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Isoform 3 of Cyclin-L1 AlphaSync

Canonical isoform description: Regulatory component of the cyclin-L-CDK11 complex that regulates transcription and pre-mRNA splicing^1,2,3. Inhibited by the CDK-specific inhibitor CDKN1A/p21⁴. May be a candidate proto-oncogene in head and neck squamous cell carcinomas (HNSCC)^5,6.

AlphaFold DB , UniProt , Accession Q9UK58-5 (canonical: Q9UK58), Species HUMAN (Homo sapiens, Human), Gene CCNL1, Length 172 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.3	Very low	46.9	Very low	242 Å²	242	130.5 Å²	130.5	100%	1.192	85%	0.852	S	S	*	*				0	88	0	-63.8	-177.8	174.9	0	0	105.6
2	A	50.5	Low	46.2	Very low	97 Å²	97	128.4 Å²	128.4	80%	0.802	85%	0.854	S	S	*	*				63.5	123.1	82.4	0	0	0	0	0	110.7
3	S	48.5	Very low	45.1	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	86%	0.857	S	S	*	*			cis	-163.1	153.8	0	-73	0	0	0	0	106.5
4	G	53.6	Low	44.7	Very low	71 Å²	71	125.1 Å²	125.1	73%	0.732	86%	0.857	S	S	*	*			trans	-76	-141.7	173.4	0	0	0	0	0	113.1
5	P	58.4	Low	44	Very low	127 Å²	127	123.3 Å²	123.3	83%	0.825	85%	0.854	S	S	*	*			cis	-137.7	179.2	-22.3	36.1	-16.2	0	0	0	113.9
6	H	44.2	Very low	44.1	Very low	191 Å²	191	122.4 Å²	122.4	88%	0.884	85%	0.848	S	S	*	*			trans	-66.8	146.9	171.4	-73.6	-97.2	0	0	0	113.3
7	S	61.2	Low	44	Very low	124 Å²	124	121.9 Å²	121.9	87%	0.867	85%	0.845	S	S	*	*			trans	-113	139.5	170.4	-61.4	0	0	0	0	111.9
8	T	42	Very low	44	Very low	138 Å²	138	121.2 Å²	121.2	85%	0.847	85%	0.848	S	S	*	*			trans	-97.9	158.8	-173.7	0.7	0	0	0	0	112.8
9	A	39.7	Very low	44.4	Very low	88 Å²	88	119.8 Å²	119.8	73%	0.727	84%	0.844	S	S	*	*			trans	72.9	132.5	151.5	0	0	0	0	0	119.1
10	T	39.9	Very low	44.5	Very low	140 Å²	140	120 Å²	120	86%	0.859	84%	0.842	S	S	*	*				179.2	134.5	97.8	-57.8	0	0	0	0	109.8
11	A	32.3	Very low	44.4	Very low	98 Å²	98	119.8 Å²	119.8	81%	0.81	84%	0.841	S	S	*	*			trans	-78.9	150	175.6	0	0	0	0	0	112.1
12	A	38.9	Very low	44.6	Very low	106 Å²	106	113.5 Å²	113.5	88%	0.876	83%	0.827	S	S	*	*			trans	-148.1	115.1	163.2	0	0	0	0	0	110.1
13	A	31.9	Very low	44	Very low	107 Å²	107	112.8 Å²	112.8	88%	0.884	83%	0.83	S	S	*	*			trans	-95	135	162.2	0	0	0	0	0	108.2
14	A	39.5	Very low	43.5	Very low	104 Å²	104	111.1 Å²	111.1	86%	0.86	83%	0.831	S	S	*	*			trans	-148.5	122.9	166.1	0	0	0	0	0	109.6
15	A	34.1	Very low	42.8	Very low	98 Å²	98	113.5 Å²	113.5	81%	0.81	84%	0.837	S	S	*	*			trans	-90.4	150.8	172.5	0	0	0	0	0	110.8
16	S	46	Very low	42.4	Very low	108 Å²	108	112.9 Å²	112.9	76%	0.755	84%	0.835	S	S	*	*			trans	175.7	110.4	153.3	23.7	0	0	0	0	108.5
17	S	42.8	Very low	42.3	Very low	115 Å²	115	109.8 Å²	109.8	80%	0.804	84%	0.835	S	S	*	*				90.6	116.2	80.2	70.5	0	0	0	0	113.4
18	A	44.1	Very low	41.1	Very low	108 Å²	108	107 Å²	107	89%	0.893	83%	0.826	S	S	*	*			trans	-159.3	139.2	153.1	0	0	0	0	0	111.3
19	A	50.7	Low	41.2	Very low	95 Å²	95	107.1 Å²	107.1	79%	0.785	83%	0.827	S	S	*	*			trans	-73.3	-163.5	-166.4	0	0	0	0	0	114.5
20	P	47.5	Very low	40.9	Very low	124 Å²	124	108.3 Å²	108.3	81%	0.805	83%	0.825	S	S	*	*			cis	-144	-173.3	6.8	38.6	-14	0	0	0	117.8
21	S	41.3	Very low	41.1	Very low	115 Å²	115	108.2 Å²	108.2	80%	0.804	82%	0.824	S	S	*	*			trans	-76.6	171.4	-175.4	46.4	0	0	0	0	118.1
22	A	49.4	Very low	41.4	Very low	110 Å²	110	108.1 Å²	108.1	91%	0.909	81%	0.814	S	S	*	*			trans	85.7	133.2	170.1	0	0	0	0	0	114.7
23	G	37.2	Very low	41.3	Very low	83 Å²	83	108.7 Å²	108.7	86%	0.856	81%	0.807	S	S	*	*			cis	156.4	134.8	10.5	0	0	0	0	0	105.4
24	G	38.8	Very low	41.5	Very low	83 Å²	83	109.4 Å²	109.4	86%	0.856	80%	0.8	S	S	*	*			trans	167.9	94.7	-179.2	0	0	0	0	0	114.4
25	S	39	Very low	41.3	Very low	122 Å²	122	110.5 Å²	110.5	85%	0.853	80%	0.797	S	S	*	*			trans	-68	143.2	172.6	-48.2	0	0	0	0	112.4
26	S	50.5	Low	41.4	Very low	113 Å²	113	112 Å²	112	79%	0.79	80%	0.796	S	S	*	*				174.3	120.2	125	56	0	0	0	0	113.5
27	S	40.8	Very low	41.5	Very low	127 Å²	127	112.9 Å²	112.9	89%	0.888	80%	0.797	S	S	*	*				60.7	121	129.1	-160.6	0	0	0	0	120.8
28	G	37.3	Very low	42.3	Very low	66 Å²	66	110.4 Å²	110.4	68%	0.68	79%	0.789	S	S	*	*			trans	152.2	93.6	144.5	0	0	0	0	0	117.4
29	T	43.6	Very low	43.3	Very low	139 Å²	139	106.7 Å²	106.7	85%	0.853	76%	0.761	S	S	*	*			trans	90.6	86.7	145.5	-39.7	0	0	0	0	119.5
30	T	34.2	Very low	44.4	Very low	114 Å²	114	105.8 Å²	105.8	70%	0.699	74%	0.743	S	S	*	*			trans	-0.7	123.3	132.7	-46.3	0	0	0	0	118.5
31	T	42.8	Very low	45.8	Very low	137 Å²	137	106 Å²	106	84%	0.84	74%	0.736	S	S	*	*				-159.8	90.4	126.2	-64.4	0	0	0	0	110.1
32	T	38.2	Very low	47.5	Very low	96 Å²	96	105.6 Å²	105.6	59%	0.589	72%	0.724	S	S	*	*				32.1	122.9	125.6	-29.9	0	0	0	0	120.8
33	T	37.6	Very low	49	Very low	118 Å²	118	103.6 Å²	103.6	72%	0.724	71%	0.714	S	S	*	*			trans	66.7	138.9	142.2	53	0	0	0	0	118.8
34	T	36.7	Very low	51.1	Low	122 Å²	122	108 Å²	108	75%	0.748	72%	0.718	S	S	*	*			cis	-171.7	145.9	8.8	19.3	0	0	0	0	107.5
35	T	34.1	Very low	52.7	Low	128 Å²	128	112.6 Å²	112.6	79%	0.785	71%	0.709	S	S	*	*			trans	-20.1	137.8	160.9	17.2	0	0	0	0	118.4
36	T	37.2	Very low	54.6	Low	130 Å²	130	112.4 Å²	112.4	80%	0.798	70%	0.698	S	S	*	*			trans	101.2	109.2	151.6	-25.7	0	0	0	0	117.5
37	T	47.5	Very low	55.6	Low	126 Å²	126	112.4 Å²	112.4	77%	0.773	68%	0.682	S	S	*	*			trans	95.4	67.7	161.2	-17	0	0	0	0	119.5	G39	T37-G39 PolarHBondContact O-N 3.13Å; T37-G39 VanDerWaalsContact O-N 3.13Å
38	G	59.5	Low	57.2	Low	62 Å²	62	110.7 Å²	110.7	64%	0.639	67%	0.67	S	S	*	*				67.8	17.1	118	0	0	0	0	0	122.3
39	G	65.2	Low	58.8	Low	30 Å²	30	113.4 Å²	113.4	31%	0.309	67%	0.665	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-170.4	164.1	175.8	0	0	0	0	0	116.6	T37 Y47	T37-G39 PolarHBondContact O-N 3.13Å; T37-G39 VanDerWaalsContact O-N 3.13Å; G39-Y47 CarbonylContact C-O 3.34Å; G39-Y47 VanDerWaalsContact C-O 3.32Å; G39-Y47 WeakPolarHBondContact CA-O 3.47Å
