3.53Å
112	V	95.7	Very high	92.9	Very high	6 Å²	6	62.5 Å²	62.5	4%	0.036	31%	0.309	C	S	.	.	H	α-helix	trans	-67.9	-42.8	178.2	164.1	0	0	0	0	111.8	L94 A98 I101 L103 D108 L109 L114 A115 G116	L94-V112 HydrophobicContact CB-CG1 4.42Å; L94-V112 HydrophobicContact CD1-CG1 4.28Å; L94-V112 HydrophobicContact CD2-CG1 3.31Å; L94-V112 HydrophobicContact CG-CG1 3.36Å; L94-V112 WeakPolarHBondContact CG-O 3.31Å; A98-V112 HydrophobicContact CB-CG1 4.05Å; A98-V112 HydrophobicContact CB-CG2 3.8Å; I101-V112 HydrophobicContact CD1-CG2 3.75Å; I101-V112 HydrophobicContact CG1-CG2 4.43Å; L103-V112 HydrophobicContact CD2-CG2 3.79Å; D108-V112 WeakPolarHBondContact O-CB 3.37Å; D108-V112 WeakPolarHBondContact O-CG2 3.36Å; D108-V112 PolarHBondContact O-N 2.98Å; L109-V112 PolarHBondContact O-N 3.43Å; V112-L114 VanDerWaalsContact C-N 3.34Å; V112-L114 PolarHBondContact O-N 3.24Å; V112-A115 PolarHBondContact O-N 3.3Å; V112-G116 PolarHBondContact O-N 3.38Å; V112-G116 VanDerWaalsContact O-N 3.12Å
113	L	97.1	Very high	93.3	Very high	105 Å²	105	62.2 Å²	62.2	55%	0.55	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-39.9	172.4	-71.9	171.6	0	0	0	112	L94 L109 G116 L117	L94-L113 HydrophobicContact CD1-CD2 3.98Å; L109-L113 WeakPolarHBondContact O-CB 3.45Å; L109-L113 WeakPolarHBondContact O-CG 3.31Å; L109-L113 PolarHBondContact O-N 3.39Å; L113-G116 PolarHBondContact O-N 3.47Å; L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 PolarHBondContact O-N 2.92Å
114	L	96.9	Very high	93.8	Very high	55 Å²	55	62.5 Å²	62.5	29%	0.288	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-42.7	176	179.6	61	0	0	0	111.2	Y110 E111 V112 G116 L117 L118 L176 M179	Y110-L114 VanDerWaalsContact O-CB 3.26Å; Y110-L114 WeakPolarHBondContact O-CB 3.45Å; Y110-L114 PolarHBondContact O-N 3.5Å; E111-L114 PolarHBondContact O-N 2.89Å; V112-L114 VanDerWaalsContact C-N 3.34Å; V112-L114 PolarHBondContact O-N 3.24Å; L114-G116 VanDerWaalsContact C-N 3.33Å; L114-G116 PolarHBondContact O-N 2.97Å; L114-L117 PolarHBondContact O-N 2.68Å; L114-L118 HydrophobicContact CD1-CD1 4.35Å; L114-L118 HydrophobicContact CD1-CG 4.16Å; L114-L118 HydrophobicContact CG-CD1 4.04Å; L114-L118 HydrophobicContact CG-CG 4.32Å; L114-L118 WeakPolarHBondContact O-CB 3.09Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.42Å; L114-L118 PolarHBondContact O-N 3.29Å; L114-L176 HydrophobicContact CD2-CD1 4.47Å; L114-M179 HydrophobicContact CB-SD 3.99Å; L114-M179 HydrophobicContact CD2-CE 4.39Å; L114-M179 HydrophobicContact CD2-SD 3.75Å; L114-M179 HydrophobicContact CG-SD 3.71Å
115	A	97.9	Very high	94.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-44.8	175.5	0	0	0	0	0	111.9	W97 E111 V112 L118 A119 M179 S183	W97-A115 HydrophobicContact CB-CB 3.43Å; W97-A115 VanDerWaalsContact CB-CB 3.43Å; W97-A115 HydrophobicContact CG-CB 3.74Å; E111-A115 PolarHBondContact O-N 3.19Å; V112-A115 PolarHBondContact O-N 3.3Å; A115-L118 PolarHBondContact O-N 3.25Å; A115-A119 PolarHBondContact O-N 3.31Å; A115-M179 HydrophobicContact CB-CG 3.64Å; A115-M179 HydrophobicContact CB-SD 4.16Å; A115-S183 PolarHBondContact O-OG 3.36Å
116	G	98.4	Very high	95	Very high	5 Å²	5	53.2 Å²	53.2	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-62.4	-43.9	174.9	0	0	0	0	0	113	G90 V112 L113 L114 L118 A119 S120	G90-G116 WeakPolarHBondContact CA-O 3.35Å; G90-G116 WeakPolarHBondContact O-CA 3.27Å; V112-G116 PolarHBondContact O-N 3.38Å; V112-G116 VanDerWaalsContact O-N 3.12Å; L113-G116 PolarHBondContact O-N 3.47Å; L114-G116 VanDerWaalsContact C-N 3.33Å; L114-G116 PolarHBondContact O-N 2.97Å; G116-L118 VanDerWaalsContact C-N 3.35Å; G116-L118 PolarHBondContact O-N 3.22Å; G116-A119 PolarHBondContact O-N 3.29Å; G116-S120 PolarHBondContact O-N 2.97Å
117	L	98.4	Very high	95.7	Very high	95 Å²	95	46.9 Å²	46.9	50%	0.497	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-43.7	176.3	179.4	63.6	0	0	0	111.8	L113 L114 A119 S120 I121	L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 PolarHBondContact O-N 2.92Å; L114-L117 PolarHBondContact O-N 2.68Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 2.93Å; L117-S120 PolarHBondContact O-N 3.02Å; L117-I121 HydrophobicContact CD1-CD1 3.85Å; L117-I121 HydrophobicContact CD1-CG1 4Å; L117-I121 HydrophobicContact CD2-CD1 4.29Å; L117-I121 HydrophobicContact CG-CD1 3.71Å; L117-I121 HydrophobicContact CG-CG1 4.26Å; L117-I121 WeakPolarHBondContact O-CB 3.43Å; L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.03Å
118	L	98.3	Very high	96.3	Very high	38 Å²	38	53 Å²	53	20%	0.199	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-38.2	177.2	-72	171.3	0	0	0	111.7	L114 A115 G116 L176 M179 L180	L114-L118 HydrophobicContact CD1-CD1 4.35Å; L114-L118 HydrophobicContact CD1-CG 4.16Å; L114-L118 HydrophobicContact CG-CD1 4.04Å; L114-L118 HydrophobicContact CG-CG 4.32Å; L114-L118 WeakPolarHBondContact O-CB 3.09Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.42Å; L114-L118 PolarHBondContact O-N 3.29Å; A115-L118 PolarHBondContact O-N 3.25Å; G116-L118 VanDerWaalsContact C-N 3.35Å; G116-L118 PolarHBondContact O-N 3.22Å; L118-L176 HydrophobicContact CD1-CD1 4.39Å; L118-M179 HydrophobicContact CD1-CG 4.08Å; L118-M179 HydrophobicContact CD1-SD 3.89Å; L118-L180 HydrophobicContact CD1-CD2 3.9Å; L118-L180 HydrophobicContact CD1-CG 4.33Å; L118-L180 HydrophobicContact CD2-CD2 3.88Å; L118-L180 HydrophobicContact CG-CD2 4.34Å
119	A	98.3	Very high	96.7	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.2	-37.1	175	0	0	0	0	0	112.2	H89 A115 G116 L117 H187	H89-A119 WeakPolarHBondContact O-CB 3.3Å; A115-A119 PolarHBondContact O-N 3.31Å; G116-A119 PolarHBondContact O-N 3.29Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 2.93Å; A119-H187 PolarHBondContact O-ND1 3.21Å
120	S	98.3	Very high	96.9	Very high	23 Å²	23	53 Å²	53	16%	0.161	26%	0.257	C	S	.	.	H	α-helix	trans	-79.9	-27.1	-179.7	-74.7	0	0	0	0	115	N86 G90 G116 L117 I122 D123	N86-S120 PolarHBondContact ND2-O 3.39Å; N86-S120 PolarHBondContact O-OG 2.89Å; N86-S120 VanDerWaalsContact O-OG 3.09Å; N86-S120 WeakPolarHBondContact OD1-CA 3.46Å; N86-S120 WeakPolarHBondContact OD1-CB 3.15Å; N86-S120 PolarHBondContact OD1-O 3.35Å; N86-S120 PolarHBondContact OD1-OG 2.92Å; G90-S120 WeakPolarHBondContact CA-OG 3.29Å; G90-S120 PolarHBondContact N-OG 3.08Å; G116-S120 PolarHBondContact O-N 2.97Å; L117-S120 PolarHBondContact O-N 3.02Å; S120-I122 PolarHBondContact O-N 3.18Å; S120-D123 PolarHBondContact O-N 3.34Å
121	I	97.6	Very high	97.1	Very high	73 Å²	73	48 Å²	48	37%	0.374	26%	0.258	S	S	.	.	H	α-helix	trans	-67.8	-22.5	179.2	-78.3	173.6	0	0	0	111.7	L117 D123 L124	L117-I121 HydrophobicContact CD1-CD1 3.85Å; L117-I121 HydrophobicContact CD1-CG1 4Å; L117-I121 HydrophobicContact CD2-CD1 4.29Å; L117-I121 HydrophobicContact CG-CD1 3.71Å; L117-I121 HydrophobicContact CG-CG1 4.26Å; L117-I121 WeakPolarHBondContact O-CB 3.43Å; L117-I121 WeakPolarHBondContact O-CG1 3.3Å; L117-I121 PolarHBondContact O-N 3.03Å; I121-D123 VanDerWaalsContact C-N 3.27Å; I121-D123 PolarHBondContact O-N 3.47Å; I121-L124 HydrophobicContact CG1-CD1 4.23Å; I121-L124 HydrophobicContact CG2-CD1 4.39Å; I121-L124 VanDerWaalsContact O-CB 3.27Å; I121-L124 WeakPolarHBondContact O-CB 3.28Å; I121-L124 PolarHBondContact O-N 3.13Å
122	I	97.6	Very high	97.3	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-45.2	178.6	-63.4	167.1	0	0	0	110.4	S120 L124 D125 L147 M184 H187	S120-I122 PolarHBondContact O-N 3.18Å; I122-L124 PolarHBondContact O-N 3.3Å; I122-D125 WeakPolarHBondContact O-CB 3.17Å; I122-D125 PolarHBondContact O-N 2.95Å; I122-D125 VanDerWaalsContact O-N 3.07Å; I122-L147 HydrophobicContact CG2-CB 4.07Å; I122-M184 HydrophobicContact CD1-CB 4.13Å; I122-M184 HydrophobicContact CD1-CG 3.85Å; I122-H187 HydrophobicContact CD1-CB 3.75Å
123	D	97.5	Very high	97.2	Very high	27 Å²	27	55.9 Å²	55.9	14%	0.144	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.8	179.1	-77.1	-23.8	0	0	0	114.2	N86 H89 S120 I121 D125 H126 H148 H187	N86-D123 VanDerWaalsContact CB-OD2 3.31Å; N86-D123 WeakPolarHBondContact CB-OD2 3.17Å; N86-D123 PolarHBondContact OD1-OD2 2.95Å; H89-D123 IonicContact CD2-OD2 3.71Å; S120-D123 PolarHBondContact O-N 3.34Å; I121-D123 VanDerWaalsContact C-N 3.27Å; I121-D123 PolarHBondContact O-N 3.47Å; D123-D125 PolarHBondContact O-N 3.03Å; D123-H126 WeakPolarHBondContact O-CB 3.47Å; D123-H126 PolarHBondContact O-N 2.92Å; D123-H148 IonicContact OD1-CE1 3.63Å; D123-H148 IonicContact OD1-NE2 3.34Å; D123-H187 IonicContact OD1-CE1 3.56Å; D123-H187 PolarHBondContact OD1-CE1 3.07Å; D123-H187 IonicContact OD1-NE2 3.12Å; D123-H187 IonicContact OD2-CE1 3.59Å
124	L	96.5	Very high	97.2	Very high	94 Å²	94	53.7 Å²	53.7	49%	0.492	30%	0.298	S	S	.	.	H	α-helix	trans	-69	-18.1	176	-59.7	-176.3	0	0	0	112.2	I121 I122 H126 F127 Y128	I121-L124 HydrophobicContact CG1-CD1 4.23Å; I121-L124 HydrophobicContact CG2-CD1 4.39Å; I121-L124 VanDerWaalsContact O-CB 3.27Å; I121-L124 WeakPolarHBondContact O-CB 3.28Å; I121-L124 PolarHBondContact O-N 3.13Å; I122-L124 PolarHBondContact O-N 3.3Å; L124-H126 PolarHBondContact O-N 2.89Å; L124-F127 HydrophobicContact CD2-CD2 4.27Å; L124-F127 PolarHBondContact O-N 2.95Å; L124-F127 VanDerWaalsContact O-N 3.14Å; L124-Y128 PolarHBondContact O-N 3.38Å; L124-Y128 VanDerWaalsContact O-N 3.12Å
125	D	97.2	Very high	97.1	Very high	6 Å²	6	51.6 Å²	51.6	3%	0.032	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-22.7	174.6	75.6	-8.4	0	0	0	112.9	I122 D123 Y128 M129 P145 L147 H148	I122-D125 WeakPolarHBondContact O-CB 3.17Å; I122-D125 PolarHBondContact O-N 2.95Å; I122-D125 VanDerWaalsContact O-N 3.07Å; D123-D125 PolarHBondContact O-N 3.03Å; D125-Y128 PolarHBondContact O-N 2.8Å; D125-M129 VanDerWaalsContact O-CB 3.28Å; D125-M129 WeakPolarHBondContact O-CB 3.46Å; D125-M129 PolarHBondContact O-N 3.14Å; D125-P145 HydrophobicContact CB-CB 3.96Å; D125-P145 WeakPolarHBondContact OD1-CB 3.41Å; D125-P145 WeakPolarHBondContact OD2-CB 3.5Å; D125-L147 HydrophobicContact CB-CB 4.12Å; D125-L147 HydrophobicContact CB-CD1 3.82Å; D125-L147 HydrophobicContact CB-CG 3.75Å; D125-L147 WeakPolarHBondContact OD2-CA 3.4Å; D125-L147 WeakPolarHBondContact OD2-CB 3.48Å; D125-L147 PolarHBondContact OD2-N 2.93Å; D125-H148 IonicContact OD1-CE1 3.74Å; D125-H148 PolarHBondContact OD1-CE1 3.37Å; D125-H148 IonicContact OD1-ND1 3.32Å; D125-H148 PolarHBondContact OD1-ND1 3.35Å; D125-H148 VanDerWaalsContact OD1-ND1 3.13Å; D125-H148 IonicContact OD2-CE1 3.28Å; D125-H148 IonicContact OD2-ND1 3.89Å; D125-H148 PolarHBondContact OD2-ND1 2.88Å