40	I	74.1	Confident	59.7	Low	77 Å²	77	111.3 Å²	111.3	40%	0.395	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.9	117.6	176	-57	152.5	0	0	0	107.6	I42 Y47 V50	I40-I42 HydrophobicContact CG2-CD1 4.39Å; I40-I42 HydrophobicContact CG2-CG1 4.03Å; I40-Y47 PolarHBondContact N-O 3.31Å; I40-Y47 WeakPolarHBondContact O-CB 3.47Å; I40-Y47 PolarHBondContact O-N 2.88Å; I40-V50 HydrophobicContact CD1-CG2 4.4Å
41	L	76	Confident	61.3	Low	127 Å²	127	108.5 Å²	108.5	67%	0.665	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.6	119.8	174	-72.7	167.2	0	0	0	110	R45 L46	L41-R45 WeakPolarHBondContact CA-O 3.35Å; L41-L46 HydrophobicContact CD2-CB 3.7Å; L41-L46 HydrophobicContact CD2-CD1 3.58Å; L41-L46 HydrophobicContact CD2-CG 4.23Å; L41-L46 HydrophobicContact CG-CD1 3.66Å
42	I	78.8	Confident	62.3	Low	107 Å²	107	109.6 Å²	109.6	55%	0.549	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.9	110.5	171.2	-54.9	174.1	0	0	0	108	I40 R45 Y47	I40-I42 HydrophobicContact CG2-CD1 4.39Å; I40-I42 HydrophobicContact CG2-CG1 4.03Å; I42-R45 PolarHBondContact N-O 3.41Å; I42-R45 PolarHBondContact O-N 3.36Å; I42-Y47 HydrophobicContact CB-CD2 3.91Å; I42-Y47 HydrophobicContact CB-CE2 3.7Å; I42-Y47 HydrophobicContact CD1-CD2 4.04Å; I42-Y47 HydrophobicContact CD1-CE2 4.25Å; I42-Y47 HydrophobicContact CG1-CD2 4.01Å; I42-Y47 HydrophobicContact CG1-CE2 4.25Å
43	G	81	Confident	63.6	Low	68 Å²	68	108.1 Å²	108.1	70%	0.701	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.3	-132.9	-166.6	0	0	0	0	0	110.3	R45	G43-R45 VanDerWaalsContact C-N 3.27Å; G43-R45 PolarHBondContact O-N 3.01Å
44	D	80.4	Confident	65.1	Low	175 Å²	175	109.6 Å²	109.6	94%	0.936	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	13.1	179.4	-55.2	-25.5	0	0	0	113.1
45	R	73.1	Confident	66.2	Low	180 Å²	180	110 Å²	110	68%	0.679	63%	0.627	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	-176.6	-65.8	-164.5	-172.9	-104.6	2.1	112	L41 I42 G43 Y47	L41-R45 WeakPolarHBondContact CA-O 3.35Å; I42-R45 PolarHBondContact N-O 3.41Å; I42-R45 PolarHBondContact O-N 3.36Å; G43-R45 VanDerWaalsContact C-N 3.27Å; G43-R45 PolarHBondContact O-N 3.01Å; R45-Y47 HydrophobicContact CB-CD2 4.29Å; R45-Y47 HydrophobicContact CB-CE2 3.62Å; R45-Y47 WeakPolarHBondContact O-CD2 3.44Å
46	L	78.6	Confident	67.4	Low	118 Å²	118	110.3 Å²	110.3	62%	0.618	62%	0.619	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.7	107.5	170.1	-173.3	67.9	0	0	0	109.1	L41	L41-L46 HydrophobicContact CD2-CB 3.7Å; L41-L46 HydrophobicContact CD2-CD1 3.58Å; L41-L46 HydrophobicContact CD2-CG 4.23Å; L41-L46 HydrophobicContact CG-CD1 3.66Å
47	Y	71.8	Confident	68.5	Low	113 Å²	113	107.4 Å²	107.4	44%	0.443	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.5	146.2	170.9	-66	-94.2	0	0	0	108.9	G39 I40 I42 R45	G39-Y47 CarbonylContact C-O 3.34Å; G39-Y47 VanDerWaalsContact C-O 3.32Å; G39-Y47 WeakPolarHBondContact CA-O 3.47Å; I40-Y47 PolarHBondContact N-O 3.31Å; I40-Y47 WeakPolarHBondContact O-CB 3.47Å; I40-Y47 PolarHBondContact O-N 2.88Å; I42-Y47 HydrophobicContact CB-CD2 3.91Å; I42-Y47 HydrophobicContact CB-CE2 3.7Å; I42-Y47 HydrophobicContact CD1-CD2 4.04Å; I42-Y47 HydrophobicContact CD1-CE2 4.25Å; I42-Y47 HydrophobicContact CG1-CD2 4.01Å; I42-Y47 HydrophobicContact CG1-CE2 4.25Å; R45-Y47 HydrophobicContact CB-CD2 4.29Å; R45-Y47 HydrophobicContact CB-CE2 3.62Å; R45-Y47 WeakPolarHBondContact O-CD2 3.44Å
48	S	73.9	Confident	69.3	Low	92 Å²	92	108 Å²	108	64%	0.643	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-58.1	147.2	170.3	56.1	0	0	0	0	110.2	V50	S48-V50 PolarHBondContact O-N 2.76Å
49	E	69.8	Low	69.5	Low	123 Å²	123	107.2 Å²	107.2	58%	0.575	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-53.5	129.4	171.6	-170.3	-148.3	150.2	0	0	110	S51	E49-S51 WeakPolarHBondContact OE1-CB 3.36Å; E49-S51 PolarHBondContact OE1-OG 3.02Å
50	V	63.9	Low	69.6	Low	95 Å²	95	109.4 Å²	109.4	58%	0.576	59%	0.591	S	S	*	*			trans	-97.8	88.9	173.1	-173.7	0	0	0	0	107.7	I40 S48 L52	I40-V50 HydrophobicContact CD1-CG2 4.4Å; S48-V50 PolarHBondContact O-N 2.76Å; V50-L52 HydrophobicContact CG1-CD2 3.8Å; V50-L52 HydrophobicContact CG1-CG 3.95Å; V50-L52 PolarHBondContact O-N 3.18Å
51	S	67.3	Low	69.4	Low	55 Å²	55	113.7 Å²	113.7	39%	0.385	61%	0.61	S	S	.	*			trans	-80.8	100.5	175.1	-153.2	0	0	0	0	109.8	E49 T53	E49-S51 WeakPolarHBondContact OE1-CB 3.36Å; E49-S51 PolarHBondContact OE1-OG 3.02Å; S51-T53 PolarHBondContact O-N 3Å; S51-T53 PolarHBondContact OG-OG1 3.2Å
52	L	63.2	Low	69	Low	160 Å²	160	115.6 Å²	115.6	84%	0.838	62%	0.615	S	S	*	*			trans	-92.3	66.7	176.8	-62.1	-178.8	0	0	0	110.6	V50	V50-L52 HydrophobicContact CG1-CD2 3.8Å; V50-L52 HydrophobicContact CG1-CG 3.95Å; V50-L52 PolarHBondContact O-N 3.18Å
53	T	66.1	Low	68.3	Low	65 Å²	65	117.7 Å²	117.7	40%	0.399	62%	0.616	S	S	.	*			trans	-96.4	142.8	175.5	-44.4	0	0	0	0	110	S51 D55 H56	S51-T53 PolarHBondContact O-N 3Å; S51-T53 PolarHBondContact OG-OG1 3.2Å; T53-D55 HydrophobicContact CG2-CB 4.13Å; T53-D55 WeakPolarHBondContact CG2-OD2 3.43Å; T53-D55 PolarHBondContact O-N 3.49Å; T53-D55 VanDerWaalsContact O-N 3.1Å; T53-H56 PolarHBondContact O-N 3.39Å; T53-H56 VanDerWaalsContact O-N 3.15Å
54	I	68.1	Low	67.6	Low	149 Å²	149	117.9 Å²	117.9	76%	0.764	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-57.2	-26.7	177.7	-56.4	178.2	0	0	0	111	H56 S57	I54-H56 PolarHBondContact O-N 2.95Å; I54-S57 WeakPolarHBondContact O-CB 3.33Å; I54-S57 PolarHBondContact O-N 3.47Å
55	D	60.1	Low	67.3	Low	129 Å²	129	113.6 Å²	113.6	69%	0.69	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-60.2	-28.6	179.9	-55.7	-23.9	0	0	0	113.2	T53 S57	T53-D55 HydrophobicContact CG2-CB 4.13Å; T53-D55 WeakPolarHBondContact CG2-OD2 3.43Å; T53-D55 PolarHBondContact O-N 3.49Å; T53-D55 VanDerWaalsContact O-N 3.1Å; D55-S57 PolarHBondContact O-N 2.87Å
56	H	59.5	Low	67.7	Low	135 Å²	135	108.4 Å²	108.4	63%	0.625	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-78.6	1.1	175.3	-89.7	-71.1	0	0	0	114.2	T53 I54 L58 R113	T53-H56 PolarHBondContact O-N 3.39Å; T53-H56 VanDerWaalsContact O-N 3.15Å; I54-H56 PolarHBondContact O-N 2.95Å; H56-L58 VanDerWaalsContact C-N 3.32Å; H56-R113 PolarHBondContact O-NH2 3.33Å
57	S	60.7	Low	68.1	Low	69 Å²	69	103 Å²	103	48%	0.483	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-72.3	-29.9	174.6	-160.8	0	0	0	0	111.8	I54 D55	I54-S57 WeakPolarHBondContact O-CB 3.33Å; I54-S57 PolarHBondContact O-N 3.47Å; D55-S57 PolarHBondContact O-N 2.87Å
58	L	63.4	Low	68.9	Low	140 Å²	140	98.4 Å²	98.4	73%	0.733	53%	0.53	S	S	*	.	S	Bend	trans	-82.8	132.7	176.2	-59.8	179.3	0	0	0	110.1	H56 P60	H56-L58 VanDerWaalsContact C-N 3.32Å; L58-P60 WeakPolarHBondContact O-CD 3.45Å
59	I	64.2	Low	69.6	Low	45 Å²	45	94 Å²	94	23%	0.231	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-72	121.7	169.2	-65.6	149	0	0	0	106.4	E61 R63 L64 Y116	I59-E61 PolarHBondContact O-N 2.93Å; I59-R63 HydrophobicContact CG2-CB 3.61Å; I59-L64 HydrophobicContact CG2-CD2 4.16Å; I59-Y116 VanDerWaalsContact CD1-CB 3.41Å; I59-Y116 HydrophobicContact CD1-CD2 3.53Å; I59-Y116 HydrophobicContact CD1-CG 3.67Å
60	P	68.7	Low	70.6	Confident	76 Å²	76	91.5 Å²	91.5	49%	0.494	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-52.5	138.9	176.3	-25.1	33.4	0	0	0	110.4	L58 E62 R63	L58-P60 WeakPolarHBondContact O-CD 3.45Å; P60-E62 PolarHBondContact O-N 3.01Å; P60-R63 WeakPolarHBondContact O-CB 3.47Å; P60-R63 PolarHBondContact O-N 3.32Å
61	E	68.5	Low	71.9	Confident	166 Å²	166	92.9 Å²	92.9	78%	0.776	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-56.1	-29.4	-176.2	-64.8	-170.5	163.1	0	0	112.4	I59 R63 L64	I59-E61 PolarHBondContact O-N 2.93Å; E61-R63 PolarHBondContact O-N 3.47Å; E61-R63 VanDerWaalsContact O-N 3.15Å; E61-L64 HydrophobicContact CB-CD1 4.36Å; E61-L64 HydrophobicContact CG-CD1 4.35Å; E61-L64 VanDerWaalsContact O-CB 3.31Å; E61-L64 WeakPolarHBondContact O-CB 3.41Å; E61-L64 PolarHBondContact O-N 3.46Å
62	E	67.8	Low	73	Confident	168 Å²	168	92.9 Å²	92.9	79%	0.785	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-58.3	-24	173.9	-61.6	165.6	-178.1	0	0	113.9	P60	P60-E62 PolarHBondContact O-N 3.01Å
63	R	63.5	Low	74.3	Confident	150 Å²	150	88.6 Å²	88.6	57%	0.566	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-92.8	-7.3	177.4	-65.1	-70	-173.2	166.3	-0.6	113	I59 P60 E61 S65	I59-R63 HydrophobicContact CG2-CB 3.61Å; P60-R63 WeakPolarHBondContact O-CB 3.47Å; P60-R63 PolarHBondContact O-N 3.32Å; E61-R63 PolarHBondContact O-N 3.47Å; E61-R63 VanDerWaalsContact O-N 3.15Å; R63-S65 VanDerWaalsContact C-N 3.35Å
64	L	66.8	Low	75.5	Confident	72 Å²	72	87 Å²	87	38%	0.377	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-25.5	175.3	-59.8	174.5	0	0	0	111.4	I59 E61 T67 Y116	I59-L64 HydrophobicContact CG2-CD2 4.16Å; E61-L64 HydrophobicContact CB-CD1 4.36Å; E61-L64 HydrophobicContact CG-CD1 4.35Å; E61-L64 VanDerWaalsContact O-CB 3.31Å; E61-L64 WeakPolarHBondContact O-CB 3.41Å; E61-L64 PolarHBondContact O-N 3.46Å; L64-T67 VanDerWaalsContact O-CG2 3.25Å; L64-T67 WeakPolarHBondContact O-CG2 3.33Å; L64-Y116 HydrophobicContact CD2-CD1 3.76Å; L64-Y116 HydrophobicContact CD2-CE1 3.49Å; L64-Y116 VanDerWaalsContact CD2-CE1 3.49Å; L64-Y116 HydrophobicContact CD2-CE2 4.45Å; L64-Y116 HydrophobicContact CD2-CG 4.36Å
65	S	74.6	Confident	76.7	Confident	85 Å²	85	83.7 Å²	83.7	59%	0.594	45%	0.451	S	S	*	.	S	Bend	trans	-155.3	122	176.2	59.3	0	0	0	0	111.8	R63	R63-S65 VanDerWaalsContact C-N 3.35Å
66	P	81.4	Confident	78.1	Confident	71 Å²	71	82.3 Å²	82.3	46%	0.461	44%	0.444	S	S	.	.	S	Bend	cis	-77.1	134.6	-3.3	30.3	-31.7	0	0	0	111.5	M70 Q71	P66-M70 HydrophobicContact CB-CB 4.37Å; P66-Q71 HydrophobicContact CB-CG 4.19Å; P66-Q71 HydrophobicContact CG-CG 4.22Å; P66-Q71 PolarHBondContact O-NE2 3.25Å
67	T	86.9	Confident	79.7	Confident	4 Å²	4	79.7 Å²	79.7	3%	0.025	44%	0.438	C	S	.	.			trans	-64.4	158.1	173.7	68.6	0	0	0	0	110.4	L64 S69 M70 Q71 E79 Y116	L64-T67 VanDerWaalsContact O-CG2 3.25Å; L64-T67 WeakPolarHBondContact O-CG2 3.33Å; T67-S69 PolarHBondContact O-N 2.9Å; T67-S69 PolarHBondContact OG1-N 3.45Å; T67-M70 HydrophobicContact CG2-SD 4.34Å; T67-M70 PolarHBondContact O-N 2.81Å; T67-M70 VanDerWaalsContact O-N 3.15Å; T67-M70 WeakPolarHBondContact OG1-CB 3.31Å; T67-M70 VanDerWaalsContact OG1-CG 3.24Å; T67-M70 WeakPolarHBondContact OG1-CG 3.47Å; T67-M70 PolarHBondContact OG1-N 3.25Å; T67-Q71 WeakPolarHBondContact O-CG 3.26Å; T67-Q71 PolarHBondContact O-N 2.85Å; T67-E79 PolarHBondContact OG1-OE1 3.28Å; T67-E79 PolarHBondContact OG1-OE2 3.19Å; T67-Y116 HydrophobicContact CG2-CD1 4.41Å; T67-Y116 HydrophobicContact CG2-CE1 4.32Å
68	P	88.5	Confident	81.3	Confident	18 Å²	18	78.5 Å²	78.5	12%	0.117	43%	0.43	C	S	.	.	H	α-helix	trans	-56.9	-29.9	172.9	-26.3	35.7	0	0	0	113.6	D72 Y116	P68-D72 PolarHBondContact O-N 3.26Å; P68-Y116 WeakPolarHBondContact CD-O 3.41Å; P68-Y116 WeakPolarHBondContact CG-O 3.45Å
69	S	89.7	Confident	82.8	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-73.3	-39.6	177.3	-48	0	0	0	0	111.9	T67 Q71 D72 G73 L74 E79 S119 F120	T67-S69 PolarHBondContact O-N 2.9Å; T67-S69 PolarHBondContact OG1-N 3.45Å; S69-Q71 VanDerWaalsContact C-N 3.3Å; S69-Q71 PolarHBondContact O-N 3.48Å; S69-D72 CarbonylContact O-C 2.99Å; S69-D72 PolarHBondContact O-N 2.91Å; S69-D72 VanDerWaalsContact O-N 3.1Å; S69-G73 PolarHBondContact O-N 3.43Å; S69-L74 WeakPolarHBondContact O-CB 3.33Å; S69-L74 PolarHBondContact O-N 2.84Å; S69-E79 WeakPolarHBondContact CB-OE2 3.47Å; S69-S119 WeakPolarHBondContact CA-OG 3.41Å; S69-S119 WeakPolarHBondContact OG-CA 3.47Å; S69-F120 WeakPolarHBondContact OG-CD2 3.14Å; S69-F120 PolarHBondContact OG-N 3.44Å