126	H	97.6	Very high	97	Very high	48 Å²	48	58.9 Å²	58.9	22%	0.222	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-43.8	171.4	-78.5	-100.7	0	0	0	111.4	D123 L124 A130 A138 L141 P145 H148	D123-H126 WeakPolarHBondContact O-CB 3.47Å; D123-H126 PolarHBondContact O-N 2.92Å; L124-H126 PolarHBondContact O-N 2.89Å; H126-A130 WeakPolarHBondContact O-CB 3.34Å; H126-A130 PolarHBondContact O-N 3.22Å; H126-A138 HydrophobicContact CB-CB 3.98Å; H126-A138 PolarHBondContact ND1-O 3.27Å; H126-L141 HydrophobicContact CB-CD1 4.19Å; H126-P145 HydrophobicContact CB-CG 4.38Å; H126-H148 AromaticContact CD2-CE1 3.47Å; H126-H148 PolarHBondContact CD2-CE1 2.97Å; H126-H148 VanDerWaalsContact CD2-CE1 3.47Å; H126-H148 AromaticContact NE2-CE1 3.34Å; H126-H148 PolarHBondContact NE2-CE1 3.25Å; H126-H148 VanDerWaalsContact NE2-CE1 3.34Å; H126-H148 AromaticContact NE2-NE2 3.63Å
127	F	97.3	Very high	96.9	Very high	47 Å²	47	60.2 Å²	60.2	21%	0.206	33%	0.329	C	S	.	.	H	α-helix	trans	-69.6	-38.7	176.7	-66.7	-81.7	0	0	0	111.5	L124 A130 G131 S132 L135 A138	L124-F127 HydrophobicContact CD2-CD2 4.27Å; L124-F127 PolarHBondContact O-N 2.95Å; L124-F127 VanDerWaalsContact O-N 3.14Å; F127-A130 PolarHBondContact O-N 3.23Å; F127-G131 PolarHBondContact O-N 3.31Å; F127-G131 VanDerWaalsContact O-N 3.14Å; F127-S132 WeakPolarHBondContact CD1-O 3.31Å; F127-S132 PolarHBondContact O-N 3.04Å; F127-L135 HydrophobicContact CE1-CB 4.5Å; F127-L135 HydrophobicContact CE1-CD1 4.43Å; F127-L135 HydrophobicContact CZ-CD1 3.89Å; F127-A138 HydrophobicContact CD1-CB 3.75Å; F127-A138 HydrophobicContact CD2-CB 4.43Å; F127-A138 HydrophobicContact CE1-CB 3.83Å; F127-A138 HydrophobicContact CE2-CB 4.48Å; F127-A138 HydrophobicContact CG-CB 4.1Å; F127-A138 HydrophobicContact CZ-CB 4.21Å
128	Y	96.3	Very high	96.8	Very high	190 Å²	190	55.8 Å²	55.8	75%	0.745	31%	0.306	S	S	*	.	H	α-helix	trans	-59.7	-50.1	173.6	174.5	-101.5	0	0	0	111.5	L124 D125 A130 G131	L124-Y128 PolarHBondContact O-N 3.38Å; L124-Y128 VanDerWaalsContact O-N 3.12Å; D125-Y128 PolarHBondContact O-N 2.8Å; Y128-A130 VanDerWaalsContact C-N 3.32Å; Y128-A130 PolarHBondContact O-N 3.39Å; Y128-G131 PolarHBondContact O-N 3.24Å
129	M	96.7	Very high	96.6	Very high	65 Å²	65	57.1 Å²	57.1	32%	0.32	32%	0.316	S	S	.	.	H	α-helix	trans	-68.2	-31.4	179.6	-169.1	178.2	-159.7	0	0	112.4	D125 G131 L141 Q143 P145	D125-M129 VanDerWaalsContact O-CB 3.28Å; D125-M129 WeakPolarHBondContact O-CB 3.46Å; D125-M129 PolarHBondContact O-N 3.14Å; M129-G131 PolarHBondContact O-N 3.24Å; M129-L141 HydrophobicContact CB-CD1 3.92Å; M129-L141 HydrophobicContact CB-CD2 4.33Å; M129-L141 HydrophobicContact CG-CD1 4.17Å; M129-L141 HydrophobicContact CG-CD2 4.16Å; M129-L141 HydrophobicContact SD-CD1 4.01Å; M129-Q143 HydrophobicContact CE-CB 3.6Å; M129-P145 HydrophobicContact CB-CB 4.46Å; M129-P145 HydrophobicContact CB-CG 4.32Å; M129-P145 VanDerWaalsContact SD-CA 3.5Å; M129-P145 HydrophobicContact SD-CB 4.08Å; M129-P145 HydrophobicContact SD-CG 3.81Å
130	A	96.6	Very high	96.4	Very high	27 Å²	27	61.1 Å²	61.1	22%	0.223	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.2	173.4	0	0	0	0	0	113.2	H126 F127 Y128 S132 A137 L141	H126-A130 WeakPolarHBondContact O-CB 3.34Å; H126-A130 PolarHBondContact O-N 3.22Å; F127-A130 PolarHBondContact O-N 3.23Å; Y128-A130 VanDerWaalsContact C-N 3.32Å; Y128-A130 PolarHBondContact O-N 3.39Å; A130-S132 PolarHBondContact O-N 2.84Å; A130-S132 VanDerWaalsContact O-N 3.13Å; A130-A137 HydrophobicContact CB-CB 3.98Å; A130-L141 HydrophobicContact CB-CD2 3.91Å
131	G	96.2	Very high	96.3	Very high	71 Å²	71	61.9 Å²	61.9	73%	0.732	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	22.6	-173.7	0	0	0	0	0	113.3	F127 Y128 M129	F127-G131 PolarHBondContact O-N 3.31Å; F127-G131 VanDerWaalsContact O-N 3.14Å; Y128-G131 PolarHBondContact O-N 3.24Å; M129-G131 PolarHBondContact O-N 3.24Å
132	S	96.1	Very high	96	Very high	45 Å²	45	64.3 Å²	64.3	32%	0.315	37%	0.366	S	S	.	.	S	Bend	trans	-158.3	156.9	-175.9	70.6	0	0	0	0	112.1	F127 A130 S134 A137	F127-S132 WeakPolarHBondContact CD1-O 3.31Å; F127-S132 PolarHBondContact O-N 3.04Å; A130-S132 PolarHBondContact O-N 2.84Å; A130-S132 VanDerWaalsContact O-N 3.13Å; S132-S134 PolarHBondContact O-N 3.44Å; S132-A137 WeakPolarHBondContact OG-CB 3.13Å
133	L	94.3	Very high	95.7	Very high	154 Å²	154	70.6 Å²	70.6	81%	0.806	40%	0.396	S	S	*	.	S	Bend	trans	-84.2	10.7	171.5	-60.7	-179.4	0	0	0	113	L135	L133-L135 PolarHBondContact O-N 3.11Å
134	S	96.4	Very high	95.4	Very high	59 Å²	59	71.8 Å²	71.8	41%	0.413	40%	0.398	S	S	.	.			trans	-75.5	112.8	177.9	175.8	0	0	0	0	109.7	S132 K136 A137 A138	S132-S134 PolarHBondContact O-N 3.44Å; S134-K136 PolarHBondContact O-N 2.96Å; S134-A137 WeakPolarHBondContact O-CB 3.16Å; S134-A137 PolarHBondContact O-N 3.02Å; S134-A137 PolarHBondContact OG-N 3.03Å; S134-A138 PolarHBondContact O-N 3.37Å
135	L	95.4	Very high	95.3	Very high	11 Å²	11	67.4 Å²	67.4	6%	0.058	38%	0.375	C	S	.	.	H	α-helix	trans	-57.2	-36.9	177.2	-178.5	63.6	0	0	0	111.9	L78 W79 A82 F127 L133 A137 A138 V139	L78-L135 HydrophobicContact CD2-CD2 4.28Å; L78-L135 HydrophobicContact CD2-CG 4.2Å; L78-L135 HydrophobicContact CG-CD2 3.81Å; L78-L135 HydrophobicContact CG-CG 4.14Å; W79-L135 VanDerWaalsContact CA-CD2 3.5Å; W79-L135 HydrophobicContact CB-CD2 4.15Å; W79-L135 HydrophobicContact CD2-CB 4.32Å; W79-L135 HydrophobicContact CD2-CD2 3.39Å; W79-L135 HydrophobicContact CD2-CG 4.47Å; W79-L135 HydrophobicContact CE3-CD2 3.65Å; W79-L135 HydrophobicContact CG-CD2 3.62Å; W79-L135 HydrophobicContact CH2-CB 4.01Å; W79-L135 HydrophobicContact CZ2-CB 3.7Å; W79-L135 HydrophobicContact CZ2-CD2 4.33Å; W79-L135 HydrophobicContact CZ3-CB 4.44Å; W79-L135 HydrophobicContact CZ3-CD2 4.21Å; A82-L135 HydrophobicContact CB-CD1 3.74Å; A82-L135 HydrophobicContact CB-CD2 3.89Å; A82-L135 HydrophobicContact CB-CG 4.4Å; F127-L135 HydrophobicContact CE1-CB 4.5Å; F127-L135 HydrophobicContact CE1-CD1 4.43Å; F127-L135 HydrophobicContact CZ-CD1 3.89Å; L133-L135 PolarHBondContact O-N 3.11Å; L135-A137 VanDerWaalsContact C-N 3.28Å; L135-A137 PolarHBondContact O-N 3.49Å; L135-A138 PolarHBondContact O-N 3.13Å; L135-V139 HydrophobicContact CD1-CG1 3.96Å; L135-V139 HydrophobicContact CG-CG1 4.39Å; L135-V139 WeakPolarHBondContact O-CG1 3.46Å; L135-V139 VanDerWaalsContact O-CG2 3.32Å; L135-V139 WeakPolarHBondContact O-CG2 3.41Å; L135-V139 PolarHBondContact O-N 3.13Å; L135-V139 VanDerWaalsContact O-N 3.09Å
136	K	96.3	Very high	95.2	Very high	152 Å²	152	69.8 Å²	69.8	66%	0.661	39%	0.391	S	S	*	.	H	α-helix	trans	-61.5	-37.6	176.1	-173.2	177.7	179.3	-178.9	0	111.8	L78 S134 S140	L78-K136 HydrophobicContact CD2-CB 4.45Å; S134-K136 PolarHBondContact O-N 2.96Å; K136-S140 VanDerWaalsContact O-CB 3.28Å; K136-S140 WeakPolarHBondContact O-CB 3.19Å; K136-S140 PolarHBondContact O-N 2.91Å; K136-S140 PolarHBondContact O-OG 3.5Å
137	A	95.9	Very high	95.1	Very high	34 Å²	34	70.6 Å²	70.6	28%	0.281	40%	0.396	S	S	.	.	H	α-helix	trans	-71.3	-45.3	176.2	0	0	0	0	0	111.3	A130 S132 S134 L135 V139 S140	A130-A137 HydrophobicContact CB-CB 3.98Å; S132-A137 WeakPolarHBondContact OG-CB 3.13Å; S134-A137 WeakPolarHBondContact O-CB 3.16Å; S134-A137 PolarHBondContact O-N 3.02Å; S134-A137 PolarHBondContact OG-N 3.03Å; L135-A137 VanDerWaalsContact C-N 3.28Å; L135-A137 PolarHBondContact O-N 3.49Å; A137-V139 VanDerWaalsContact C-N 3.29Å; A137-V139 PolarHBondContact O-N 3.36Å; A137-S140 PolarHBondContact O-N 2.9Å; A137-S140 VanDerWaalsContact O-N 3.1Å
138	A	96.3	Very high	95.1	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-57.7	-36.5	179.9	0	0	0	0	0	113.6	H126 F127 S134 L135 L141	H126-A138 HydrophobicContact CB-CB 3.98Å; H126-A138 PolarHBondContact ND1-O 3.27Å; F127-A138 HydrophobicContact CD1-CB 3.75Å; F127-A138 HydrophobicContact CD2-CB 4.43Å; F127-A138 HydrophobicContact CE1-CB 3.83Å; F127-A138 HydrophobicContact CE2-CB 4.48Å; F127-A138 HydrophobicContact CG-CB 4.1Å; F127-A138 HydrophobicContact CZ-CB 4.21Å; S134-A138 PolarHBondContact O-N 3.37Å; L135-A138 PolarHBondContact O-N 3.13Å; A138-L141 WeakPolarHBondContact O-CD1 2.98Å; A138-L141 WeakPolarHBondContact O-CG 3.49Å
139	V	94.4	Very high	95.1	Very high	67 Å²	67	59.7 Å²	59.7	41%	0.406	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-5.5	179.2	-55.8	0	0	0	0	114.3	L78 L135 A137	L78-V139 HydrophobicContact CD1-CG1 4.45Å; L78-V139 HydrophobicContact CD1-CG2 4.11Å; L78-V139 HydrophobicContact CD2-CG2 4.29Å; L135-V139 HydrophobicContact CD1-CG1 3.96Å; L135-V139 HydrophobicContact CG-CG1 4.39Å; L135-V139 WeakPolarHBondContact O-CG1 3.46Å; L135-V139 VanDerWaalsContact O-CG2 3.32Å; L135-V139 WeakPolarHBondContact O-CG2 3.41Å; L135-V139 PolarHBondContact O-N 3.13Å; L135-V139 VanDerWaalsContact O-N 3.09Å; A137-V139 VanDerWaalsContact C-N 3.29Å; A137-V139 PolarHBondContact O-N 3.36Å
140	S	94.9	Very high	95.1	Very high	83 Å²	83	57.4 Å²	57.4	58%	0.58	34%	0.344	S	S	*	.	S	Bend	trans	-113.4	25.7	-176.6	-51	0	0	0	0	112.3	K136 A137	K136-S140 VanDerWaalsContact O-CB 3.28Å; K136-S140 WeakPolarHBondContact O-CB 3.19Å; K136-S140 PolarHBondContact O-N 2.91Å; K136-S140 PolarHBondContact O-OG 3.5Å; A137-S140 PolarHBondContact O-N 2.9Å; A137-S140 VanDerWaalsContact O-N 3.1Å
141	L	94.3	Very high	95.1	Very high	39 Å²	39	57.5 Å²	57.5	20%	0.204	34%	0.343	C	S	.	.			trans	-66.9	141.3	-176.9	-69.3	172.7	0	0	0	111.7	H126 M129 A130 A138 Q143 P145	H126-L141 HydrophobicContact CB-CD1 4.19Å; M129-L141 HydrophobicContact CB-CD1 3.92Å; M129-L141 HydrophobicContact CB-CD2 4.33Å; M129-L141 HydrophobicContact CG-CD1 4.17Å; M129-L141 HydrophobicContact CG-CD2 4.16Å; M129-L141 HydrophobicContact SD-CD1 4.01Å; A130-L141 HydrophobicContact CB-CD2 3.91Å; A138-L141 WeakPolarHBondContact O-CD1 2.98Å; A138-L141 WeakPolarHBondContact O-CG 3.49Å; L141-Q143 VanDerWaalsContact C-N 3.28Å; L141-Q143 PolarHBondContact O-N 3.49Å; L141-P145 HydrophobicContact CD1-CG 3.53Å
142	P	92.1	Very high	95.1	Very high	125 Å²	125	56.9 Å²	56.9	81%	0.812	32%	0.323	S	S	*	.	S	Bend	trans	-75	-19.4	178.6	30.9	-35.7	0	0	0	113
143	Q	90.6	Very high	95.2	Very high	138 Å²	138	55.1 Å²	55.1	65%	0.645	31%	0.31	S	S	*	.	S	Bend	trans	-137.6	155.4	-176.3	-68.4	179.4	1	0	0	109.5	M129 L141	M129-Q143 HydrophobicContact CE-CB 3.6Å; L141-Q143 VanDerWaalsContact C-N 3.28Å; L141-Q143 PolarHBondContact O-N 3.49Å
144	R	91.6	Very high	95.2	Very high	51 Å²	51	50.9 Å²	50.9	19%	0.192	29%	0.292	C	S	.	.			trans	-72.1	130.8	179.3	-162.9	175.3	-172	-174.6	-4.5	110	H148 D191 G196 W198	R144-H148 HydrophobicContact CG-CB 3.85Å; R144-H148 VanDerWaalsContact NE-CB 3.25Å; R144-D191 IonicContact NH2-OD2 2.92Å; R144-G196 PolarHBondContact NH1-O 3.47Å; R144-W198 HydrophobicContact CB-CE3 4.29Å; R144-W198 HydrophobicContact CB-CZ3 4.43Å; R144-W198 HydrophobicContact CG-CE3 4.38Å
145	P	95.4	Very high	95.2	Very high	2 Å²	2	52 Å²	52	1%	0.013	30%	0.295	C	S	.	.			trans	-58.1	151.6	175.5	-31.7	40.7	0	0	0	114.5	D125 H126 M129 L141 L147 H148 W198	D125-P145 HydrophobicContact CB-CB 3.96Å; D125-P145 WeakPolarHBondContact OD1-CB 3.41Å; D125-P145 WeakPolarHBondContact OD2-CB 3.5Å; H126-P145 HydrophobicContact CB-CG 4.38Å; M129-P145 HydrophobicContact CB-CB 4.46Å; M129-P145 HydrophobicContact CB-CG 4.32Å; M129-P145 VanDerWaalsContact SD-CA 3.5Å; M129-P145 HydrophobicContact SD-CB 4.08Å; M129-P145 HydrophobicContact SD-CG 3.81Å; L141-P145 HydrophobicContact CD1-CG 3.53Å; P145-L147 PolarHBondContact O-N 3.31Å; P145-H148 WeakPolarHBondContact O-CB 3.24Å; P145-H148 PolarHBondContact O-N 3.32Å; P145-W198 WeakPolarHBondContact O-CZ3 3.34Å
146	P	94.6	Very high	95.2	Very high	57 Å²	57	54.2 Å²	54.2	37%	0.37	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67.1	-32	-168.1	25.2	-34.3	0	0	0	114.4	H148 C149 L152	P146-H148 PolarHBondContact O-N 2.86Å; P146-C149 WeakPolarHBondContact O-CB 3.39Å; P146-C149 PolarHBondContact O-N 3.34Å; P146-L152 WeakPolarHBondContact O-CD1 3.49Å
147	L	96.1	Very high	95.2	Very high	64 Å²	64	47.6 Å²	47.6	34%	0.335	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-68	-21.1	-179.6	-57.4	-176.1	0	0	0	111.7	I122 D125 P145 C149 H188	I122-L147 HydrophobicContact CG2-CB 4.07Å; D125-L147 HydrophobicContact CB-CB 4.12Å; D125-L147 HydrophobicContact CB-CD1 3.82Å; D125-L147 HydrophobicContact CB-CG 3.75Å; D125-L147 WeakPolarHBondContact OD2-CA 3.4Å; D125-L147 WeakPolarHBondContact OD2-CB 3.48Å; D125-L147 PolarHBondContact OD2-N 2.93Å; P145-L147 PolarHBondContact O-N 3.31Å; L147-C149 PolarHBondContact O-N 3.11Å; L147-H188 PolarHBondContact O-CE1 2.92Å; L147-H188 PolarHBondContact O-NE2 3.26Å
148	H	96.7	Very high	95.2	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-80.1	6.1	173.8	-62.3	75.6	0	0	0	114.2	D123 D125 H126 R144 P145 P146 S150 H187 D191	D123-H148 IonicContact OD1-CE1 3.63Å; D123-H148 IonicContact OD1-NE2 3.34Å; D125-H148 IonicContact OD1-CE1 3.74Å; D125-H148 PolarHBondContact OD1-CE1 3.37Å; D125-H148 IonicContact OD1-ND1 3.32Å; D125-H148 PolarHBondContact OD1-ND1 3.35Å; D125-H148 VanDerWaalsContact OD1-ND1 3.13Å; D125-H148 IonicContact OD2-CE1 3.28Å; D125-H148 IonicContact OD2-ND1 3.89Å; D125-H148 PolarHBondContact OD2-ND1 2.88Å; H126-H148 AromaticContact CD2-CE1 3.47Å; H126-H148 PolarHBondContact CD2-CE1 2.97Å; H126-H148 VanDerWaalsContact CD2-CE1 3.47Å; H126-H148 AromaticContact NE2-CE1 3.34Å; H126-H148 PolarHBondContact NE2-CE1 3.25Å; H126-H148 VanDerWaalsContact NE2-CE1 3.34Å; H126-H148 AromaticContact NE2-NE2 3.63Å; R144-H148 HydrophobicContact CG-CB 3.85Å; R144-H148 VanDerWaalsContact NE-CB 3.25Å; P145-H148 WeakPolarHBondContact O-CB 3.24Å; P145-H148 PolarHBondContact O-N 3.32Å; P146-H148 PolarHBondContact O-N 2.86Å; H148-S150 PolarHBondContact O-N 3.07Å; H148-H187 AromaticContact CD2-NE2 3.68Å; H148-H187 AromaticContact NE2-NE2 3.24Å; H148-H187 PolarHBondContact NE2-NE2 2.9Å; H148-D191 IonicContact CD2-OD2 3.03Å; H148-D191 PolarHBondContact CD2-OD2 2.99Å; H148-D191 VanDerWaalsContact CD2-OD2 3.28Å; H148-D191 IonicContact NE2-OD2 3.64Å
149	C	96.8	Very high	95.1	Very high	8 Å²	8	55.1 Å²	55.1	5%	0.054	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-74.9	108.8	168.7	-177.3	0	0	0	0	109.7	P146 L147 S151 L152 W198 C200	P146-C149 WeakPolarHBondContact O-CB 3.39Å; P146-C149 PolarHBondContact O-N 3.34Å; L147-C149 PolarHBondContact O-N 3.11Å; C149-S151 PolarHBondContact O-N 3.37Å; C149-L152 HydrophobicContact CB-CD1 3.92Å; C149-L152 HydrophobicContact CB-CG 3.89Å; C149-L152 VanDerWaalsContact O-CB 3.31Å; C149-L152 WeakPolarHBondContact O-CB 3.28Å; C149-L152 PolarHBondContact O-N 3.08Å; C149-W198 VanDerWaalsContact CA-CE3 3.43Å; C149-W198 HydrophobicContact CB-CD2 3.93Å; C149-W198 HydrophobicContact CB-CE3 3.53Å; C149-W198 HydrophobicContact CB-CH2 4.18Å; C149-W198 HydrophobicContact CB-CZ3 3.68Å; C149-C200 VanDerWaalsContact SG-CB 3.53Å
150	S	97.1	Very high	95	Very high	17 Å²	17	53.8 Å²	53.8	12%	0.119	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.4	-175.7	-54.3	0	0	0	0	112.7	H148 L152 I153 P154 H188 W198	H148-S150 PolarHBondContact O-N 3.07Å; S150-L152 PolarHBondContact O-N 3.16Å; S150-I153 WeakPolarHBondContact O-CB 3.44Å; S150-I153 WeakPolarHBondContact O-CG1 3.41Å; S150-I153 PolarHBondContact O-N 3.03Å; S150-P154 WeakPolarHBondContact O-CD 3.32Å; S150-H188 WeakPolarHBondContact CA-ND1 3.42Å; S150-H188 PolarHBondContact OG-ND1 2.67Å; S150-W198 WeakPolarHBondContact CA-O 3.43Å; S150-W198 VanDerWaalsContact CB-O 3.28Å; S150-W198 WeakPolarHBondContact CB-O 3.49Å; S150-W198 PolarHBondContact N-O 3.3Å
151	S	96.1	Very high	94.8	Very high	29 Å²	29	54.4 Å²	54.4	20%	0.203	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.8	172	-58.5	0	0	0	0	113.2	C149 I153 P154 V155 V199 C200	C149-S151 PolarHBondContact O-N 3.37Å; S151-I153 VanDerWaalsContact C-N 3.33Å; S151-P154 WeakPolarHBondContact O-CD 3.08Å; S151-P154 WeakPolarHBondContact O-CG 3.19Å; S151-V155 WeakPolarHBondContact O-CG2 3.19Å; S151-V199 WeakPolarHBondContact OG-CA 3.45Å; S151-C200 WeakPolarHBondContact CB-O 3.28Å; S151-C200 PolarHBondContact OG-N 3.31Å; S151-C200 PolarHBondContact OG-O 3.32Å
152	L	96.1	Very high	94.7	Very high	57 Å²	57	57.8 Å²	57.8	30%	0.298	31%	0.31	S	S	.	.	H	α-helix	trans	-72.8	-25.5	177.3	-67.8	179.6	0	0	0	112.8	P146 C149 S150 V155 I156	P146-L152 WeakPolarHBondContact O-CD1 3.49Å; C149-L152 HydrophobicContact CB-CD1 3.92Å; C149-L152 HydrophobicContact CB-CG 3.89Å; C149-L152 VanDerWaalsContact O-CB 3.31Å; C149-L152 WeakPolarHBondContact O-CB 3.28Å; C149-L152 PolarHBondContact O-N 3.08Å; S150-L152 PolarHBondContact O-N 3.16Å; L152-V155 PolarHBondContact O-N 2.98Å; L152-I156 HydrophobicContact CB-CD1 4.05Å; L152-I156 WeakPolarHBondContact O-CB 3.07Å; L152-I156 VanDerWaalsContact O-CG1 3.3Å; L152-I156 WeakPolarHBondContact O-CG1 3.07Å; L152-I156 PolarHBondContact O-N 3.25Å
153	I	96.9	Very high	94.7	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.046	30%	0.296	C	S	.	.	H	α-helix	trans	-55	-59.4	-178.3	-58.3	175.9	0	0	0	111.3	S150 S151 V155 I156 C157 F181 M184 H188	S150-I153 WeakPolarHBondContact O-CB 3.44Å; S150-I153 WeakPolarHBondContact O-CG1 3.41Å; S150-I153 PolarHBondContact O-N 3.03Å; S151-I153 VanDerWaalsContact C-N 3.33Å; I153-V155 VanDerWaalsContact C-N 3.29Å; I153-V155 PolarHBondContact O-N 3.46Å; I153-I156 PolarHBondContact O-N 3.49Å; I153-C157 WeakPolarHBondContact O-CB 3.05Å; I153-C157 PolarHBondContact O-N 3.36Å; I153-C157 PolarHBondContact O-SG 3.21Å; I153-F181 HydrophobicContact CG2-CD2 3.9Å; I153-F181 HydrophobicContact CG2-CE2 4.44Å; I153-M184 HydrophobicContact CD1-CB 3.98Å; I153-M184 HydrophobicContact CG1-CB 3.82Å; I153-M184 HydrophobicContact CG1-CE 4.23Å; I153-M184 HydrophobicContact CG1-SD 4.37Å; I153-M184 HydrophobicContact CG2-CB 4.34Å; I153-H188 HydrophobicContact CD1-CB 4.32Å
154	P	95.8	Very high	94.6	Very high	65 Å²	65	50.6 Å²	50.6	42%	0.422	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-35.6	178.8	25.3	-35	0	0	0	112.1	S150 S151 C157 L158	S150-P154 WeakPolarHBondContact O-CD 3.32Å; S151-P154 WeakPolarHBondContact O-CD 3.08Å; S151-P154 WeakPolarHBondContact O-CG 3.19Å; P154-C157 PolarHBondContact O-N 3.02Å; P154-L158 VanDerWaalsContact O-CB 3.22Å; P154-L158 WeakPolarHBondContact O-CB 3.42Å; P154-L158 WeakPolarHBondContact O-CG 3.34Å; P154-L158 PolarHBondContact O-N 2.91Å
155	V	96.3	Very high	94.4	Very high	81 Å²	81	56.7 Å²	56.7	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-50.3	178.7	174.3	0	0	0	0	110.9	S151 L152 I153 T159	S151-V155 WeakPolarHBondContact O-CG2 3.19Å; L152-V155 PolarHBondContact O-N 2.98Å; I153-V155 VanDerWaalsContact C-N 3.29Å; I153-V155 PolarHBondContact O-N 3.46Å; V155-T159 WeakPolarHBondContact O-CB 3.21Å; V155-T159 PolarHBondContact O-N 3.38Å; V155-T159 PolarHBondContact O-OG1 3.45Å
156	I	96	Very high	94.1	Very high	58 Å²	58	61.2 Å²	61.2	30%	0.297	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-47.9	179.7	-68.9	168	0	0	0	110.3	L152 I153 T159 L160 L180 M184	L152-I156 HydrophobicContact CB-CD1 4.05Å; L152-I156 WeakPolarHBondContact O-CB 3.07Å; L152-I156 VanDerWaalsContact O-CG1 3.3Å; L152-I156 WeakPolarHBondContact O-CG1 3.07Å; L152-I156 PolarHBondContact O-N 3.25Å; I153-I156 PolarHBondContact O-N 3.49Å; I156-T159 PolarHBondContact O-N 3.01Å; I156-L160 WeakPolarHBondContact O-CB 2.94Å; I156-L160 PolarHBondContact O-N 3.22Å; I156-L180 HydrophobicContact CG2-CD1 4.32Å; I156-M184 HydrophobicContact CD1-CE 4.1Å; I156-M184 HydrophobicContact CD1-SD 4.16Å
157	C	95.7	Very high	93.6	Very high	13 Å²	13	60.7 Å²	60.7	9%	0.088	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-45	-177.1	-63.8	0	0	0	0	112.1	I153 P154 R161 P177	I153-C157 WeakPolarHBondContact O-CB 3.05Å; I153-C157 PolarHBondContact O-N 3.36Å; I153-C157 PolarHBondContact O-SG 3.21Å; P154-C157 PolarHBondContact O-N 3.02Å; C157-R161 WeakPolarHBondContact O-CB 3.42Å; C157-R161 PolarHBondContact O-N 3.16Å; C157-P177 PolarHBondContact SG-O 3Å
158	L	94.6	Very high	92.9	Very high	123 Å²	123	68.2 Å²	68.2	64%	0.644	34%	0.344	S	S	*	.	H	α-helix	trans	-70.5	-39.6	179	-66.6	175.3	0	0	0	111.8	P154 R161 F162	P154-L158 VanDerWaalsContact O-CB 3.22Å; P154-L158 WeakPolarHBondContact O-CB 3.42Å; P154-L158 WeakPolarHBondContact O-CG 3.34Å; P154-L158 PolarHBondContact O-N 2.91Å; L158-R161 PolarHBondContact O-N 3.33Å; L158-F162 WeakPolarHBondContact O-CB 3.42Å; L158-F162 PolarHBondContact O-N 3.36Å
159	T	95.1	Very high	91.9	Very high	70 Å²	70	72.9 Å²	72.9	43%	0.429	37%	0.369	S	S	.	.	H	α-helix	trans	-61.9	-47.3	175.3	-60	0	0	0	0	110.6	V155 I156 R161 F162 L163	V155-T159 WeakPolarHBondContact O-CB 3.21Å; V155-T159 PolarHBondContact O-N 3.38Å; V155-T159 PolarHBondContact O-OG1 3.45Å; I156-T159 PolarHBondContact O-N 3.01Å; T159-R161 VanDerWaalsContact C-N 3.34Å; T159-R161 PolarHBondContact O-N 2.89Å; T159-F162 WeakPolarHBondContact O-CB 3.43Å; T159-F162 PolarHBondContact O-N 3.3Å; T159-L163 HydrophobicContact CG2-CD1 4.14Å; T159-L163 HydrophobicContact CG2-CG 4.35Å; T159-L163 WeakPolarHBondContact O-CG 3.45Å; T159-L163 PolarHBondContact O-N 3.41Å
160	L	93.4	Very high	90.2	Very high	39 Å²	39	80 Å²	80	20%	0.204	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-45.6	176.7	179.8	63.4	0	0	0	111	I156 F162 L163 M164 L176 P177 L180	I156-L160 WeakPolarHBondContact O-CB 2.94Å; I156-L160 PolarHBondContact O-N 3.22Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 3.07Å; L160-L163 PolarHBondContact O-N 2.79Å; L160-M164 HydrophobicContact CD1-CG 4.28Å; L160-M164 HydrophobicContact CD1-SD 4.4Å; L160-M164 HydrophobicContact CG-CG 4.42Å; L160-M164 HydrophobicContact CG-SD 4.06Å; L160-M164 WeakPolarHBondContact O-CB 3.5Å; L160-M164 VanDerWaalsContact O-CG 3.23Å; L160-M164 WeakPolarHBondContact O-CG 3.28Å; L160-M164 PolarHBondContact O-N 2.99Å; L160-L176 HydrophobicContact CD2-CB 4.32Å; L160-L176 HydrophobicContact CD2-CD2 3.85Å; L160-L176 HydrophobicContact CD2-CG 3.79Å; L160-P177 HydrophobicContact CD2-CB 4.4Å; L160-P177 HydrophobicContact CD2-CG 3.91Å; L160-P177 HydrophobicContact CG-CG 4.07Å; L160-L180 HydrophobicContact CD2-CD1 3.5Å; L160-L180 VanDerWaalsContact CD2-CD1 3.5Å