70	M	90.7	Very high	84.2	Confident	70 Å²	70	72.9 Å²	72.9	35%	0.345	40%	0.404	S	S	.	.	H	α-helix	trans	-62.2	-38.7	172.9	-71.4	175	74.6	0	0	112.2	P66 T67 D72 G73 L74 L76	P66-M70 HydrophobicContact CB-CB 4.37Å; T67-M70 HydrophobicContact CG2-SD 4.34Å; T67-M70 PolarHBondContact O-N 2.81Å; T67-M70 VanDerWaalsContact O-N 3.15Å; T67-M70 WeakPolarHBondContact OG1-CB 3.31Å; T67-M70 VanDerWaalsContact OG1-CG 3.24Å; T67-M70 WeakPolarHBondContact OG1-CG 3.47Å; T67-M70 PolarHBondContact OG1-N 3.25Å; M70-D72 PolarHBondContact O-N 3.01Å; M70-G73 PolarHBondContact O-N 3.41Å; M70-L74 WeakPolarHBondContact CA-O 3.17Å; M70-L76 HydrophobicContact SD-CD1 3.89Å
71	Q	89.6	Confident	85.5	Confident	123 Å²	123	74.2 Å²	74.2	58%	0.575	41%	0.406	S	S	*	.	H	α-helix	trans	-64	-29	174.6	-66.3	173.4	16.9	0	0	112.5	P66 T67 S69 G73	P66-Q71 HydrophobicContact CB-CG 4.19Å; P66-Q71 HydrophobicContact CG-CG 4.22Å; P66-Q71 PolarHBondContact O-NE2 3.25Å; T67-Q71 WeakPolarHBondContact O-CG 3.26Å; T67-Q71 PolarHBondContact O-N 2.85Å; S69-Q71 VanDerWaalsContact C-N 3.3Å; S69-Q71 PolarHBondContact O-N 3.48Å; Q71-G73 VanDerWaalsContact C-N 3.29Å
72	D	91.5	Very high	86.8	Confident	56 Å²	56	68.5 Å²	68.5	30%	0.299	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	7.4	174.7	-71.6	-23.1	0	0	0	113.2	P68 S69 M70 S119 V121 K122	P68-D72 PolarHBondContact O-N 3.26Å; S69-D72 CarbonylContact O-C 2.99Å; S69-D72 PolarHBondContact O-N 2.91Å; S69-D72 VanDerWaalsContact O-N 3.1Å; M70-D72 PolarHBondContact O-N 3.01Å; D72-S119 WeakPolarHBondContact OD2-CB 3.33Å; D72-S119 PolarHBondContact OD2-OG 3.37Å; D72-V121 HydrophobicContact CB-CB 4.09Å; D72-V121 HydrophobicContact CB-CG2 4.01Å; D72-K122 IonicContact OD1-NZ 2.68Å; D72-K122 PolarHBondContact OD1-NZ 3.5Å; D72-K122 WeakPolarHBondContact OD2-CD 3.38Å; D72-K122 WeakPolarHBondContact OD2-CE 3.09Å; D72-K122 IonicContact OD2-NZ 3.27Å; D72-K122 PolarHBondContact OD2-NZ 2.83Å
73	G	90.9	Very high	88.1	Confident	69 Å²	69	61.3 Å²	61.3	71%	0.711	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	12.2	173.7	0	0	0	0	0	115.8	S69 M70 Q71	S69-G73 PolarHBondContact O-N 3.43Å; M70-G73 PolarHBondContact O-N 3.41Å; Q71-G73 VanDerWaalsContact C-N 3.29Å
74	L	90.5	Very high	89.6	Confident	33 Å²	33	58.2 Å²	58.2	17%	0.173	34%	0.341	C	S	.	.			trans	-82.1	129.5	172.7	-167.4	69.5	0	0	0	110.6	S69 M70 E79 L82 F120 V121	S69-L74 WeakPolarHBondContact O-CB 3.33Å; S69-L74 PolarHBondContact O-N 2.84Å; M70-L74 WeakPolarHBondContact CA-O 3.17Å; L74-E79 HydrophobicContact CD2-CB 3.76Å; L74-E79 HydrophobicContact CD2-CG 4.23Å; L74-E79 HydrophobicContact CG-CB 4.34Å; L74-L82 HydrophobicContact CD2-CD1 3.83Å; L74-F120 HydrophobicContact CD2-CB 3.95Å; L74-V121 HydrophobicContact CB-CG2 4.06Å
75	D	92.5	Very high	91	Very high	79 Å²	79	56.7 Å²	56.7	42%	0.422	33%	0.332	S	S	.	.			trans	-70.1	147.9	175.3	60.6	-67.2	0	0	0	111.8	P77 S78 E79	D75-P77 WeakPolarHBondContact OD2-CD 3.36Å; D75-P77 VanDerWaalsContact OD2-CG 3.27Å; D75-P77 WeakPolarHBondContact OD2-CG 3.26Å; D75-S78 VanDerWaalsContact CG-CB 3.48Å; D75-S78 PolarHBondContact O-N 2.89Å; D75-S78 WeakPolarHBondContact OD1-CB 3.42Å; D75-S78 PolarHBondContact OD1-OG 3.44Å; D75-S78 VanDerWaalsContact OD2-CB 3.27Å; D75-S78 WeakPolarHBondContact OD2-CB 3.44Å; D75-S78 PolarHBondContact OD2-N 3.25Å; D75-S78 PolarHBondContact OD2-OG 3.02Å; D75-E79 PolarHBondContact O-N 2.85Å
76	L	90.5	Very high	92	Very high	100 Å²	100	52.6 Å²	52.6	52%	0.524	30%	0.304	S	S	.	.	H	α-helix	trans	-54.7	-44.6	-179.5	-170	100	0	0	0	114	M70 E79 T80	M70-L76 HydrophobicContact SD-CD1 3.89Å; L76-E79 PolarHBondContact O-N 3.24Å; L76-T80 WeakPolarHBondContact O-CB 3.35Å; L76-T80 PolarHBondContact O-N 3.39Å; L76-T80 PolarHBondContact O-OG1 3.46Å
77	P	93.9	Very high	92.8	Very high	79 Å²	79	50.1 Å²	50.1	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-44.7	178	17.6	-22.7	0	0	0	112	D75 E79 T80 D81	D75-P77 WeakPolarHBondContact OD2-CD 3.36Å; D75-P77 VanDerWaalsContact OD2-CG 3.27Å; D75-P77 WeakPolarHBondContact OD2-CG 3.26Å; P77-E79 VanDerWaalsContact C-N 3.33Å; P77-E79 PolarHBondContact O-N 2.92Å; P77-T80 WeakPolarHBondContact O-CA 3.37Å; P77-T80 WeakPolarHBondContact O-CB 3.47Å; P77-T80 PolarHBondContact O-N 3.05Å; P77-D81 PolarHBondContact O-N 3Å
78	S	93.7	Very high	93.2	Very high	44 Å²	44	55.6 Å²	55.6	31%	0.308	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-38.6	175.2	-62.1	0	0	0	0	112.9	D75 T80 D81 L82	D75-S78 VanDerWaalsContact CG-CB 3.48Å; D75-S78 PolarHBondContact O-N 2.89Å; D75-S78 WeakPolarHBondContact OD1-CB 3.42Å; D75-S78 PolarHBondContact OD1-OG 3.44Å; D75-S78 VanDerWaalsContact OD2-CB 3.27Å; D75-S78 WeakPolarHBondContact OD2-CB 3.44Å; D75-S78 PolarHBondContact OD2-N 3.25Å; D75-S78 PolarHBondContact OD2-OG 3.02Å; S78-T80 VanDerWaalsContact C-N 3.3Å; S78-T80 PolarHBondContact O-N 3.38Å; S78-D81 PolarHBondContact O-N 3.27Å; S78-L82 WeakPolarHBondContact O-CG 3.45Å; S78-L82 PolarHBondContact O-N 3.21Å
79	E	93.9	Very high	93.6	Very high	5 Å²	5	55.2 Å²	55.2	2%	0.023	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-40.7	173.1	-173.7	177.8	164.6	0	0	111.8	T67 S69 L74 D75 L76 P77 L82 R83 F120	T67-E79 PolarHBondContact OG1-OE1 3.28Å; T67-E79 PolarHBondContact OG1-OE2 3.19Å; S69-E79 WeakPolarHBondContact CB-OE2 3.47Å; L74-E79 HydrophobicContact CD2-CB 3.76Å; L74-E79 HydrophobicContact CD2-CG 4.23Å; L74-E79 HydrophobicContact CG-CB 4.34Å; D75-E79 PolarHBondContact O-N 2.85Å; L76-E79 PolarHBondContact O-N 3.24Å; P77-E79 VanDerWaalsContact C-N 3.33Å; P77-E79 PolarHBondContact O-N 2.92Å; E79-L82 PolarHBondContact O-N 3.17Å; E79-R83 VanDerWaalsContact O-CG 3.29Å; E79-R83 WeakPolarHBondContact O-CG 3.34Å; E79-R83 PolarHBondContact O-N 2.8Å; E79-R83 IonicContact OE1-CZ 2.8Å; E79-R83 VanDerWaalsContact OE1-CZ 3.27Å; E79-R83 IonicContact OE1-NE 3.04Å; E79-R83 PolarHBondContact OE1-NE 3.11Å; E79-R83 IonicContact OE1-NH2 2.66Å; E79-R83 PolarHBondContact OE1-NH2 3.25Å; E79-F120 HydrophobicContact CG-CD2 3.85Å; E79-F120 HydrophobicContact CG-CE2 3.91Å