161	R	90.4	Very high	88.6	Confident	96 Å²	96	84.3 Å²	84.3	36%	0.362	42%	0.42	S	S	.	.	H	α-helix	trans	-58.9	-41.4	176.9	-176.9	62.2	175.7	-123.8	-1.4	111.8	C157 L158 T159 W165 P177 T233	C157-R161 WeakPolarHBondContact O-CB 3.42Å; C157-R161 PolarHBondContact O-N 3.16Å; L158-R161 PolarHBondContact O-N 3.33Å; T159-R161 VanDerWaalsContact C-N 3.34Å; T159-R161 PolarHBondContact O-N 2.89Å; R161-W165 WeakPolarHBondContact O-CB 3.49Å; R161-W165 PolarHBondContact O-N 2.92Å; R161-P177 HydrophobicContact CB-CG 4.31Å; R161-T233 PolarHBondContact NH1-OG1 3.36Å
162	F	91.6	Very high	87.1	Confident	110 Å²	110	86.8 Å²	86.8	48%	0.482	44%	0.438	S	S	.	.	H	α-helix	trans	-65.7	-44.9	176.4	178.2	-109.2	0	0	0	112.2	L158 T159 L160 M164 W165 L166	L158-F162 WeakPolarHBondContact O-CB 3.42Å; L158-F162 PolarHBondContact O-N 3.36Å; T159-F162 WeakPolarHBondContact O-CB 3.43Å; T159-F162 PolarHBondContact O-N 3.3Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 3.07Å; F162-M164 PolarHBondContact O-N 3.43Å; F162-W165 AromaticContact CD2-CE3 3.98Å; F162-W165 HydrophobicContact CD2-CE3 3.98Å; F162-W165 HydrophobicContact CD2-CZ3 4.35Å; F162-W165 AromaticContact CE2-CE3 3.85Å; F162-W165 HydrophobicContact CE2-CE3 3.85Å; F162-W165 AromaticContact CE2-CZ3 3.77Å; F162-W165 HydrophobicContact CE2-CZ3 3.77Å; F162-W165 WeakPolarHBondContact O-CB 3.28Å; F162-W165 PolarHBondContact O-N 3.43Å; F162-L166 HydrophobicContact CD1-CD1 3.95Å; F162-L166 HydrophobicContact CD1-CG 4.46Å; F162-L166 HydrophobicContact CE1-CD1 3.38Å; F162-L166 HydrophobicContact CE1-CG 4.06Å; F162-L166 HydrophobicContact CE2-CD1 4.45Å; F162-L166 HydrophobicContact CE2-CD2 4.46Å; F162-L166 HydrophobicContact CE2-CG 4.29Å; F162-L166 HydrophobicContact CZ-CD1 3.67Å; F162-L166 HydrophobicContact CZ-CD2 4.17Å; F162-L166 HydrophobicContact CZ-CG 3.97Å; F162-L166 PolarHBondContact O-N 3.23Å
163	L	91.6	Very high	86.1	Confident	97 Å²	97	90.9 Å²	90.9	51%	0.508	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-41.6	176.4	-70.6	176.5	0	0	0	112.1	T159 L160 W165 L166 G167	T159-L163 HydrophobicContact CG2-CD1 4.14Å; T159-L163 HydrophobicContact CG2-CG 4.35Å; T159-L163 WeakPolarHBondContact O-CG 3.45Å; T159-L163 PolarHBondContact O-N 3.41Å; L160-L163 PolarHBondContact O-N 2.79Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 2.66Å; L163-L166 PolarHBondContact O-N 3.3Å; L163-G167 PolarHBondContact O-N 3.45Å
164	M	88.9	Confident	85.4	Confident	16 Å²	16	90.9 Å²	90.9	8%	0.079	45%	0.45	C	S	.	.	H	α-helix	trans	-63.4	-38.7	175.2	-70.3	174.7	66.6	0	0	112.1	L160 F162 R168 L169 W173 P177	L160-M164 HydrophobicContact CD1-CG 4.28Å; L160-M164 HydrophobicContact CD1-SD 4.4Å; L160-M164 HydrophobicContact CG-CG 4.42Å; L160-M164 HydrophobicContact CG-SD 4.06Å; L160-M164 WeakPolarHBondContact O-CB 3.5Å; L160-M164 VanDerWaalsContact O-CG 3.23Å; L160-M164 WeakPolarHBondContact O-CG 3.28Å; L160-M164 PolarHBondContact O-N 2.99Å; F162-M164 PolarHBondContact O-N 3.43Å; M164-R168 PolarHBondContact O-N 3.35Å; M164-R168 VanDerWaalsContact O-N 3.09Å; M164-L169 HydrophobicContact CB-CB 4.42Å; M164-L169 PolarHBondContact O-N 3.18Å; M164-W173 VanDerWaalsContact CE-C 3.41Å; M164-W173 HydrophobicContact CE-CB 3.92Å; M164-W173 WeakPolarHBondContact CE-O 3.38Å; M164-P177 HydrophobicContact SD-CG 3.74Å
165	W	86.8	Confident	85	Confident	178 Å²	178	88.1 Å²	88.1	67%	0.674	43%	0.433	S	S	*	.	H	α-helix	trans	-63.6	-47.3	174.4	174.1	80	0	0	0	111.4	R161 F162 L163 G167 R168	R161-W165 WeakPolarHBondContact O-CB 3.49Å; R161-W165 PolarHBondContact O-N 2.92Å; F162-W165 AromaticContact CD2-CE3 3.98Å; F162-W165 HydrophobicContact CD2-CE3 3.98Å; F162-W165 HydrophobicContact CD2-CZ3 4.35Å; F162-W165 AromaticContact CE2-CE3 3.85Å; F162-W165 HydrophobicContact CE2-CE3 3.85Å; F162-W165 AromaticContact CE2-CZ3 3.77Å; F162-W165 HydrophobicContact CE2-CZ3 3.77Å; F162-W165 WeakPolarHBondContact O-CB 3.28Å; F162-W165 PolarHBondContact O-N 3.43Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 2.66Å; W165-G167 PolarHBondContact O-N 3.02Å; W165-R168 PolarHBondContact O-N 2.93Å
166	L	88.9	Confident	84.8	Confident	98 Å²	98	86 Å²	86	51%	0.513	42%	0.418	S	S	.	.	H	α-helix	trans	-59.7	-45	175	-74.3	179.5	0	0	0	112.2	F162 L163 R168	F162-L166 HydrophobicContact CD1-CD1 3.95Å; F162-L166 HydrophobicContact CD1-CG 4.46Å; F162-L166 HydrophobicContact CE1-CD1 3.38Å; F162-L166 HydrophobicContact CE1-CG 4.06Å; F162-L166 HydrophobicContact CE2-CD1 4.45Å; F162-L166 HydrophobicContact CE2-CD2 4.46Å; F162-L166 HydrophobicContact CE2-CG 4.29Å; F162-L166 HydrophobicContact CZ-CD1 3.67Å; F162-L166 HydrophobicContact CZ-CD2 4.17Å; F162-L166 HydrophobicContact CZ-CG 3.97Å; F162-L166 PolarHBondContact O-N 3.23Å; L163-L166 PolarHBondContact O-N 3.3Å; L166-R168 PolarHBondContact O-N 3.03Å
167	G	85	Confident	84.7	Confident	46 Å²	46	83.5 Å²	83.5	47%	0.474	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-0	-179.8	0	0	0	0	0	114.6	L163 W165 L169	L163-G167 PolarHBondContact O-N 3.45Å; W165-G167 PolarHBondContact O-N 3.02Å; G167-L169 PolarHBondContact O-N 3.43Å; G167-L169 VanDerWaalsContact O-N 3.11Å
168	R	81.6	Confident	84.7	Confident	221 Å²	221	84.6 Å²	84.6	83%	0.834	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	29.9	-175.3	-56	-176.7	177.2	-164.3	-0.6	113.3	M164 W165 L166 K170	M164-R168 PolarHBondContact O-N 3.35Å; M164-R168 VanDerWaalsContact O-N 3.09Å; W165-R168 PolarHBondContact O-N 2.93Å; L166-R168 PolarHBondContact O-N 3.03Å; R168-K170 PolarHBondContact O-N 3.5Å
169	L	74.3	Confident	84.8	Confident	99 Å²	99	78.9 Å²	78.9	52%	0.518	38%	0.378	S	S	.	.			trans	-81	61.4	178.3	-58.9	178.9	0	0	0	109.7	M164 G167	M164-L169 HydrophobicContact CB-CB 4.42Å; M164-L169 PolarHBondContact O-N 3.18Å; G167-L169 PolarHBondContact O-N 3.43Å; G167-L169 VanDerWaalsContact O-N 3.11Å
170	K	61.7	Low	84.8	Confident	158 Å²	158	76.9 Å²	76.9	69%	0.687	37%	0.365	S	S	*	.			trans	-72.1	-37.6	-165.8	-102.7	-177.8	172.2	-175.8	0	114.4	R168	R168-K170 PolarHBondContact O-N 3.5Å
171	D	64.3	Low	85.1	Confident	107 Å²	107	77.4 Å²	77.4	57%	0.572	37%	0.365	S	S	*	.	S	Bend	trans	-114	-35.1	-160.9	-56.7	-37.4	0	0	0	114.7
172	S	64	Low	85.4	Confident	82 Å²	82	72.8 Å²	72.8	57%	0.573	35%	0.348	S	S	*	.	S	Bend	trans	-75.4	-31.4	-170.9	-59.2	0	0	0	0	114.3	K240	S172-K240 PolarHBondContact O-NZ 2.92Å
173	W	74.4	Confident	85.7	Confident	142 Å²	142	67.6 Å²	67.6	54%	0.538	33%	0.325	S	S	.	.	S	Bend	trans	-127.7	14.8	-169.3	-62.6	90.6	0	0	0	114.2	M164 S175 L176	M164-W173 VanDerWaalsContact CE-C 3.41Å; M164-W173 HydrophobicContact CE-CB 3.92Å; M164-W173 WeakPolarHBondContact CE-O 3.38Å; W173-S175 PolarHBondContact O-N 3.32Å; W173-L176 HydrophobicContact CB-CB 4.45Å; W173-L176 HydrophobicContact CE3-CB 4.49Å; W173-L176 HydrophobicContact CE3-CD2 4.04Å; W173-L176 VanDerWaalsContact O-CB 3.27Å; W173-L176 WeakPolarHBondContact O-CB 3.35Å; W173-L176 PolarHBondContact O-N 2.9Å
174	C	82.2	Confident	86	Confident	10 Å²	10	63.5 Å²	63.5	7%	0.068	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.5	-174.5	62.3	0	0	0	0	114.4	T233 V236	C174-T233 HydrophobicContact CB-CG2 4.25Å; C174-T233 WeakPolarHBondContact O-CG2 3.23Å; C174-V236 HydrophobicContact CB-CG1 4.38Å
175	S	88.3	Confident	86.5	Confident	7 Å²	7	63.8 Å²	63.8	5%	0.049	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.9	174.4	50.2	0	0	0	0	114.4	E111 W173 W178 M179	E111-S175 PolarHBondContact OE2-OG 3.33Å; W173-S175 PolarHBondContact O-N 3.32Å; S175-W178 WeakPolarHBondContact O-CA 3.49Å; S175-W178 WeakPolarHBondContact O-CB 3.34Å; S175-W178 PolarHBondContact O-N 3.4Å; S175-M179 PolarHBondContact O-N 2.82Å
176	L	91.9	Very high	87	Confident	35 Å²	35	55.4 Å²	55.4	18%	0.183	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-43.7	-170.1	-175	65.5	0	0	0	113.9	L114 L118 L160 W173 W178 M179 L180	L114-L176 HydrophobicContact CD2-CD1 4.47Å; L118-L176 HydrophobicContact CD1-CD1 4.39Å; L160-L176 HydrophobicContact CD2-CB 4.32Å; L160-L176 HydrophobicContact CD2-CD2 3.85Å; L160-L176 HydrophobicContact CD2-CG 3.79Å; W173-L176 HydrophobicContact CB-CB 4.45Å; W173-L176 HydrophobicContact CE3-CB 4.49Å; W173-L176 HydrophobicContact CE3-CD2 4.04Å; W173-L176 VanDerWaalsContact O-CB 3.27Å; W173-L176 WeakPolarHBondContact O-CB 3.35Å; W173-L176 PolarHBondContact O-N 2.9Å; L176-W178 VanDerWaalsContact C-N 3.27Å; L176-W178 PolarHBondContact O-N 3.32Å; L176-M179 PolarHBondContact O-N 3.39Å; L176-L180 HydrophobicContact CG-CD1 4.46Å; L176-L180 WeakPolarHBondContact O-CG 3.35Å; L176-L180 PolarHBondContact O-N 3.06Å
177	P	94.4	Very high	87.5	Confident	6 Å²	6	50.7 Å²	50.7	4%	0.039	25%	0.25	C	S	.	.	H	α-helix	trans	-59.9	-36.9	174.4	-23.4	33.7	0	0	0	113.1	C157 L160 R161 M164 F181	C157-P177 PolarHBondContact SG-O 3Å; L160-P177 HydrophobicContact CD2-CB 4.4Å; L160-P177 HydrophobicContact CD2-CG 3.91Å; L160-P177 HydrophobicContact CG-CG 4.07Å; R161-P177 HydrophobicContact CB-CG 4.31Å; M164-P177 HydrophobicContact SD-CG 3.74Å; P177-F181 WeakPolarHBondContact O-CB 3.3Å; P177-F181 PolarHBondContact O-N 3.02Å
178	W	95.2	Very high	88.1	Confident	36 Å²	36	48.6 Å²	48.6	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-74.7	-35.1	178.5	-65.7	107.1	0	0	0	112.4	W97 S175 L176 F181 I182 L227 M228 T231 T233	W97-W178 HydrophobicContact CH2-CB 3.97Å; W97-W178 HydrophobicContact CZ3-CB 3.93Å; S175-W178 WeakPolarHBondContact O-CA 3.49Å; S175-W178 WeakPolarHBondContact O-CB 3.34Å; S175-W178 PolarHBondContact O-N 3.4Å; L176-W178 VanDerWaalsContact C-N 3.27Å; L176-W178 PolarHBondContact O-N 3.32Å; W178-F181 HydrophobicContact CE3-CD1 4.45Å; W178-F181 WeakPolarHBondContact O-CB 3.49Å; W178-F181 PolarHBondContact O-N 2.92Å; W178-I182 PolarHBondContact O-N 3.19Å; W178-L227 HydrophobicContact CH2-CB 3.55Å; W178-L227 HydrophobicContact CZ3-CB 3.6Å; W178-L227 HydrophobicContact CZ3-CD1 4.2Å; W178-M228 HydrophobicContact CB-CE 4.32Å; W178-M228 HydrophobicContact CB-CG 4.03Å; W178-M228 HydrophobicContact CB-SD 3.79Å; W178-M228 HydrophobicContact CD2-CG 3.33Å; W178-M228 HydrophobicContact CD2-SD 4.26Å; W178-M228 HydrophobicContact CE3-CG 3.83Å; W178-M228 HydrophobicContact CG-CE 4.31Å; W178-M228 HydrophobicContact CG-CG 3.41Å; W178-M228 VanDerWaalsContact CG-CG 3.41Å; W178-M228 HydrophobicContact CG-SD 3.84Å; W178-M228 HydrophobicContact CZ2-CG 4.28Å; W178-M228 HydrophobicContact CZ3-CG 4.49Å; W178-T231 HydrophobicContact CH2-CG2 4.33Å; W178-T231 HydrophobicContact CZ2-CG2 3.93Å; W178-T231 VanDerWaalsContact CZ2-OG1 3.3Å; W178-T231 WeakPolarHBondContact CZ2-OG1 3.25Å; W178-T233 PolarHBondContact NE1-OG1 3.2Å
179	M	95.9	Very high	88.9	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-45.5	173.8	-169.4	-173.5	-61.6	0	0	110.7	W97 E111 L114 A115 L118 S175 L176 I182 S183	W97-M179 HydrophobicContact CD2-CB 4.25Å; W97-M179 HydrophobicContact CD2-CE 4.5Å; W97-M179 HydrophobicContact CD2-CG 4.04Å; W97-M179 HydrophobicContact CE3-CB 4.12Å; W97-M179 HydrophobicContact CE3-CG 4.29Å; W97-M179 HydrophobicContact CG-CG 4.4Å; W97-M179 HydrophobicContact CH2-CB 4.08Å; W97-M179 HydrophobicContact CZ2-CB 4.21Å; W97-M179 HydrophobicContact CZ2-CE 4.01Å; W97-M179 HydrophobicContact CZ3-CB 4.03Å; E111-M179 HydrophobicContact CB-CE 3.86Å; E111-M179 HydrophobicContact CG-CE 4.34Å; L114-M179 HydrophobicContact CB-SD 3.99Å; L114-M179 HydrophobicContact CD2-CE 4.39Å; L114-M179 HydrophobicContact CD2-SD 3.75Å; L114-M179 HydrophobicContact CG-SD 3.71Å; A115-M179 HydrophobicContact CB-CG 3.64Å; A115-M179 HydrophobicContact CB-SD 4.16Å; L118-M179 HydrophobicContact CD1-CG 4.08Å; L118-M179 HydrophobicContact CD1-SD 3.89Å; S175-M179 PolarHBondContact O-N 2.82Å; L176-M179 PolarHBondContact O-N 3.39Å; M179-I182 PolarHBondContact O-N 2.89Å; M179-S183 VanDerWaalsContact O-CB 3.28Å; M179-S183 WeakPolarHBondContact O-CB 3.39Å; M179-S183 PolarHBondContact O-N 2.94Å; M179-S183 PolarHBondContact O-OG 2.88Å
180	L	97	Very high	90	Very high	28 Å²	28	34.7 Å²	34.7	15%	0.147	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-45.5	172.4	-76.3	169.4	0	0	0	111.5	L118 I156 L160 L176 I182 S183 M184	L118-L180 HydrophobicContact CD1-CD2 3.9Å; L118-L180 HydrophobicContact CD1-CG 4.33Å; L118-L180 HydrophobicContact CD2-CD2 3.88Å; L118-L180 HydrophobicContact CG-CD2 4.34Å; I156-L180 HydrophobicContact CG2-CD1 4.32Å; L160-L180 HydrophobicContact CD2-CD1 3.5Å; L160-L180 VanDerWaalsContact CD2-CD1 3.5Å; L176-L180 HydrophobicContact CG-CD1 4.46Å; L176-L180 WeakPolarHBondContact O-CG 3.35Å; L176-L180 PolarHBondContact O-N 3.06Å; L180-I182 PolarHBondContact O-N 3.22Å; L180-S183 PolarHBondContact O-N 3.47Å; L180-M184 WeakPolarHBondContact O-CB 3.37Å; L180-M184 WeakPolarHBondContact O-CG 3.43Å; L180-M184 PolarHBondContact O-N 2.97Å
181	F	97.8	Very high	91.7	Very high	49 Å²	49	28.3 Å²	28.3	22%	0.215	14%	0.144	C	C	.	.	H	α-helix	trans	-56.3	-51.5	177.3	174.6	-101.6	0	0	0	112	I153 P177 W178 T185 L220	I153-F181 HydrophobicContact CG2-CD2 3.9Å; I153-F181 HydrophobicContact CG2-CE2 4.44Å; P177-F181 WeakPolarHBondContact O-CB 3.3Å; P177-F181 PolarHBondContact O-N 3.02Å; W178-F181 HydrophobicContact CE3-CD1 4.45Å; W178-F181 WeakPolarHBondContact O-CB 3.49Å; W178-F181 PolarHBondContact O-N 2.92Å; F181-T185 WeakPolarHBondContact O-CB 3.46Å; F181-T185 PolarHBondContact O-N 3.4Å; F181-T185 PolarHBondContact O-OG1 3.32Å; F181-L220 HydrophobicContact CE1-CD1 4.09Å; F181-L220 HydrophobicContact CZ-CD1 4.42Å
182	I	97.8	Very high	93.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.8	-46.4	177.5	-86.2	-83.6	0	0	0	111.4	W97 V100 W178 M179 L180 S186 L220 C224	W97-I182 HydrophobicContact CE3-CB 4.37Å; W97-I182 HydrophobicContact CE3-CG1 4.44Å; W97-I182 HydrophobicContact CE3-CG2 4.48Å; V100-I182 HydrophobicContact CG2-CD1 4.15Å; V100-I182 HydrophobicContact CG2-CG1 4.26Å; W178-I182 PolarHBondContact O-N 3.19Å; M179-I182 PolarHBondContact O-N 2.89Å; L180-I182 PolarHBondContact O-N 3.22Å; I182-S186 VanDerWaalsContact O-CB 3.27Å; I182-S186 WeakPolarHBondContact O-CB 3.27Å; I182-S186 PolarHBondContact O-N 3.13Å; I182-S186 PolarHBondContact O-OG 3.14Å; I182-L220 HydrophobicContact CD1-CD2 3.99Å; I182-L220 HydrophobicContact CD1-CG 3.71Å; I182-C224 HydrophobicContact CD1-CB 3.77Å; I182-C224 HydrophobicContact CG1-CB 3.78Å; I182-C224 VanDerWaalsContact CG1-SG 3.56Å
183	S	98.1	Very high	94.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.1	-49.9	-174.9	-55.2	0	0	0	0	111.3	A115 M179 L180 S186 H187	A115-S183 PolarHBondContact O-OG 3.36Å; M179-S183 VanDerWaalsContact O-CB 3.28Å; M179-S183 WeakPolarHBondContact O-CB 3.39Å; M179-S183 PolarHBondContact O-N 2.94Å; M179-S183 PolarHBondContact O-OG 2.88Å; L180-S183 PolarHBondContact O-N 3.47Å; S183-S186 PolarHBondContact O-OG 3.04Å; S183-H187 WeakPolarHBondContact O-CB 3.44Å; S183-H187 PolarHBondContact O-N 3.48Å
184	M	98.4	Very high	95.8	Very high	12 Å²	12	21.5 Å²	21.5	6%	0.059	10%	0.102	C	C	.	.	H	α-helix	trans	-70.7	-41.9	179.3	-61.2	-172.1	77.4	0	0	112.4	I122 I153 I156 L180 H187 H188	I122-M184 HydrophobicContact CD1-CB 4.13Å; I122-M184 HydrophobicContact CD1-CG 3.85Å; I153-M184 HydrophobicContact CD1-CB 3.98Å; I153-M184 HydrophobicContact CG1-CB 3.82Å; I153-M184 HydrophobicContact CG1-CE 4.23Å; I153-M184 HydrophobicContact CG1-SD 4.37Å; I153-M184 HydrophobicContact CG2-CB 4.34Å; I156-M184 HydrophobicContact CD1-CE 4.1Å; I156-M184 HydrophobicContact CD1-SD 4.16Å; L180-M184 WeakPolarHBondContact O-CB 3.37Å; L180-M184 WeakPolarHBondContact O-CG 3.43Å; L180-M184 PolarHBondContact O-N 2.97Å; M184-H187 PolarHBondContact O-N 3.42Å; M184-H188 WeakPolarHBondContact O-CB 3.44Å; M184-H188 PolarHBondContact O-CD2 3.12Å; M184-H188 PolarHBondContact O-N 3.07Å
185	T	98.3	Very high	96.2	Very high	22 Å²	22	27 Å²	27	14%	0.135	13%	0.127	C	C	.	.	H	α-helix	trans	-65.9	-45.8	-178.1	-56.4	0	0	0	0	111.1	F181 H187 H188 V189 L220	F181-T185 WeakPolarHBondContact O-CB 3.46Å; F181-T185 PolarHBondContact O-N 3.4Å; F181-T185 PolarHBondContact O-OG1 3.32Å; T185-H187 VanDerWaalsContact C-N 3.32Å; T185-H187 PolarHBondContact O-N 3.37Å; T185-H188 PolarHBondContact O-N 3.14Å; T185-V189 HydrophobicContact CG2-CG2 4.01Å; T185-V189 WeakPolarHBondContact O-CB 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.17Å; T185-V189 PolarHBondContact O-N 2.98Å; T185-L220 HydrophobicContact CG2-CD1 3.99Å; T185-L220 HydrophobicContact CG2-CD2 3.91Å
186	S	98.3	Very high	96.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-39.9	177.9	60.2	0	0	0	0	112.2	I182 S183 R190	I182-S186 VanDerWaalsContact O-CB 3.27Å; I182-S186 WeakPolarHBondContact O-CB 3.27Å; I182-S186 PolarHBondContact O-N 3.13Å; I182-S186 PolarHBondContact O-OG 3.14Å; S183-S186 PolarHBondContact O-OG 3.04Å; S186-R190 PolarHBondContact O-N 3.46Å
187	H	98.4	Very high	96.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58	-54.2	172.7	-176.6	119.8	0	0	0	111.4	H89 A119 I122 D123 H148 S183 M184 T185 V189 R190 D191	H89-H187 AromaticContact CG-CE1 3.84Å; H89-H187 AromaticContact CG-ND1 3.58Å; H89-H187 AromaticContact ND1-CD2 3.99Å; H89-H187 AromaticContact ND1-CE1 3.85Å; H89-H187 AromaticContact ND1-CG 3.56Å; H89-H187 AromaticContact ND1-ND1 3.5Å; H89-H187 PolarHBondContact ND1-ND1 2.82Å; A119-H187 PolarHBondContact O-ND1 3.21Å; I122-H187 HydrophobicContact CD1-CB 3.75Å; D123-H187 IonicContact OD1-CE1 3.56Å; D123-H187 PolarHBondContact OD1-CE1 3.07Å; D123-H187 IonicContact OD1-NE2 3.12Å; D123-H187 IonicContact OD2-CE1 3.59Å; H148-H187 AromaticContact CD2-NE2 3.68Å; H148-H187 AromaticContact NE2-NE2 3.24Å; H148-H187 PolarHBondContact NE2-NE2 2.9Å; S183-H187 WeakPolarHBondContact O-CB 3.44Å; S183-H187 PolarHBondContact O-N 3.48Å; M184-H187 PolarHBondContact O-N 3.42Å; T185-H187 VanDerWaalsContact C-N 3.32Å; T185-H187 PolarHBondContact O-N 3.37Å; H187-V189 PolarHBondContact O-N 2.88Å; H187-R190 PolarHBondContact O-N 3.5Å; H187-D191 IonicContact CD2-OD2 3.13Å; H187-D191 IonicContact NE2-OD2 3.98Å; H187-D191 PolarHBondContact O-N 2.94Å; H187-D191 VanDerWaalsContact O-N 3.13Å
188	H	98.4	Very high	96.9	Very high	1 Å²	1	30 Å²	30	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-37.6	-176.6	-75.3	-143.9	0	0	0	112.9	L147 S150 I153 M184 T185 R190 D191 A192 L197	L147-H188 PolarHBondContact O-CE1 2.92Å; L147-H188 PolarHBondContact O-NE2 3.26Å; S150-H188 WeakPolarHBondContact CA-ND1 3.42Å; S150-H188 PolarHBondContact OG-ND1 2.67Å; I153-H188 HydrophobicContact CD1-CB 4.32Å; M184-H188 WeakPolarHBondContact O-CB 3.44Å; M184-H188 PolarHBondContact O-CD2 3.12Å; M184-H188 PolarHBondContact O-N 3.07Å; T185-H188 PolarHBondContact O-N 3.14Å; H188-R190 VanDerWaalsContact C-N 3.34Å; H188-D191 PolarHBondContact O-N 3.49Å; H188-A192 VanDerWaalsContact O-CB 3.27Å; H188-A192 WeakPolarHBondContact O-CB 3.22Å; H188-A192 PolarHBondContact O-N 2.92Å; H188-L197 HydrophobicContact CB-CD2 4.07Å
189	V	98.1	Very high	96.9	Very high	16 Å²	16	30.6 Å²	30.6	10%	0.097	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-38.2	178.9	170.7	0	0	0	0	111	T185 H187 Y213 T216	T185-V189 HydrophobicContact CG2-CG2 4.01Å; T185-V189 WeakPolarHBondContact O-CB 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.17Å; T185-V189 PolarHBondContact O-N 2.98Å; H187-V189 PolarHBondContact O-N 2.88Å; V189-Y213 HydrophobicContact CG1-CD2 4.17Å; V189-T216 HydrophobicContact CG1-CG2 3.92Å; V189-T216 HydrophobicContact CG2-CG2 4.15Å
190	R	97.9	Very high	96.8	Very high	13 Å²	13	33.4 Å²	33.4	5%	0.049	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-48.5	173.7	-177.5	173.7	178.8	-92.5	-6	111.6	D66 D85 H89 S186 H187 H188 A192 V193 Y213	D66-R190 IonicContact OD1-CZ 3.42Å; D66-R190 IonicContact OD1-NE 3.14Å; D66-R190 PolarHBondContact OD1-NE 3.08Å; D66-R190 VanDerWaalsContact OD1-NE 3.14Å; D66-R190 IonicContact OD1-NH2 3.19Å; D66-R190 PolarHBondContact OD1-NH2 3.06Å; D85-R190 IonicContact OD1-CZ 3.26Å; D85-R190 VanDerWaalsContact OD1-CZ 3.26Å; D85-R190 IonicContact OD1-NH1 2.86Å; D85-R190 PolarHBondContact OD1-NH1 3.15Å; D85-R190 IonicContact OD1-NH2 2.83Å; D85-R190 PolarHBondContact OD1-NH2 3.32Å; H89-R190 PolarHBondContact CD2-NH1 3.12Å; H89-R190 PolarHBondContact CE1-NH1 3.44Å; H89-R190 PolarHBondContact NE2-NH1 3.33Å; S186-R190 PolarHBondContact O-N 3.46Å; H187-R190 PolarHBondContact O-N 3.5Å; H188-R190 VanDerWaalsContact C-N 3.34Å; R190-A192 PolarHBondContact O-N 3.23Å; R190-V193 WeakPolarHBondContact O-CB 3.16Å; R190-V193 WeakPolarHBondContact O-CG2 3.41Å; R190-V193 PolarHBondContact O-N 3.08Å; R190-Y213 HydrophobicContact CB-CD2 4.19Å; R190-Y213 HydrophobicContact CB-CE2 3.71Å; R190-Y213 HydrophobicContact CG-CE2 3.86Å
191	D	97.2	Very high	96.6	Very high	24 Å²	24	37.5 Å²	37.5	13%	0.128	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-30.3	178.8	-89.5	11.5	0	0	0	114.1	H89 R144 H148 H187 H188 V193 R194 H195	H89-D191 IonicContact CE1-OD1 2.73Å; H89-D191 PolarHBondContact CE1-OD1 3.35Å; H89-D191 IonicContact NE2-OD1 3.81Å; H89-D191 PolarHBondContact NE2-OD1 2.91Å; R144-D191 IonicContact NH2-OD2 2.92Å; H148-D191 IonicContact CD2-OD2 3.03Å; H148-D191 PolarHBondContact CD2-OD2 2.99Å; H148-D191 VanDerWaalsContact CD2-OD2 3.28Å; H148-D191 IonicContact NE2-OD2 3.64Å; H187-D191 IonicContact CD2-OD2 3.13Å; H187-D191 IonicContact NE2-OD2 3.98Å; H187-D191 PolarHBondContact O-N 2.94Å; H187-D191 VanDerWaalsContact O-N 3.13Å; H188-D191 PolarHBondContact O-N 3.49Å; D191-V193 PolarHBondContact O-N 3.5Å; D191-V193 VanDerWaalsContact O-N 3.07Å; D191-R194 PolarHBondContact O-N 2.88Å; D191-H195 PolarHBondContact O-N 3.36Å
192	A	97.1	Very high	96.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-17.5	-179.6	0	0	0	0	0	112.8	H188 R190 R194 G196 L197 P207 V208	H188-A192 VanDerWaalsContact O-CB 3.27Å; H188-A192 WeakPolarHBondContact O-CB 3.22Å; H188-A192 PolarHBondContact O-N 2.92Å; R190-A192 PolarHBondContact O-N 3.23Å; A192-R194 PolarHBondContact O-N 3.19Å; A192-G196 VanDerWaalsContact O-CA 3.25Å; A192-G196 WeakPolarHBondContact O-CA 3.44Å; A192-G196 PolarHBondContact O-N 2.99Å; A192-L197 HydrophobicContact CB-CD2 3.76Å; A192-L197 HydrophobicContact CB-CG 3.82Å; A192-P207 CarbonylContact O-C 3.56Å; A192-P207 WeakPolarHBondContact O-CA 3.48Å; A192-V208 HydrophobicContact CB-CB 4.02Å; A192-V208 HydrophobicContact CB-CG2 3.51Å; A192-V208 PolarHBondContact O-N 2.96Å