80	T	93.9	Very high	93.9	Very high	63 Å²	63	55.2 Å²	55.2	39%	0.387	31%	0.31	S	S	.	.	H	α-helix	trans	-64.3	-44.8	178.1	-56.8	0	0	0	0	110.8	L76 P77 S78 L82 R83 I84	L76-T80 WeakPolarHBondContact O-CB 3.35Å; L76-T80 PolarHBondContact O-N 3.39Å; L76-T80 PolarHBondContact O-OG1 3.46Å; P77-T80 WeakPolarHBondContact O-CA 3.37Å; P77-T80 WeakPolarHBondContact O-CB 3.47Å; P77-T80 PolarHBondContact O-N 3.05Å; S78-T80 VanDerWaalsContact C-N 3.3Å; S78-T80 PolarHBondContact O-N 3.38Å; T80-L82 VanDerWaalsContact C-N 3.35Å; T80-L82 PolarHBondContact O-N 3.25Å; T80-R83 WeakPolarHBondContact O-CB 3.33Å; T80-R83 PolarHBondContact O-N 3.17Å; T80-R83 VanDerWaalsContact O-N 3.15Å; T80-I84 HydrophobicContact CG2-CD1 4.06Å; T80-I84 WeakPolarHBondContact O-CG1 3.4Å; T80-I84 PolarHBondContact O-N 3.25Å
81	D	95.7	Very high	94.2	Very high	103 Å²	103	54.3 Å²	54.3	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-62.3	-41.4	176.8	-68.7	-20.4	0	0	0	111.6	P77 S78 R83 I84 L85	P77-D81 PolarHBondContact O-N 3Å; S78-D81 PolarHBondContact O-N 3.27Å; D81-R83 VanDerWaalsContact C-N 3.33Å; D81-R83 PolarHBondContact O-N 3.15Å; D81-I84 PolarHBondContact O-N 3.13Å; D81-L85 WeakPolarHBondContact O-CB 3.36Å; D81-L85 PolarHBondContact O-N 2.9Å
82	L	95.5	Very high	94.6	Very high	47 Å²	47	50.1 Å²	50.1	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-36.9	174.3	-72	178.4	0	0	0	112.6	L74 S78 E79 T80 G86 F120 F125	L74-L82 HydrophobicContact CD2-CD1 3.83Å; S78-L82 WeakPolarHBondContact O-CG 3.45Å; S78-L82 PolarHBondContact O-N 3.21Å; E79-L82 PolarHBondContact O-N 3.17Å; T80-L82 VanDerWaalsContact C-N 3.35Å; T80-L82 PolarHBondContact O-N 3.25Å; L82-G86 PolarHBondContact O-N 3.09Å; L82-F120 HydrophobicContact CB-CD1 3.98Å; L82-F120 HydrophobicContact CB-CE1 3.89Å; L82-F120 HydrophobicContact CB-CE2 4.49Å; L82-F120 HydrophobicContact CB-CG 4.33Å; L82-F120 HydrophobicContact CB-CZ 4.15Å; L82-F120 HydrophobicContact CD1-CB 3.79Å; L82-F120 HydrophobicContact CD1-CD1 3.93Å; L82-F120 HydrophobicContact CD1-CG 3.84Å; L82-F125 HydrophobicContact CD2-CD1 4.34Å; L82-F125 HydrophobicContact CD2-CE1 4.49Å
83	R	95.4	Very high	94.9	Very high	17 Å²	17	47.4 Å²	47.4	6%	0.064	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-46.6	175.8	-73.4	171.1	-179.1	-88.8	10.1	111.3	E79 T80 D81 G86 C87 F115 F120	E79-R83 VanDerWaalsContact O-CG 3.29Å; E79-R83 WeakPolarHBondContact O-CG 3.34Å; E79-R83 PolarHBondContact O-N 2.8Å; E79-R83 IonicContact OE1-CZ 2.8Å; E79-R83 VanDerWaalsContact OE1-CZ 3.27Å; E79-R83 IonicContact OE1-NE 3.04Å; E79-R83 PolarHBondContact OE1-NE 3.11Å; E79-R83 IonicContact OE1-NH2 2.66Å; E79-R83 PolarHBondContact OE1-NH2 3.25Å; T80-R83 WeakPolarHBondContact O-CB 3.33Å; T80-R83 PolarHBondContact O-N 3.17Å; T80-R83 VanDerWaalsContact O-N 3.15Å; D81-R83 VanDerWaalsContact C-N 3.33Å; D81-R83 PolarHBondContact O-N 3.15Å; R83-G86 PolarHBondContact O-N 3.46Å; R83-C87 PolarHBondContact O-N 3.2Å; R83-F115 PolarHBondContact NH2-O 3.06Å; R83-F120 HydrophobicContact CG-CE2 3.63Å; R83-F120 HydrophobicContact CG-CZ 3.6Å
84	I	96.1	Very high	95.2	Very high	85 Å²	85	44.1 Å²	44.1	44%	0.436	24%	0.243	S	C	.	.	H	α-helix	trans	-59.7	-50.6	175.9	-66.9	166.3	0	0	0	109.7	T80 D81 G86 C87 E88	T80-I84 HydrophobicContact CG2-CD1 4.06Å; T80-I84 WeakPolarHBondContact O-CG1 3.4Å; T80-I84 PolarHBondContact O-N 3.25Å; D81-I84 PolarHBondContact O-N 3.13Å; I84-G86 VanDerWaalsContact C-N 3.31Å; I84-G86 PolarHBondContact O-N 3Å; I84-C87 WeakPolarHBondContact O-CB 3.4Å; I84-C87 PolarHBondContact O-N 3.49Å; I84-E88 HydrophobicContact CG2-CG 4.39Å; I84-E88 WeakPolarHBondContact O-CG 3.29Å; I84-E88 PolarHBondContact O-N 3.39Å
85	L	95.2	Very high	95.5	Very high	39 Å²	39	47.6 Å²	47.6	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-40.9	-179.8	-178.7	64.1	0	0	0	112.7	D81 E88 L89 F125	D81-L85 WeakPolarHBondContact O-CB 3.36Å; D81-L85 PolarHBondContact O-N 2.9Å; L85-E88 PolarHBondContact O-N 2.9Å; L85-L89 WeakPolarHBondContact O-CB 3.48Å; L85-L89 PolarHBondContact O-N 3.45Å; L85-F125 HydrophobicContact CD2-CE1 4.31Å; L85-F125 HydrophobicContact CD2-CE2 3.9Å; L85-F125 HydrophobicContact CD2-CZ 3.6Å; L85-F125 HydrophobicContact CG-CE2 3.99Å; L85-F125 HydrophobicContact CG-CZ 4.2Å
86	G	96.4	Very high	95.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-44.7	173.9	0	0	0	0	0	112.4	L82 R83 I84 L89 I90	L82-G86 PolarHBondContact O-N 3.09Å; R83-G86 PolarHBondContact O-N 3.46Å; I84-G86 VanDerWaalsContact C-N 3.31Å; I84-G86 PolarHBondContact O-N 3Å; G86-L89 PolarHBondContact O-N 3.32Å; G86-I90 VanDerWaalsContact O-CG1 3.29Å; G86-I90 WeakPolarHBondContact O-CG1 3.22Å; G86-I90 PolarHBondContact O-N 2.88Å
87	C	97	Very high	96.1	Very high	18 Å²	18	43.8 Å²	43.8	12%	0.122	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-38.8	176.8	-75.7	0	0	0	0	113	R83 I84 L89 I90 Q91 Q108 H112	R83-C87 PolarHBondContact O-N 3.2Å; I84-C87 WeakPolarHBondContact O-CB 3.4Å; I84-C87 PolarHBondContact O-N 3.49Å; C87-L89 VanDerWaalsContact C-N 3.34Å; C87-I90 PolarHBondContact O-N 3.48Å; C87-Q91 WeakPolarHBondContact O-CB 3.34Å; C87-Q91 PolarHBondContact O-N 3.23Å; C87-Q108 HydrophobicContact CB-CG 4.32Å; C87-Q108 PolarHBondContact O-NE2 3.07Å; C87-H112 PolarHBondContact SG-NE2 3.42Å; C87-H112 VanDerWaalsContact SG-NE2 3.36Å