193	V	97.1	Very high	96.2	Very high	45 Å²	45	45 Å²	45	27%	0.273	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-33.1	172.7	176.6	0	0	0	0	111.9	R190 D191 P207 Y210 Y213	R190-V193 WeakPolarHBondContact O-CB 3.16Å; R190-V193 WeakPolarHBondContact O-CG2 3.41Å; R190-V193 PolarHBondContact O-N 3.08Å; D191-V193 PolarHBondContact O-N 3.5Å; D191-V193 VanDerWaalsContact O-N 3.07Å; V193-P207 WeakPolarHBondContact O-CB 3.43Å; V193-Y210 HydrophobicContact CG1-CD2 4.09Å; V193-Y210 HydrophobicContact CG2-CD2 4.36Å; V193-Y213 HydrophobicContact CG2-CD1 3.83Å; V193-Y213 HydrophobicContact CG2-CG 3.69Å
194	R	93.2	Very high	96	Very high	143 Å²	143	50 Å²	50	54%	0.54	26%	0.259	S	S	.	.	H	α-helix	trans	-93.8	-42.6	-178.7	-63.1	-178.3	-174.3	156	8.3	112.7	D85 D191 A192	D85-R194 IonicContact OD1-NH2 3.96Å; D85-R194 IonicContact OD2-NH1 3.62Å; D191-R194 PolarHBondContact O-N 2.88Å; A192-R194 PolarHBondContact O-N 3.19Å
195	H	90.6	Very high	95.9	Very high	125 Å²	125	52.3 Å²	52.3	58%	0.579	27%	0.274	S	S	*	.	H	α-helix	trans	-124.3	-1	-166.9	-60.3	-62.5	0	0	0	114.6	D191	D191-H195 PolarHBondContact O-N 3.36Å
196	G	96.3	Very high	95.8	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.299	C	S	.	.			trans	71	178.3	-169.2	0	0	0	0	0	113	R144 A192 A206	R144-G196 PolarHBondContact NH1-O 3.47Å; A192-G196 VanDerWaalsContact O-CA 3.25Å; A192-G196 WeakPolarHBondContact O-CA 3.44Å; A192-G196 PolarHBondContact O-N 2.99Å; G196-A206 WeakPolarHBondContact CA-O 3.09Å
197	L	96.9	Very high	95.7	Very high	47 Å²	47	58.7 Å²	58.7	25%	0.246	32%	0.323	C	S	.	.			trans	-84.2	132.6	173.7	-66.5	170.5	0	0	0	109.4	H188 A192 V199 N204 T205	H188-L197 HydrophobicContact CB-CD2 4.07Å; A192-L197 HydrophobicContact CB-CD2 3.76Å; A192-L197 HydrophobicContact CB-CG 3.82Å; L197-V199 HydrophobicContact CB-CG2 4.32Å; L197-V199 PolarHBondContact O-N 3.37Å; L197-N204 CarbonylContact O-C 3.5Å; L197-N204 WeakPolarHBondContact O-CA 3.46Å; L197-T205 HydrophobicContact CB-CG2 4.09Å; L197-T205 PolarHBondContact N-OG1 2.88Å; L197-T205 PolarHBondContact O-N 2.81Å
198	W	96.7	Very high	95.7	Very high	65 Å²	65	59.8 Å²	59.8	25%	0.246	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	108.4	172.1	179.7	22.7	0	0	0	110.1	R144 P145 C149 S150 N204	R144-W198 HydrophobicContact CB-CE3 4.29Å; R144-W198 HydrophobicContact CB-CZ3 4.43Å; R144-W198 HydrophobicContact CG-CE3 4.38Å; P145-W198 WeakPolarHBondContact O-CZ3 3.34Å; C149-W198 VanDerWaalsContact CA-CE3 3.43Å; C149-W198 HydrophobicContact CB-CD2 3.93Å; C149-W198 HydrophobicContact CB-CE3 3.53Å; C149-W198 HydrophobicContact CB-CH2 4.18Å; C149-W198 HydrophobicContact CB-CZ3 3.68Å; S150-W198 WeakPolarHBondContact CA-O 3.43Å; S150-W198 VanDerWaalsContact CB-O 3.28Å; S150-W198 WeakPolarHBondContact CB-O 3.49Å; S150-W198 PolarHBondContact N-O 3.3Å; W198-N204 WeakPolarHBondContact CA-OD1 3.38Å; W198-N204 VanDerWaalsContact CB-OD1 3.31Å; W198-N204 WeakPolarHBondContact CB-OD1 3.28Å
199	V	95.7	Very high	95.6	Very high	48 Å²	48	62.8 Å²	62.8	29%	0.291	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	85.9	-179	-168.2	0	0	0	0	109	S151 L197 F202 G203 T205	S151-V199 WeakPolarHBondContact OG-CA 3.45Å; L197-V199 HydrophobicContact CB-CG2 4.32Å; L197-V199 PolarHBondContact O-N 3.37Å; V199-F202 HydrophobicContact CG1-CD2 4.05Å; V199-F202 CarbonylContact O-C 3.42Å; V199-F202 VanDerWaalsContact O-CA 3.27Å; V199-F202 WeakPolarHBondContact O-CA 3.49Å; V199-F202 WeakPolarHBondContact O-CB 3.41Å; V199-F202 PolarHBondContact O-N 2.89Å; V199-G203 CarbonylContact C-O 3.58Å; V199-G203 PolarHBondContact N-O 2.84Å; V199-G203 PolarHBondContact O-N 3.01Å; V199-T205 HydrophobicContact CG2-CG2 4.14Å
200	C	93	Very high	95.6	Very high	63 Å²	63	65.9 Å²	65.9	43%	0.426	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	138.9	174.4	-175.4	0	0	0	0	111.2	C149 S151	C149-C200 VanDerWaalsContact SG-CB 3.53Å; S151-C200 WeakPolarHBondContact CB-O 3.28Å; S151-C200 PolarHBondContact OG-N 3.31Å; S151-C200 PolarHBondContact OG-O 3.32Å
201	P	93.7	Very high	95.6	Very high	113 Å²	113	73.4 Å²	73.4	73%	0.734	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.7	7.8	-0.9	36.6	-36.6	0	0	0	114.8	G203	P201-G203 VanDerWaalsContact C-N 3.33Å; P201-G203 PolarHBondContact O-N 3.47Å
202	F	93.4	Very high	95.6	Very high	180 Å²	180	75.4 Å²	75.4	79%	0.789	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.6	-173.8	-52.4	-74	0	0	0	115.2	V199	V199-F202 HydrophobicContact CG1-CD2 4.05Å; V199-F202 CarbonylContact O-C 3.42Å; V199-F202 VanDerWaalsContact O-CA 3.27Å; V199-F202 WeakPolarHBondContact O-CA 3.49Å; V199-F202 WeakPolarHBondContact O-CB 3.41Å; V199-F202 PolarHBondContact O-N 2.89Å
203	G	92.8	Very high	95.7	Very high	28 Å²	28	75.4 Å²	75.4	29%	0.289	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.7	-152.2	176.5	0	0	0	0	0	113.4	V199 P201	V199-G203 CarbonylContact C-O 3.58Å; V199-G203 PolarHBondContact N-O 2.84Å; V199-G203 PolarHBondContact O-N 3.01Å; P201-G203 VanDerWaalsContact C-N 3.33Å; P201-G203 PolarHBondContact O-N 3.47Å
204	N	93.9	Very high	95.7	Very high	103 Å²	103	74.3 Å²	74.3	55%	0.551	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	142.1	179.9	-62.4	-66.7	0	0	0	110.8	L197 W198	L197-N204 CarbonylContact O-C 3.5Å; L197-N204 WeakPolarHBondContact O-CA 3.46Å; W198-N204 WeakPolarHBondContact CA-OD1 3.38Å; W198-N204 VanDerWaalsContact CB-OD1 3.31Å; W198-N204 WeakPolarHBondContact CB-OD1 3.28Å
205	T	96.1	Very high	95.9	Very high	61 Å²	61	70.2 Å²	70.2	37%	0.374	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-72.7	169.1	166.3	71.5	0	0	0	0	110.6	L197 V199	L197-T205 HydrophobicContact CB-CG2 4.09Å; L197-T205 PolarHBondContact N-OG1 2.88Å; L197-T205 PolarHBondContact O-N 2.81Å; V199-T205 HydrophobicContact CG2-CG2 4.14Å
206	A	96.6	Very high	96.3	Very high	80 Å²	80	66.3 Å²	66.3	66%	0.661	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-59.8	154	162.8	0	0	0	0	0	110.7	G196 V208	G196-A206 WeakPolarHBondContact CA-O 3.09Å; A206-V208 PolarHBondContact O-N 2.99Å
207	P	97.6	Very high	96.4	Very high	78 Å²	78	66.3 Å²	66.3	51%	0.506	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-53	135.2	171.6	-26.4	35.1	0	0	0	111.8	A192 V193	A192-P207 CarbonylContact O-C 3.56Å; A192-P207 WeakPolarHBondContact O-CA 3.48Å; V193-P207 WeakPolarHBondContact O-CB 3.43Å
208	V	97.1	Very high	96.4	Very high	22 Å²	22	64.9 Å²	64.9	13%	0.133	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-72.8	129.1	-177	170.7	0	0	0	0	109.2	A192 A206 Y210 L212	A192-V208 HydrophobicContact CB-CB 4.02Å; A192-V208 HydrophobicContact CB-CG2 3.51Å; A192-V208 PolarHBondContact O-N 2.96Å; A206-V208 PolarHBondContact O-N 2.99Å; V208-Y210 PolarHBondContact O-N 3.02Å; V208-L212 HydrophobicContact CG1-CB 4.01Å; V208-L212 HydrophobicContact CG1-CD2 4.13Å; V208-L212 HydrophobicContact CG1-CG 4.06Å
209	P	97.6	Very high	96.4	Very high	64 Å²	64	65.7 Å²	65.7	42%	0.416	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-55.1	138.6	173.9	-25.8	34.2	0	0	0	111.4	W211 L212 Y213	P209-W211 VanDerWaalsContact C-N 3.32Å; P209-W211 PolarHBondContact O-N 3.18Å; P209-L212 HydrophobicContact CB-CB 4.29Å; P209-L212 WeakPolarHBondContact O-CA 3.13Å; P209-L212 WeakPolarHBondContact O-CB 3.49Å; P209-L212 PolarHBondContact O-N 3.2Å; P209-Y213 PolarHBondContact O-N 3.17Å; P209-Y213 VanDerWaalsContact O-N 3.1Å
210	Y	97.8	Very high	96.5	Very high	81 Å²	81	63.8 Å²	63.8	32%	0.318	37%	0.366	S	S	.	.	H	α-helix	trans	-56.1	-43.9	-172.5	-169.6	-105.8	0	0	0	113.5	V63 D66 V193 V208 L212 Y213 V214	V63-Y210 WeakPolarHBondContact CA-OH 3.44Å; V63-Y210 HydrophobicContact CG2-CE1 4.22Å; D66-Y210 HydrophobicContact CB-CE2 4.49Å; D66-Y210 WeakPolarHBondContact CB-OH 3.33Å; D66-Y210 WeakPolarHBondContact OD2-CE2 3.24Å; D66-Y210 PolarHBondContact OD2-OH 3.43Å; V193-Y210 HydrophobicContact CG1-CD2 4.09Å; V193-Y210 HydrophobicContact CG2-CD2 4.36Å; V208-Y210 PolarHBondContact O-N 3.02Å; Y210-L212 PolarHBondContact O-N 2.86Å; Y210-Y213 AromaticContact CD2-CD1 3.77Å; Y210-Y213 HydrophobicContact CD2-CD1 3.77Å; Y210-Y213 HydrophobicContact CD2-CE1 4.2Å; Y210-Y213 AromaticContact CE2-CD1 3.6Å; Y210-Y213 HydrophobicContact CE2-CD1 3.6Å; Y210-Y213 AromaticContact CE2-CE1 3.53Å; Y210-Y213 HydrophobicContact CE2-CE1 3.53Å; Y210-Y213 HydrophobicContact CG-CD1 4.43Å; Y210-Y213 AromaticContact CZ-CE1 3.85Å; Y210-Y213 WeakPolarHBondContact O-CB 3.38Å; Y210-Y213 WeakPolarHBondContact O-CD1 3.13Å; Y210-Y213 PolarHBondContact O-N 3.17Å; Y210-V214 HydrophobicContact CD1-CG2 4.25Å; Y210-V214 HydrophobicContact CE1-CG2 3.83Å; Y210-V214 PolarHBondContact O-N 3.33Å; Y210-V214 VanDerWaalsContact O-N 3.07Å
211	W	97.6	Very high	96.6	Very high	171 Å²	171	60.9 Å²	60.9	65%	0.648	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-33.9	177	68.8	-97.2	0	0	0	112.4	P209 S215	P209-W211 VanDerWaalsContact C-N 3.32Å; P209-W211 PolarHBondContact O-N 3.18Å; W211-S215 VanDerWaalsContact O-CB 3.25Å; W211-S215 WeakPolarHBondContact O-CB 3.47Å; W211-S215 PolarHBondContact O-N 2.91Å; W211-S215 PolarHBondContact O-OG 3.44Å
212	L	97.6	Very high	96.7	Very high	67 Å²	67	56.1 Å²	56.1	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-72.7	-39.6	180	-179	59.2	0	0	0	110.3	V208 P209 Y210 T216	V208-L212 HydrophobicContact CG1-CB 4.01Å; V208-L212 HydrophobicContact CG1-CD2 4.13Å; V208-L212 HydrophobicContact CG1-CG 4.06Å; P209-L212 HydrophobicContact CB-CB 4.29Å; P209-L212 WeakPolarHBondContact O-CA 3.13Å; P209-L212 WeakPolarHBondContact O-CB 3.49Å; P209-L212 PolarHBondContact O-N 3.2Å; Y210-L212 PolarHBondContact O-N 2.86Å; L212-T216 WeakPolarHBondContact O-CB 3.48Å; L212-T216 PolarHBondContact O-N 3.33Å; L212-T216 PolarHBondContact O-OG1 3.43Å
213	Y	97.8	Very high	96.7	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-55.7	-55.1	170.2	141.7	-113.7	0	0	0	111.2	C62 D66 V189 R190 V193 P209 Y210 S215 T216 T217	C62-Y213 HydrophobicContact CB-CE1 4.3Å; C62-Y213 WeakPolarHBondContact CB-OH 3.45Å; C62-Y213 PolarHBondContact SG-OH 2.85Å; D66-Y213 VanDerWaalsContact OD2-CE1 3.23Å; D66-Y213 WeakPolarHBondContact OD2-CE1 3.49Å; D66-Y213 PolarHBondContact OD2-OH 3.2Å; V189-Y213 HydrophobicContact CG1-CD2 4.17Å; R190-Y213 HydrophobicContact CB-CD2 4.19Å; R190-Y213 HydrophobicContact CB-CE2 3.71Å; R190-Y213 HydrophobicContact CG-CE2 3.86Å; V193-Y213 HydrophobicContact CG2-CD1 3.83Å; V193-Y213 HydrophobicContact CG2-CG 3.69Å; P209-Y213 PolarHBondContact O-N 3.17Å; P209-Y213 VanDerWaalsContact O-N 3.1Å; Y210-Y213 AromaticContact CD2-CD1 3.77Å; Y210-Y213 HydrophobicContact CD2-CD1 3.77Å; Y210-Y213 HydrophobicContact CD2-CE1 4.2Å; Y210-Y213 AromaticContact CE2-CD1 3.6Å; Y210-Y213 HydrophobicContact CE2-CD1 3.6Å; Y210-Y213 AromaticContact CE2-CE1 3.53Å; Y210-Y213 HydrophobicContact CE2-CE1 3.53Å; Y210-Y213 HydrophobicContact CG-CD1 4.43Å; Y210-Y213 AromaticContact CZ-CE1 3.85Å; Y210-Y213 WeakPolarHBondContact O-CB 3.38Å; Y210-Y213 WeakPolarHBondContact O-CD1 3.13Å; Y210-Y213 PolarHBondContact O-N 3.17Å; Y213-S215 PolarHBondContact O-N 2.98Å; Y213-T216 PolarHBondContact O-N 2.97Å; Y213-T217 WeakPolarHBondContact CD2-OG1 2.86Å; Y213-T217 WeakPolarHBondContact CE2-OG1 3.37Å; Y213-T217 WeakPolarHBondContact O-CB 3.43Å; Y213-T217 PolarHBondContact O-N 3.08Å; Y213-T217 PolarHBondContact O-OG1 3.26Å
214	V	98.3	Very high	96.8	Very high	22 Å²	22	50.7 Å²	50.7	13%	0.133	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-45.3	-176.3	177.7	0	0	0	0	110.5	V63 Y210 T216 T217 A218	V63-V214 HydrophobicContact CG2-CG1 4.27Å; V63-V214 HydrophobicContact CG2-CG2 4.02Å; Y210-V214 HydrophobicContact CD1-CG2 4.25Å; Y210-V214 HydrophobicContact CE1-CG2 3.83Å; Y210-V214 PolarHBondContact O-N 3.33Å; Y210-V214 VanDerWaalsContact O-N 3.07Å; V214-T216 PolarHBondContact O-N 3.02Å; V214-T217 PolarHBondContact O-N 3.46Å; V214-A218 WeakPolarHBondContact O-CB 3.34Å; V214-A218 PolarHBondContact O-N 2.86Å
215	S	97.9	Very high	96.6	Very high	56 Å²	56	45.9 Å²	45.9	39%	0.392	26%	0.26	S	S	.	.	H	α-helix	trans	-63.9	-41.2	179.2	-56.7	0	0	0	0	111.9	W211 Y213 T219	W211-S215 VanDerWaalsContact O-CB 3.25Å; W211-S215 WeakPolarHBondContact O-CB 3.47Å; W211-S215 PolarHBondContact O-N 2.91Å; W211-S215 PolarHBondContact O-OG 3.44Å; Y213-S215 PolarHBondContact O-N 2.98Å; S215-T219 WeakPolarHBondContact O-CB 3.44Å; S215-T219 WeakPolarHBondContact O-CG2 3.35Å; S215-T219 PolarHBondContact O-N 2.85Å; S215-T219 PolarHBondContact O-OG1 2.89Å
216	T	97.8	Very high	96.2	Very high	43 Å²	43	44.6 Å²	44.6	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-48.5	177.4	-58.9	0	0	0	0	110	V189 L212 Y213 V214 A218 T219 L220	V189-T216 HydrophobicContact CG1-CG2 3.92Å; V189-T216 HydrophobicContact CG2-CG2 4.15Å; L212-T216 WeakPolarHBondContact O-CB 3.48Å; L212-T216 PolarHBondContact O-N 3.33Å; L212-T216 PolarHBondContact O-OG1 3.43Å; Y213-T216 PolarHBondContact O-N 2.97Å; V214-T216 PolarHBondContact O-N 3.02Å; T216-A218 VanDerWaalsContact C-N 3.33Å; T216-A218 PolarHBondContact O-N 2.83Å; T216-T219 PolarHBondContact O-N 3.34Å; T216-T219 PolarHBondContact O-OG1 3.29Å; T216-L220 WeakPolarHBondContact O-CB 3.49Å; T216-L220 PolarHBondContact O-N 3.15Å
217	T	98.1	Very high	95.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-41.5	179	-58.8	0	0	0	0	112	L58 V92 Y213 V214 T219 P221	L58-T217 HydrophobicContact CD2-CG2 4.23Å; L58-T217 HydrophobicContact CG-CG2 4.27Å; V92-T217 HydrophobicContact CG1-CG2 3.57Å; Y213-T217 WeakPolarHBondContact CD2-OG1 2.86Å; Y213-T217 WeakPolarHBondContact CE2-OG1 3.37Å; Y213-T217 WeakPolarHBondContact O-CB 3.43Å; Y213-T217 PolarHBondContact O-N 3.08Å; Y213-T217 PolarHBondContact O-OG1 3.26Å; V214-T217 PolarHBondContact O-N 3.46Å; T217-T219 PolarHBondContact O-N 3.2Å; T217-P221 VanDerWaalsContact O-CD 3.3Å; T217-P221 WeakPolarHBondContact O-CD 3.5Å
218	A	97.6	Very high	95.5	Very high	17 Å²	17	40 Å²	40	14%	0.14	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-32.1	177.9	0	0	0	0	0	113.2	S55 V214 T216	S55-A218 VanDerWaalsContact CB-O 3.3Å; S55-A218 WeakPolarHBondContact CB-O 3.43Å; S55-A218 PolarHBondContact OG-O 2.81Å; V214-A218 WeakPolarHBondContact O-CB 3.34Å; V214-A218 PolarHBondContact O-N 2.86Å; T216-A218 VanDerWaalsContact C-N 3.33Å; T216-A218 PolarHBondContact O-N 2.83Å
219	T	96.8	Very high	94.8	Very high	83 Å²	83	40.2 Å²	40.2	51%	0.509	21%	0.211	S	C	.	.	H	α-helix	trans	-94.6	-20.9	-177.1	55.4	0	0	0	0	114	S215 T216 T217 P221 H222 L223	S215-T219 WeakPolarHBondContact O-CB 3.44Å; S215-T219 WeakPolarHBondContact O-CG2 3.35Å; S215-T219 PolarHBondContact O-N 2.85Å; S215-T219 PolarHBondContact O-OG1 2.89Å; T216-T219 PolarHBondContact O-N 3.34Å; T216-T219 PolarHBondContact O-OG1 3.29Å; T217-T219 PolarHBondContact O-N 3.2Å; T219-P221 VanDerWaalsContact C-CD 3.47Å; T219-H222 PolarHBondContact O-N 3.29Å; T219-H222 VanDerWaalsContact O-N 3.11Å; T219-L223 PolarHBondContact O-N 2.78Å; T219-L223 VanDerWaalsContact O-N 3.11Å
220	L	97.1	Very high	94.1	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-53.6	-41.8	-178.4	-178.4	69.5	0	0	0	113.9	F181 I182 T185 T216 H222 L223 C224	F181-L220 HydrophobicContact CE1-CD1 4.09Å; F181-L220 HydrophobicContact CZ-CD1 4.42Å; I182-L220 HydrophobicContact CD1-CD2 3.99Å; I182-L220 HydrophobicContact CD1-CG 3.71Å; T185-L220 HydrophobicContact CG2-CD1 3.99Å; T185-L220 HydrophobicContact CG2-CD2 3.91Å; T216-L220 WeakPolarHBondContact O-CB 3.49Å; T216-L220 PolarHBondContact O-N 3.15Å; L220-H222 VanDerWaalsContact C-N 3.34Å; L220-H222 PolarHBondContact O-N 3.33Å; L220-L223 PolarHBondContact O-N 3.25Å; L220-C224 WeakPolarHBondContact O-CB 3.29Å; L220-C224 PolarHBondContact O-N 3.23Å
221	P	96.6	Very high	93.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-41.4	176.6	-26.6	36.6	0	0	0	113.3	L58 V99 V100 T217 T219 C224 S225	L58-P221 HydrophobicContact CD2-CG 4.32Å; V99-P221 HydrophobicContact CB-CB 3.76Å; V99-P221 HydrophobicContact CB-CG 4.29Å; V99-P221 HydrophobicContact CG1-CB 3.58Å; V99-P221 HydrophobicContact CG1-CG 4.37Å; V100-P221 HydrophobicContact CG2-CB 3.95Å; V100-P221 WeakPolarHBondContact CG2-O 3.33Å; T217-P221 VanDerWaalsContact O-CD 3.3Å; T217-P221 WeakPolarHBondContact O-CD 3.5Å; T219-P221 VanDerWaalsContact C-CD 3.47Å; P221-C224 PolarHBondContact O-N 2.85Å; P221-S225 WeakPolarHBondContact O-CB 3.03Å; P221-S225 PolarHBondContact O-N 3.47Å
222	H	94.3	Very high	92.3	Very high	14 Å²	14	36 Å²	36	7%	0.065	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-42.1	179.4	-60.7	-69.9	0	0	0	111.4	T46 F47 S55 T219 L220 C224 S225 V226	T46-H222 PolarHBondContact O-CE1 2.86Å; T46-H222 PolarHBondContact O-ND1 3.44Å; F47-H222 HydrophobicContact CD1-CB 4.46Å; F47-H222 HydrophobicContact CE1-CB 3.76Å; F47-H222 HydrophobicContact CZ-CB 4.26Å; S55-H222 WeakPolarHBondContact CB-NE2 3.25Å; S55-H222 PolarHBondContact OG-CD2 3.34Å; S55-H222 PolarHBondContact OG-NE2 2.86Å; T219-H222 PolarHBondContact O-N 3.29Å; T219-H222 VanDerWaalsContact O-N 3.11Å; L220-H222 VanDerWaalsContact C-N 3.34Å; L220-H222 PolarHBondContact O-N 3.33Å; H222-C224 VanDerWaalsContact C-N 3.33Å; H222-C224 PolarHBondContact O-N 3.08Å; H222-S225 PolarHBondContact O-N 3.41Å; H222-V226 WeakPolarHBondContact O-CG2 3.39Å; H222-V226 PolarHBondContact O-N 2.86Å
223	L	93.9	Very high	91.2	Very high	93 Å²	93	32.9 Å²	32.9	49%	0.487	20%	0.195	S	C	.	.	H	α-helix	trans	-57.7	-47.9	173	176.4	63.5	0	0	0	110.8	T219 L220 S225 V226 L227	T219-L223 PolarHBondContact O-N 2.78Å; T219-L223 VanDerWaalsContact O-N 3.11Å; L220-L223 PolarHBondContact O-N 3.25Å; L223-S225 VanDerWaalsContact C-N 3.34Å; L223-S225 PolarHBondContact O-N 2.8Å; L223-V226 PolarHBondContact O-N 3.07Å; L223-L227 HydrophobicContact CD1-CD1 4.2Å; L223-L227 HydrophobicContact CD1-CG 4.22Å; L223-L227 HydrophobicContact CG-CD1 4.04Å; L223-L227 HydrophobicContact CG-CG 4.45Å; L223-L227 VanDerWaalsContact O-CG 3.3Å; L223-L227 WeakPolarHBondContact O-CG 3.23Å; L223-L227 PolarHBondContact O-N 2.72Å
224	C	93.9	Very high	89.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-46.5	177.1	-175	0	0	0	0	111.4	V100 I182 L220 P221 H222 V226 L227 M228	V100-C224 HydrophobicContact CG2-CB 4.12Å; I182-C224 HydrophobicContact CD1-CB 3.77Å; I182-C224 HydrophobicContact CG1-CB 3.78Å; I182-C224 VanDerWaalsContact CG1-SG 3.56Å; L220-C224 WeakPolarHBondContact O-CB 3.29Å; L220-C224 PolarHBondContact O-N 3.23Å; P221-C224 PolarHBondContact O-N 2.85Å; H222-C224 VanDerWaalsContact C-N 3.33Å; H222-C224 PolarHBondContact O-N 3.08Å; C224-V226 PolarHBondContact O-N 2.93Å; C224-L227 PolarHBondContact O-N 3.48Å; C224-M228 WeakPolarHBondContact O-CB 3.18Å; C224-M228 VanDerWaalsContact O-CG 3.25Å; C224-M228 WeakPolarHBondContact O-CG 3.33Å; C224-M228 PolarHBondContact O-N 3.01Å
225	S	90.3	Very high	88	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-43	176.7	178.8	0	0	0	0	113	T46 P221 H222 L223 M228 Y229 R234	T46-S225 WeakPolarHBondContact CG2-OG 3.23Å; T46-S225 PolarHBondContact OG1-OG 3.07Å; T46-S225 VanDerWaalsContact OG1-OG 3.08Å; P221-S225 WeakPolarHBondContact O-CB 3.03Å; P221-S225 PolarHBondContact O-N 3.47Å; H222-S225 PolarHBondContact O-N 3.41Å; L223-S225 VanDerWaalsContact C-N 3.34Å; L223-S225 PolarHBondContact O-N 2.8Å; S225-M228 PolarHBondContact O-N 3.24Å; S225-Y229 WeakPolarHBondContact O-CB 3.4Å; S225-Y229 PolarHBondContact O-N 3.44Å; S225-R234 PolarHBondContact OG-NH1 3.3Å; S225-R234 PolarHBondContact OG-NH2 2.99Å
226	V	88.7	Confident	86.2	Confident	34 Å²	34	37.9 Å²	37.9	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-43.2	175.4	171.5	0	0	0	0	111	L43 T46 F47 H222 L223 C224 Y229 L230	L43-V226 HydrophobicContact CD2-CG2 4.2Å; T46-V226 HydrophobicContact CG2-CG2 4.38Å; F47-V226 HydrophobicContact CE2-CG2 4.05Å; F47-V226 HydrophobicContact CZ-CG2 4.08Å; H222-V226 WeakPolarHBondContact O-CG2 3.39Å; H222-V226 PolarHBondContact O-N 2.86Å; L223-V226 PolarHBondContact O-N 3.07Å; C224-V226 PolarHBondContact O-N 2.93Å; V226-Y229 WeakPolarHBondContact O-CB 3.37Å; V226-Y229 PolarHBondContact O-N 3.12Å; V226-L230 HydrophobicContact CG1-CD1 4.18Å; V226-L230 HydrophobicContact CG1-CG 4.44Å; V226-L230 WeakPolarHBondContact O-CG 3.27Å; V226-L230 PolarHBondContact O-N 2.89Å
227	L	89.4	Confident	84.5	Confident	59 Å²	59	36.5 Å²	36.5	31%	0.309	21%	0.206	S	C	.	.	H	α-helix	trans	-66.5	-39.3	177.5	-66.5	173.8	0	0	0	112.3	W178 L223 C224 Y229 L230 T231	W178-L227 HydrophobicContact CH2-CB 3.55Å; W178-L227 HydrophobicContact CZ3-CB 3.6Å; W178-L227 HydrophobicContact CZ3-CD1 4.2Å; L223-L227 HydrophobicContact CD1-CD1 4.2Å; L223-L227 HydrophobicContact CD1-CG 4.22Å; L223-L227 HydrophobicContact CG-CD1 4.04Å; L223-L227 HydrophobicContact CG-CG 4.45Å; L223-L227 VanDerWaalsContact O-CG 3.3Å; L223-L227 WeakPolarHBondContact O-CG 3.23Å; L223-L227 PolarHBondContact O-N 2.72Å; C224-L227 PolarHBondContact O-N 3.48Å; L227-Y229 PolarHBondContact O-N 3.38Å; L227-L230 PolarHBondContact O-N 3.25Å; L227-T231 WeakPolarHBondContact O-CB 3.33Å; L227-T231 WeakPolarHBondContact O-CG2 3.26Å; L227-T231 PolarHBondContact O-N 3.45Å; L227-T231 PolarHBondContact O-OG1 2.87Å