88	E	96.4	Very high	96.2	Very high	119 Å²	119	50.2 Å²	50.2	56%	0.556	25%	0.254	S	S	*	.	H	α-helix	trans	-62	-42.8	173.6	-72.1	-179.1	164.9	0	0	111.5	I84 L85 Q91 A92	I84-E88 HydrophobicContact CG2-CG 4.39Å; I84-E88 WeakPolarHBondContact O-CG 3.29Å; I84-E88 PolarHBondContact O-N 3.39Å; L85-E88 PolarHBondContact O-N 2.9Å; E88-Q91 PolarHBondContact O-N 2.89Å; E88-A92 WeakPolarHBondContact O-CB 3.21Å; E88-A92 PolarHBondContact O-N 3.48Å
89	L	96	Very high	96.4	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-42	178.3	-171.5	65	0	0	0	111.7	L85 G86 C87 A93 F125 E126 A129 F153 L156	L85-L89 WeakPolarHBondContact O-CB 3.48Å; L85-L89 PolarHBondContact O-N 3.45Å; G86-L89 PolarHBondContact O-N 3.32Å; C87-L89 VanDerWaalsContact C-N 3.34Å; L89-A93 WeakPolarHBondContact O-CB 3.36Å; L89-A93 PolarHBondContact O-N 3.48Å; L89-F125 HydrophobicContact CD2-CE2 4.06Å; L89-E126 HydrophobicContact CD2-CB 4.48Å; L89-E126 HydrophobicContact CD2-CG 4.21Å; L89-A129 HydrophobicContact CD2-CB 4.31Å; L89-F153 HydrophobicContact CD1-CD1 4.23Å; L89-F153 HydrophobicContact CD1-CE1 4.29Å; L89-F153 HydrophobicContact CD2-CD1 3.73Å; L89-F153 HydrophobicContact CD2-CE1 3.44Å; L89-F153 VanDerWaalsContact CD2-CE1 3.44Å; L89-F153 HydrophobicContact CG-CD1 3.9Å; L89-F153 HydrophobicContact CG-CE1 3.49Å; L89-F153 VanDerWaalsContact CG-CE1 3.49Å; L89-F153 HydrophobicContact CG-CZ 4.3Å; L89-L156 HydrophobicContact CD1-CB 3.96Å; L89-L156 HydrophobicContact CD1-CD1 3.92Å
90	I	97.4	Very high	96.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-45.8	174.2	-71.9	171.8	0	0	0	110.5	G86 C87 A93 G94 Q108 F111 A129 C132 I133	G86-I90 VanDerWaalsContact O-CG1 3.29Å; G86-I90 WeakPolarHBondContact O-CG1 3.22Å; G86-I90 PolarHBondContact O-N 2.88Å; C87-I90 PolarHBondContact O-N 3.48Å; I90-A93 PolarHBondContact O-N 3.3Å; I90-G94 PolarHBondContact O-N 3.27Å; I90-Q108 HydrophobicContact CB-CG 4.45Å; I90-Q108 HydrophobicContact CG2-CG 3.87Å; I90-F111 HydrophobicContact CD1-CB 3.57Å; I90-F111 HydrophobicContact CD1-CD2 3.85Å; I90-F111 HydrophobicContact CD1-CG 3.76Å; I90-A129 HydrophobicContact CD1-CB 4.26Å; I90-A129 HydrophobicContact CG1-CB 3.85Å; I90-C132 HydrophobicContact CD1-CB 4.47Å; I90-I133 HydrophobicContact CB-CD1 4.37Å; I90-I133 HydrophobicContact CB-CG1 4.47Å; I90-I133 HydrophobicContact CG1-CG1 4.3Å; I90-I133 HydrophobicContact CG2-CD1 3.61Å; I90-I133 HydrophobicContact CG2-CG1 4.12Å
91	Q	97.3	Very high	96.7	Very high	52 Å²	52	53.5 Å²	53.5	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-49.4	178.7	-175.5	66.6	27.9	0	0	111.3	C87 E88 A93 G94 I95	C87-Q91 WeakPolarHBondContact O-CB 3.34Å; C87-Q91 PolarHBondContact O-N 3.23Å; E88-Q91 PolarHBondContact O-N 2.89Å; Q91-A93 PolarHBondContact O-N 3.36Å; Q91-G94 PolarHBondContact O-N 2.97Å; Q91-I95 HydrophobicContact CG-CD1 4.22Å; Q91-I95 WeakPolarHBondContact O-CG1 3.28Å; Q91-I95 PolarHBondContact O-N 3.41Å
92	A	97.1	Very high	96.8	Very high	34 Å²	34	52.8 Å²	52.8	28%	0.281	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-42.9	179.3	0	0	0	0	0	111.8	E88 I95 L96 L156	E88-A92 WeakPolarHBondContact O-CB 3.21Å; E88-A92 PolarHBondContact O-N 3.48Å; A92-I95 PolarHBondContact O-N 2.87Å; A92-L96 WeakPolarHBondContact O-CG 3.46Å; A92-L96 PolarHBondContact O-N 3.46Å; A92-L96 VanDerWaalsContact O-N 3.13Å; A92-L156 HydrophobicContact CB-CD1 4Å; A92-L156 HydrophobicContact CB-CD2 3.84Å
93	A	97.4	Very high	96.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-41.7	175.9	0	0	0	0	0	112	L89 I90 Q91 I95 L96 L97 V152 F153 L156	L89-A93 WeakPolarHBondContact O-CB 3.36Å; L89-A93 PolarHBondContact O-N 3.48Å; I90-A93 PolarHBondContact O-N 3.3Å; Q91-A93 PolarHBondContact O-N 3.36Å; A93-I95 PolarHBondContact O-N 3.4Å; A93-L96 PolarHBondContact O-N 3.31Å; A93-L97 WeakPolarHBondContact O-CB 3.48Å; A93-L97 VanDerWaalsContact O-CG 3.26Å; A93-L97 WeakPolarHBondContact O-CG 3.45Å; A93-L97 PolarHBondContact O-N 3Å; A93-V152 HydrophobicContact CB-CG1 3.86Å; A93-F153 HydrophobicContact CB-CD2 3.88Å; A93-F153 HydrophobicContact CB-CE2 3.33Å; A93-F153 HydrophobicContact CB-CZ 3.84Å; A93-L156 HydrophobicContact CB-CD1 3.88Å
94	G	97.6	Very high	96.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-41.1	177.7	0	0	0	0	0	113	I90 Q91 L97 R98 L99	I90-G94 PolarHBondContact O-N 3.27Å; Q91-G94 PolarHBondContact O-N 2.97Å; G94-L97 CarbonylContact O-C 3.52Å; G94-L97 PolarHBondContact O-N 3.45Å; G94-R98 PolarHBondContact O-N 2.89Å; G94-L99 PolarHBondContact O-N 2.89Å
95	I	97.3	Very high	97	Very high	105 Å²	105	48.1 Å²	48.1	54%	0.538	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-49.3	174.4	-66.9	165.9	0	0	0	110.8	Q91 A92 A93 L97 R98 M104	Q91-I95 HydrophobicContact CG-CD1 4.22Å; Q91-I95 WeakPolarHBondContact O-CG1 3.28Å; Q91-I95 PolarHBondContact O-N 3.41Å; A92-I95 PolarHBondContact O-N 2.87Å; A93-I95 PolarHBondContact O-N 3.4Å; I95-L97 VanDerWaalsContact C-N 3.29Å; I95-L97 PolarHBondContact O-N 2.95Å; I95-R98 PolarHBondContact O-N 2.99Å; I95-M104 HydrophobicContact CG1-SD 4.35Å
96	L	96.9	Very high	97.1	Very high	87 Å²	87	47.8 Å²	47.8	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-64	-33.5	-179.6	-71.4	176.1	0	0	0	112.8	A92 A93 R98 V152 L156	A92-L96 WeakPolarHBondContact O-CG 3.46Å; A92-L96 PolarHBondContact O-N 3.46Å; A92-L96 VanDerWaalsContact O-N 3.13Å; A93-L96 PolarHBondContact O-N 3.31Å; L96-R98 VanDerWaalsContact C-N 3.29Å; L96-V152 HydrophobicContact CB-CG1 3.77Å; L96-V152 HydrophobicContact CB-CG2 4.07Å; L96-V152 HydrophobicContact CD1-CG1 3.83Å; L96-V152 HydrophobicContact CG-CG1 4.45Å; L96-L156 HydrophobicContact CD1-CD1 4.27Å; L96-L156 HydrophobicContact CD1-CD2 3.72Å; L96-L156 HydrophobicContact CD1-CG 3.93Å