228	M	88.7	Confident	82.6	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-37.3	173.1	-74.7	174.4	70	0	0	111.6	W97 V100 W178 C224 S225 T231 G232 T233 R234 I237	W97-M228 HydrophobicContact CH2-CE 4.1Å; W97-M228 HydrophobicContact CH2-SD 4.24Å; W97-M228 HydrophobicContact CZ3-SD 4.36Å; V100-M228 HydrophobicContact CG1-CE 4.28Å; V100-M228 HydrophobicContact CG1-SD 3.5Å; V100-M228 WeakPolarHBondContact CG1-SD 3.35Å; W178-M228 HydrophobicContact CB-CE 4.32Å; W178-M228 HydrophobicContact CB-CG 4.03Å; W178-M228 HydrophobicContact CB-SD 3.79Å; W178-M228 HydrophobicContact CD2-CG 3.33Å; W178-M228 HydrophobicContact CD2-SD 4.26Å; W178-M228 HydrophobicContact CE3-CG 3.83Å; W178-M228 HydrophobicContact CG-CE 4.31Å; W178-M228 HydrophobicContact CG-CG 3.41Å; W178-M228 VanDerWaalsContact CG-CG 3.41Å; W178-M228 HydrophobicContact CG-SD 3.84Å; W178-M228 HydrophobicContact CZ2-CG 4.28Å; W178-M228 HydrophobicContact CZ3-CG 4.49Å; C224-M228 WeakPolarHBondContact O-CB 3.18Å; C224-M228 VanDerWaalsContact O-CG 3.25Å; C224-M228 WeakPolarHBondContact O-CG 3.33Å; C224-M228 PolarHBondContact O-N 3.01Å; S225-M228 PolarHBondContact O-N 3.24Å; M228-T231 PolarHBondContact O-OG1 3.2Å; M228-G232 PolarHBondContact O-N 3.04Å; M228-T233 HydrophobicContact CE-CG2 4.39Å; M228-T233 WeakPolarHBondContact O-CA 3.43Å; M228-T233 WeakPolarHBondContact O-CB 3.21Å; M228-T233 PolarHBondContact O-N 2.85Å; M228-R234 HydrophobicContact CB-CB 4.42Å; M228-R234 PolarHBondContact O-N 2.96Å; M228-I237 HydrophobicContact CE-CD1 3.16Å
229	Y	83.1	Confident	80.6	Confident	27 Å²	27	43.1 Å²	43.1	11%	0.106	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-50.5	174.6	176.2	-103.7	0	0	0	111.8	K39 A42 L43 S225 V226 L227 T231 G232 R234	K39-Y229 WeakPolarHBondContact CA-OH 3.27Å; K39-Y229 WeakPolarHBondContact CB-OH 3.49Å; K39-Y229 WeakPolarHBondContact CD-OH 3.45Å; K39-Y229 WeakPolarHBondContact CG-OH 3.22Å; A42-Y229 HydrophobicContact CB-CD2 4.31Å; A42-Y229 HydrophobicContact CB-CE2 4.01Å; L43-Y229 HydrophobicContact CD2-CD1 3.93Å; L43-Y229 HydrophobicContact CD2-CE1 4.32Å; L43-Y229 HydrophobicContact CG-CD1 4.36Å; L43-Y229 HydrophobicContact CG-CE1 4.28Å; S225-Y229 WeakPolarHBondContact O-CB 3.4Å; S225-Y229 PolarHBondContact O-N 3.44Å; V226-Y229 WeakPolarHBondContact O-CB 3.37Å; V226-Y229 PolarHBondContact O-N 3.12Å; L227-Y229 PolarHBondContact O-N 3.38Å; Y229-T231 PolarHBondContact O-N 3.47Å; Y229-T231 VanDerWaalsContact O-N 3.17Å; Y229-G232 PolarHBondContact O-N 3.47Å; Y229-R234 HydrophobicContact CD2-CB 4.43Å
230	L	83.1	Confident	78.6	Confident	127 Å²	127	44 Å²	44	67%	0.665	24%	0.243	S	C	*	.	H	α-helix	trans	-60.9	-28	179	-67.8	175.9	0	0	0	113.5	V226 L227	V226-L230 HydrophobicContact CG1-CD1 4.18Å; V226-L230 HydrophobicContact CG1-CG 4.44Å; V226-L230 WeakPolarHBondContact O-CG 3.27Å; V226-L230 PolarHBondContact O-N 2.89Å; L227-L230 PolarHBondContact O-N 3.25Å
231	T	82.6	Confident	76.5	Confident	70 Å²	70	44.6 Å²	44.6	43%	0.429	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	6.2	178	58.3	0	0	0	0	113.9	W178 L227 M228 Y229 T233	W178-T231 HydrophobicContact CH2-CG2 4.33Å; W178-T231 HydrophobicContact CZ2-CG2 3.93Å; W178-T231 VanDerWaalsContact CZ2-OG1 3.3Å; W178-T231 WeakPolarHBondContact CZ2-OG1 3.25Å; L227-T231 WeakPolarHBondContact O-CB 3.33Å; L227-T231 WeakPolarHBondContact O-CG2 3.26Å; L227-T231 PolarHBondContact O-N 3.45Å; L227-T231 PolarHBondContact O-OG1 2.87Å; M228-T231 PolarHBondContact O-OG1 3.2Å; Y229-T231 PolarHBondContact O-N 3.47Å; Y229-T231 VanDerWaalsContact O-N 3.17Å; T231-T233 PolarHBondContact O-N 2.9Å; T231-T233 VanDerWaalsContact O-N 3.17Å; T231-T233 PolarHBondContact OG1-OG1 3.03Å; T231-T233 VanDerWaalsContact OG1-OG1 3.08Å
232	G	75.5	Confident	74	Confident	29 Å²	29	46.6 Å²	46.6	30%	0.299	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	7.2	-178	0	0	0	0	0	114.5	M228 Y229 R234	M228-G232 PolarHBondContact O-N 3.04Å; Y229-G232 PolarHBondContact O-N 3.47Å; G232-R234 VanDerWaalsContact C-N 3.34Å
233	T	74.9	Confident	71.6	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-71.7	-33.2	179.5	-48.9	0	0	0	0	110.9	R161 C174 W178 M228 T231 D235 V236 I237	R161-T233 PolarHBondContact NH1-OG1 3.36Å; C174-T233 HydrophobicContact CB-CG2 4.25Å; C174-T233 WeakPolarHBondContact O-CG2 3.23Å; W178-T233 PolarHBondContact NE1-OG1 3.2Å; M228-T233 HydrophobicContact CE-CG2 4.39Å; M228-T233 WeakPolarHBondContact O-CA 3.43Å; M228-T233 WeakPolarHBondContact O-CB 3.21Å; M228-T233 PolarHBondContact O-N 2.85Å; T231-T233 PolarHBondContact O-N 2.9Å; T231-T233 VanDerWaalsContact O-N 3.17Å; T231-T233 PolarHBondContact OG1-OG1 3.03Å; T231-T233 VanDerWaalsContact OG1-OG1 3.08Å; T233-D235 VanDerWaalsContact C-N 3.33Å; T233-D235 PolarHBondContact O-N 3.14Å; T233-V236 PolarHBondContact O-N 3.01Å; T233-I237 HydrophobicContact CG2-CD1 3.93Å; T233-I237 WeakPolarHBondContact O-CG1 3.41Å; T233-I237 PolarHBondContact O-N 3.07Å; T233-I237 VanDerWaalsContact O-N 3.07Å
234	R	65.8	Low	68.8	Low	46 Å²	46	47.8 Å²	47.8	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-33.5	179.9	-162.4	169.5	179.1	81.1	-5.3	112.4	T46 V100 S225 M228 Y229 G232 I237 S238	T46-R234 PolarHBondContact OG1-NH2 3.22Å; V100-R234 PolarHBondContact O-NH1 3.09Å; V100-R234 VanDerWaalsContact O-NH1 3.15Å; S225-R234 PolarHBondContact OG-NH1 3.3Å; S225-R234 PolarHBondContact OG-NH2 2.99Å; M228-R234 HydrophobicContact CB-CB 4.42Å; M228-R234 PolarHBondContact O-N 2.96Å; Y229-R234 HydrophobicContact CD2-CB 4.43Å; G232-R234 VanDerWaalsContact C-N 3.34Å; R234-I237 PolarHBondContact O-N 3.43Å; R234-S238 VanDerWaalsContact O-CB 3.23Å; R234-S238 WeakPolarHBondContact O-CB 3.46Å; R234-S238 PolarHBondContact O-N 2.85Å
235	D	62.2	Low	66.3	Low	89 Å²	89	53 Å²	53	48%	0.476	31%	0.313	S	S	.	.	H	α-helix	trans	-68.9	-39.1	178.3	-57.1	-29.8	0	0	0	111.5	T233 I237 S238 T239	T233-D235 VanDerWaalsContact C-N 3.33Å; T233-D235 PolarHBondContact O-N 3.14Å; D235-I237 VanDerWaalsContact C-N 3.34Å; D235-S238 PolarHBondContact O-N 3.31Å; D235-T239 WeakPolarHBondContact O-CG2 3.48Å; D235-T239 PolarHBondContact O-N 2.84Å; D235-T239 VanDerWaalsContact O-N 3.12Å; D235-T239 PolarHBondContact O-OG1 2.79Å
236	V	60.1	Low	63.5	Low	47 Å²	47	60.2 Å²	60.2	29%	0.285	35%	0.352	S	S	.	.	H	α-helix	trans	-66.1	-37.1	173.6	-178.6	0	0	0	0	111.3	C174 T233 T239 K240	C174-V236 HydrophobicContact CB-CG1 4.38Å; T233-V236 PolarHBondContact O-N 3.01Å; V236-T239 WeakPolarHBondContact CA-OG1 3.49Å; V236-T239 PolarHBondContact O-OG1 2.91Å; V236-K240 PolarHBondContact O-N 2.96Å
237	I	62.5	Low	60.9	Low	15 Å²	15	68 Å²	68	8%	0.077	40%	0.399	C	S	.	.	H	α-helix	trans	-73.3	-41.6	177.4	-70.7	170.7	0	0	0	110.9	M228 T233 R234 D235 T239 K240 H241	M228-I237 HydrophobicContact CE-CD1 3.16Å; T233-I237 HydrophobicContact CG2-CD1 3.93Å; T233-I237 WeakPolarHBondContact O-CG1 3.41Å; T233-I237 PolarHBondContact O-N 3.07Å; T233-I237 VanDerWaalsContact O-N 3.07Å; R234-I237 PolarHBondContact O-N 3.43Å; D235-I237 VanDerWaalsContact C-N 3.34Å; I237-T239 VanDerWaalsContact C-N 3.34Å; I237-T239 PolarHBondContact O-N 3.15Å; I237-K240 PolarHBondContact O-N 3.46Å; I237-H241 VanDerWaalsContact CG2-ND1 3.33Å; I237-H241 WeakPolarHBondContact CG2-ND1 3.05Å; I237-H241 WeakPolarHBondContact O-CB 3.33Å; I237-H241 PolarHBondContact O-N 3.11Å; I237-H241 PolarHBondContact O-ND1 3.22Å
238	S	57.8	Low	59.5	Low	43 Å²	43	68.5 Å²	68.5	30%	0.301	40%	0.403	S	S	.	.	H	α-helix	trans	-59.3	-43	178.5	-177.8	0	0	0	0	112.3	R234 D235 H241 G242 V243	R234-S238 VanDerWaalsContact O-CB 3.23Å; R234-S238 WeakPolarHBondContact O-CB 3.46Å; R234-S238 PolarHBondContact O-N 2.85Å; D235-S238 PolarHBondContact O-N 3.31Å; S238-H241 PolarHBondContact O-N 2.97Å; S238-G242 PolarHBondContact O-N 3.48Å; S238-G242 VanDerWaalsContact O-N 3.15Å; S238-V243 PolarHBondContact O-N 3.28Å; S238-V243 WeakPolarHBondContact OG-CB 3.48Å; S238-V243 WeakPolarHBondContact OG-CG2 3.5Å
239	T	55.8	Low	57.9	Low	113 Å²	113	72 Å²	72	69%	0.693	42%	0.424	S	S	*	.	H	α-helix	trans	-66.2	-38.9	176	46.7	0	0	0	0	112.5	D235 V236 I237	D235-T239 WeakPolarHBondContact O-CG2 3.48Å; D235-T239 PolarHBondContact O-N 2.84Å; D235-T239 VanDerWaalsContact O-N 3.12Å; D235-T239 PolarHBondContact O-OG1 2.79Å; V236-T239 WeakPolarHBondContact CA-OG1 3.49Å; V236-T239 PolarHBondContact O-OG1 2.91Å; I237-T239 VanDerWaalsContact C-N 3.34Å; I237-T239 PolarHBondContact O-N 3.15Å
240	K	54.5	Low	56.5	Low	100 Å²	100	74.5 Å²	74.5	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-70.4	-38.5	174.9	-172.7	-175.4	177.6	-165.2	0	113.2	S172 V236 I237 G242	S172-K240 PolarHBondContact O-NZ 2.92Å; V236-K240 PolarHBondContact O-N 2.96Å; I237-K240 PolarHBondContact O-N 3.46Å; K240-G242 VanDerWaalsContact C-N 3.27Å; K240-G242 PolarHBondContact O-N 3.09Å
241	H	53.6	Low	55	Low	21 Å²	21	71.4 Å²	71.4	10%	0.097	43%	0.429	C	S	.	.	H	α-helix	trans	-86.9	3.7	-176.6	-66.8	81.7	0	0	0	113.2	K105 D108 E111 I237 S238	K105-H241 WeakPolarHBondContact CE-O 3.27Å; K105-H241 VanDerWaalsContact NZ-C 3.27Å; K105-H241 PolarHBondContact NZ-O 3.27Å; D108-H241 IonicContact OD1-CD2 3.9Å; D108-H241 PolarHBondContact OD1-CD2 3.35Å; D108-H241 IonicContact OD1-NE2 3.61Å; E111-H241 IonicContact OE1-CE1 3.9Å; E111-H241 IonicContact OE1-NE2 3.53Å; I237-H241 VanDerWaalsContact CG2-ND1 3.33Å; I237-H241 WeakPolarHBondContact CG2-ND1 3.05Å; I237-H241 WeakPolarHBondContact O-CB 3.33Å; I237-H241 PolarHBondContact O-N 3.11Å; I237-H241 PolarHBondContact O-ND1 3.22Å; S238-H241 PolarHBondContact O-N 2.97Å
242	G	43.9	Very low	53.3	Low	43 Å²	43	71.5 Å²	71.5	44%	0.443	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	68.4	176.4	0	0	0	0	0	110.7	S238 K240 A244	S238-G242 PolarHBondContact O-N 3.48Å; S238-G242 VanDerWaalsContact O-N 3.15Å; K240-G242 VanDerWaalsContact C-N 3.27Å; K240-G242 PolarHBondContact O-N 3.09Å; G242-A244 PolarHBondContact O-N 2.84Å; G242-A244 VanDerWaalsContact O-N 3.14Å
243	V	43.3	Very low	51.8	Low	58 Å²	58	74.3 Å²	74.3	35%	0.352	44%	0.437	S	S	.	.			trans	-72.6	92.8	145.9	-176.1	0	0	0	0	105.6	S238 I245	S238-V243 PolarHBondContact O-N 3.28Å; S238-V243 WeakPolarHBondContact OG-CB 3.48Å; S238-V243 WeakPolarHBondContact OG-CG2 3.5Å; V243-I245 HydrophobicContact CG1-CB 4.42Å; V243-I245 HydrophobicContact CG1-CG1 3.49Å; V243-I245 VanDerWaalsContact CG1-CG1 3.49Å; V243-I245 PolarHBondContact O-N 3.33Å
244	A	35.5	Very low	50.1	Low	75 Å²	75	79.4 Å²	79.4	62%	0.62	47%	0.467	S	S	*	.			trans	-58.1	101	140.2	0	0	0	0	0	104.2	G242 D246	G242-A244 PolarHBondContact O-N 2.84Å; G242-A244 VanDerWaalsContact O-N 3.14Å; A244-D246 PolarHBondContact O-N 3.43Å
245	I	42.1	Very low	48.9	Very low	110 Å²	110	82 Å²	82	56%	0.564	49%	0.49	S	S	*	.			trans	-68.1	90.4	151.2	-57.3	-177.6	0	0	0	100.7	V243 V247	V243-I245 HydrophobicContact CG1-CB 4.42Å; V243-I245 HydrophobicContact CG1-CG1 3.49Å; V243-I245 VanDerWaalsContact CG1-CG1 3.49Å; V243-I245 PolarHBondContact O-N 3.33Å; I245-V247 VanDerWaalsContact C-N 3.28Å; I245-V247 HydrophobicContact CG2-CG2 4.1Å; I245-V247 PolarHBondContact O-N 2.88Å
246	D	29.9	Very low	47.8	Very low	154 Å²	154	81.4 Å²	81.4	82%	0.824	49%	0.491	S	S	*	.			trans	-61.2	106	164	-92	-17.9	0	0	0	104.9	A244	A244-D246 PolarHBondContact O-N 3.43Å
247	V	34.8	Very low	46.7	Very low	198 Å²	198	84.5 Å²	84.5	100%	1.2	51%	0.51	S	S	*	.			trans	-82.7	0	161.9	178.4	0	0	0	0	107.2	I245	I245-V247 VanDerWaalsContact C-N 3.28Å; I245-V247 HydrophobicContact CG2-CG2 4.1Å; I245-V247 PolarHBondContact O-N 2.88Å

Retrieved 247 of 247 residues in 45.5 ms (Link to these results)

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