97	L	97.3	Very high	97.2	Very high	13 Å²	13	47.8 Å²	47.8	7%	0.068	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.3	174.7	-67.7	168.4	0	0	0	113.4	A93 G94 I95 L99 I133 R144 D148 V149 V152	A93-L97 WeakPolarHBondContact O-CB 3.48Å; A93-L97 VanDerWaalsContact O-CG 3.26Å; A93-L97 WeakPolarHBondContact O-CG 3.45Å; A93-L97 PolarHBondContact O-N 3Å; G94-L97 CarbonylContact O-C 3.52Å; G94-L97 PolarHBondContact O-N 3.45Å; I95-L97 VanDerWaalsContact C-N 3.29Å; I95-L97 PolarHBondContact O-N 2.95Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 HydrophobicContact CB-CD1 4.42Å; L97-L99 HydrophobicContact CB-CG 4.09Å; L97-L99 HydrophobicContact CD1-CD1 4.43Å; L97-L99 PolarHBondContact O-N 3Å; L97-I133 HydrophobicContact CD1-CG2 3.76Å; L97-R144 HydrophobicContact CB-CG 4.45Å; L97-R144 PolarHBondContact O-NE 3.26Å; L97-R144 PolarHBondContact O-NH2 3.45Å; L97-D148 HydrophobicContact CD2-CB 3.97Å; L97-V149 HydrophobicContact CD1-CB 4.43Å; L97-V149 HydrophobicContact CD1-CG2 3.94Å; L97-V152 HydrophobicContact CD2-CB 4.36Å; L97-V152 HydrophobicContact CD2-CG2 3.74Å; L97-V152 HydrophobicContact CG-CB 4.36Å; L97-V152 HydrophobicContact CG-CG1 4.36Å; L97-V152 HydrophobicContact CG-CG2 4Å
98	R	96.9	Very high	97.2	Very high	214 Å²	214	49.4 Å²	49.4	81%	0.808	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	44.9	-175.2	-56	-179.4	175.9	-178.9	-2.3	112.6	G94 I95 L96 R144	G94-R98 PolarHBondContact O-N 2.89Å; I95-R98 PolarHBondContact O-N 2.99Å; L96-R98 VanDerWaalsContact C-N 3.29Å; R98-R144 PolarHBondContact O-NH2 3.45Å
99	L	97	Very high	97.2	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.068	26%	0.255	C	S	.	.			trans	-77.7	149.3	174.8	-71.4	176.5	0	0	0	110.9	G94 L97 A103 M104 I133 R144	G94-L99 PolarHBondContact O-N 2.89Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 HydrophobicContact CB-CD1 4.42Å; L97-L99 HydrophobicContact CB-CG 4.09Å; L97-L99 HydrophobicContact CD1-CD1 4.43Å; L97-L99 PolarHBondContact O-N 3Å; L99-A103 HydrophobicContact CB-CB 4.35Å; L99-M104 HydrophobicContact CB-CG 4.3Å; L99-I133 HydrophobicContact CD1-CD1 4.11Å; L99-I133 HydrophobicContact CD1-CG2 3.92Å; L99-R144 HydrophobicContact CD2-CG 3.77Å; L99-R144 HydrophobicContact CG-CG 4.5Å
100	P	97.3	Very high	97.2	Very high	56 Å²	56	50 Å²	50	36%	0.364	26%	0.263	S	S	.	.			trans	-64.7	152.6	172.7	27.8	-33.1	0	0	0	110.9	V102 A103 M104 A142	P100-V102 PolarHBondContact O-N 2.85Å; P100-A103 HydrophobicContact CG-CB 3.79Å; P100-A103 WeakPolarHBondContact O-CB 3.4Å; P100-A103 PolarHBondContact O-N 3.33Å; P100-M104 PolarHBondContact O-N 3.06Å; P100-A142 HydrophobicContact CG-CB 4.27Å
101	Q	97	Very high	97.1	Very high	112 Å²	112	50 Å²	50	52%	0.523	26%	0.263	S	S	.	.	H	α-helix	trans	-57.4	-34.7	-179.7	-175.6	60.6	58.8	0	0	112.7	A103 M104 A105	Q101-A103 VanDerWaalsContact C-N 3.35Å; Q101-A103 PolarHBondContact O-N 3.41Å; Q101-M104 HydrophobicContact CB-CE 4.25Å; Q101-M104 PolarHBondContact O-N 3.44Å; Q101-M104 VanDerWaalsContact OE1-CE 3.23Å; Q101-A105 PolarHBondContact O-N 3Å
102	V	97.5	Very high	97	Very high	87 Å²	87	50.4 Å²	50.4	53%	0.527	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.8	-171.2	0	0	0	0	110.6	P100 M104 A105 T106 E140	P100-V102 PolarHBondContact O-N 2.85Å; V102-M104 VanDerWaalsContact C-N 3.35Å; V102-M104 PolarHBondContact O-N 2.94Å; V102-A105 PolarHBondContact O-N 2.94Å; V102-T106 WeakPolarHBondContact O-CB 3.27Å; V102-T106 PolarHBondContact O-N 3.34Å; V102-T106 PolarHBondContact O-OG1 3.34Å; V102-T106 VanDerWaalsContact O-OG1 3.05Å; V102-E140 HydrophobicContact CG1-CG 4.4Å; V102-E140 WeakPolarHBondContact CG1-OE2 3.48Å
103	A	97.3	Very high	96.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.5	-35.9	176.8	0	0	0	0	0	113.1	L99 P100 Q101 G107 A136 E140	L99-A103 HydrophobicContact CB-CB 4.35Å; P100-A103 HydrophobicContact CG-CB 3.79Å; P100-A103 WeakPolarHBondContact O-CB 3.4Å; P100-A103 PolarHBondContact O-N 3.33Å; Q101-A103 VanDerWaalsContact C-N 3.35Å; Q101-A103 PolarHBondContact O-N 3.41Å; A103-G107 PolarHBondContact O-N 3.42Å; A103-A136 VanDerWaalsContact O-CB 3.31Å; A103-A136 WeakPolarHBondContact O-CB 3.33Å; A103-E140 HydrophobicContact CB-CB 3.93Å; A103-E140 HydrophobicContact CB-CG 3.74Å
104	M	97.5	Very high	96.5	Very high	10 Å²	10	57.3 Å²	57.3	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-43.8	174.7	-64.2	-172.7	-69.6	0	0	111.1	I95 L99 P100 Q101 V102 G107 Q108	I95-M104 HydrophobicContact CG1-SD 4.35Å; L99-M104 HydrophobicContact CB-CG 4.3Å; P100-M104 PolarHBondContact O-N 3.06Å; Q101-M104 HydrophobicContact CB-CE 4.25Å; Q101-M104 PolarHBondContact O-N 3.44Å; Q101-M104 VanDerWaalsContact OE1-CE 3.23Å; V102-M104 VanDerWaalsContact C-N 3.35Å; V102-M104 PolarHBondContact O-N 2.94Å; M104-G107 PolarHBondContact O-N 3.36Å; M104-Q108 WeakPolarHBondContact O-CG 3.36Å; M104-Q108 PolarHBondContact O-N 3.06Å
105	A	97.7	Very high	96.3	Very high	41 Å²	41	57.3 Å²	57.3	34%	0.339	29%	0.286	S	S	.	.	H	α-helix	trans	-62.4	-46.8	175.5	0	0	0	0	0	111.8	Q101 V102 G107 Q108 V109	Q101-A105 PolarHBondContact O-N 3Å; V102-A105 PolarHBondContact O-N 2.94Å; A105-G107 VanDerWaalsContact C-N 3.27Å; A105-G107 PolarHBondContact O-N 3.35Å; A105-Q108 PolarHBondContact O-N 2.79Å; A105-Q108 VanDerWaalsContact O-N 3.12Å; A105-V109 WeakPolarHBondContact O-CG2 3.49Å; A105-V109 PolarHBondContact O-N 3.36Å
106	T	97.5	Very high	96	Very high	32 Å²	32	55.2 Å²	55.2	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-57.2	-42.1	174.4	-61.1	0	0	0	0	110.9	V102 Q108 V109 L110 A136 I139 E140	V102-T106 WeakPolarHBondContact O-CB 3.27Å; V102-T106 PolarHBondContact O-N 3.34Å; V102-T106 PolarHBondContact O-OG1 3.34Å; V102-T106 VanDerWaalsContact O-OG1 3.05Å; T106-Q108 PolarHBondContact O-N 2.82Å; T106-V109 PolarHBondContact O-N 2.97Å; T106-L110 HydrophobicContact CG2-CD1 4.26Å; T106-L110 VanDerWaalsContact O-CG 3.28Å; T106-L110 WeakPolarHBondContact O-CG 3.2Å; T106-L110 PolarHBondContact O-N 3.43Å; T106-A136 HydrophobicContact CG2-CB 4.09Å; T106-I139 HydrophobicContact CG2-CD1 4.17Å; T106-I139 HydrophobicContact CG2-CG2 4.22Å; T106-E140 PolarHBondContact OG1-OE1 3.45Å
107	G	97.7	Very high	95.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-43.5	174.4	0	0	0	0	0	113.5	A103 M104 A105 L110 F111	A103-G107 PolarHBondContact O-N 3.42Å; M104-G107 PolarHBondContact O-N 3.36Å; A105-G107 VanDerWaalsContact C-N 3.27Å; A105-G107 PolarHBondContact O-N 3.35Å; G107-L110 PolarHBondContact O-N 3.47Å; G107-F111 WeakPolarHBondContact O-CB 3.37Å; G107-F111 PolarHBondContact O-N 3.37Å
108	Q	97.1	Very high	95.3	Very high	52 Å²	52	59 Å²	59	24%	0.243	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-43.2	176.9	-69.6	178.2	-28.2	0	0	111.9	C87 I90 M104 A105 T106 L110 F111 H112	C87-Q108 HydrophobicContact CB-CG 4.32Å; C87-Q108 PolarHBondContact O-NE2 3.07Å; I90-Q108 HydrophobicContact CB-CG 4.45Å; I90-Q108 HydrophobicContact CG2-CG 3.87Å; M104-Q108 WeakPolarHBondContact O-CG 3.36Å; M104-Q108 PolarHBondContact O-N 3.06Å; A105-Q108 PolarHBondContact O-N 2.79Å; A105-Q108 VanDerWaalsContact O-N 3.12Å; T106-Q108 PolarHBondContact O-N 2.82Å; Q108-L110 PolarHBondContact O-N 3.49Å; Q108-F111 WeakPolarHBondContact O-CB 3.48Å; Q108-F111 PolarHBondContact O-N 3.24Å; Q108-H112 PolarHBondContact O-CD2 3.22Å; Q108-H112 VanDerWaalsContact O-CD2 3.24Å; Q108-H112 PolarHBondContact O-N 2.97Å
109	V	95.7	Very high	95.1	Very high	99 Å²	99	49 Å²	49	60%	0.6	26%	0.256	S	S	*	.	H	α-helix	trans	-60.9	-45.1	176.3	174.2	0	0	0	0	111	A105 T106 F111 H112 R113	A105-V109 WeakPolarHBondContact O-CG2 3.49Å; A105-V109 PolarHBondContact O-N 3.36Å; T106-V109 PolarHBondContact O-N 2.97Å; V109-F111 VanDerWaalsContact C-N 3.31Å; V109-F111 PolarHBondContact O-N 3.47Å; V109-H112 PolarHBondContact O-N 3.35Å; V109-R113 WeakPolarHBondContact O-CB 3.24Å; V109-R113 PolarHBondContact O-N 3.27Å
110	L	96.1	Very high	94.9	Very high	42 Å²	42	49.1 Å²	49.1	22%	0.22	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-42	176	-71.7	170.8	0	0	0	112	T106 G107 Q108 R113 F114 C132 L135 A136 I139	T106-L110 HydrophobicContact CG2-CD1 4.26Å; T106-L110 VanDerWaalsContact O-CG 3.28Å; T106-L110 WeakPolarHBondContact O-CG 3.2Å; T106-L110 PolarHBondContact O-N 3.43Å; G107-L110 PolarHBondContact O-N 3.47Å; Q108-L110 PolarHBondContact O-N 3.49Å; L110-R113 PolarHBondContact O-N 3.01Å; L110-F114 WeakPolarHBondContact O-CB 3.44Å; L110-F114 PolarHBondContact O-N 3.22Å; L110-C132 HydrophobicContact CB-CB 4.31Å; L110-L135 HydrophobicContact CD1-CB 4.27Å; L110-L135 HydrophobicContact CD1-CD2 3.9Å; L110-L135 HydrophobicContact CD1-CG 3.97Å; L110-L135 HydrophobicContact CD2-CD2 4.26Å; L110-A136 HydrophobicContact CD1-CB 4.24Å; L110-I139 HydrophobicContact CD1-CD1 4.02Å
111	F	96.5	Very high	94.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-47.9	179.1	-177.8	-91.6	0	0	0	112	I90 G107 Q108 V109 R113 F114 F115 F120 F125 V128 A129	I90-F111 HydrophobicContact CD1-CB 3.57Å; I90-F111 HydrophobicContact CD1-CD2 3.85Å; I90-F111 HydrophobicContact CD1-CG 3.76Å; G107-F111 WeakPolarHBondContact O-CB 3.37Å; G107-F111 PolarHBondContact O-N 3.37Å; Q108-F111 WeakPolarHBondContact O-CB 3.48Å; Q108-F111 PolarHBondContact O-N 3.24Å; V109-F111 VanDerWaalsContact C-N 3.31Å; V109-F111 PolarHBondContact O-N 3.47Å; F111-R113 VanDerWaalsContact C-N 3.35Å; F111-R113 PolarHBondContact O-N 3Å; F111-F114 PolarHBondContact O-N 3.12Å; F111-F115 HydrophobicContact CD1-CD2 4.16Å; F111-F115 HydrophobicContact CD2-CD2 4.16Å; F111-F115 AromaticContact CD2-CE2 3.92Å; F111-F115 HydrophobicContact CD2-CE2 3.92Å; F111-F115 AromaticContact CE1-CD2 3.81Å; F111-F115 HydrophobicContact CE1-CD2 3.81Å; F111-F115 HydrophobicContact CE1-CE2 4.12Å; F111-F115 AromaticContact CE2-CD2 3.86Å; F111-F115 HydrophobicContact CE2-CD2 3.86Å; F111-F115 AromaticContact CE2-CE2 3.37Å; F111-F115 HydrophobicContact CE2-CE2 3.37Å; F111-F115 HydrophobicContact CE2-CZ 4.48Å; F111-F115 HydrophobicContact CG-CD2 4.32Å; F111-F115 AromaticContact CZ-CD2 3.65Å; F111-F115 HydrophobicContact CZ-CD2 3.65Å; F111-F115 AromaticContact CZ-CE2 3.46Å; F111-F115 HydrophobicContact CZ-CE2 3.46Å; F111-F115 VanDerWaalsContact CZ-CE2 3.46Å; F111-F115 WeakPolarHBondContact O-CD2 3.44Å; F111-F115 PolarHBondContact O-N 3.47Å; F111-F115 VanDerWaalsContact O-N 3.15Å; F111-F120 HydrophobicContact CE1-CE1 4.28Å; F111-F120 HydrophobicContact CE1-CZ 4.1Å; F111-F120 AromaticContact CZ-CE1 3.91Å; F111-F120 HydrophobicContact CZ-CE1 3.91Å; F111-F120 HydrophobicContact CZ-CZ 4.2Å; F111-F125 HydrophobicContact CE2-CB 4.27Å; F111-F125 HydrophobicContact CZ-CB 4.11Å; F111-V128 HydrophobicContact CD2-CG1 4.02Å; F111-V128 HydrophobicContact CE2-CG1 4.35Å; F111-A129 HydrophobicContact CD2-CB 4.21Å; F111-A129 HydrophobicContact CE2-CB 4.07Å
112	H	93.8	Very high	94.5	Very high	62 Å²	62	52 Å²	52	29%	0.287	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-46.7	174.9	-81.3	-73.4	0	0	0	111.5	C87 Q108 V109 F114 F115 Y116	C87-H112 PolarHBondContact SG-NE2 3.42Å; C87-H112 VanDerWaalsContact SG-NE2 3.36Å; Q108-H112 PolarHBondContact O-CD2 3.22Å; Q108-H112 VanDerWaalsContact O-CD2 3.24Å; Q108-H112 PolarHBondContact O-N 2.97Å; V109-H112 PolarHBondContact O-N 3.35Å; H112-F114 VanDerWaalsContact C-N 3.27Å; H112-F114 PolarHBondContact O-N 3.46Å; H112-F115 PolarHBondContact O-N 3.03Å; H112-Y116 HydrophobicContact CB-CD2 4.45Å; H112-Y116 HydrophobicContact CB-CE2 4.43Å; H112-Y116 WeakPolarHBondContact O-CD2 3.47Å; H112-Y116 PolarHBondContact O-N 2.99Å
113	R	92.1	Very high	94.3	Very high	113 Å²	113	51 Å²	51	43%	0.426	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-39.1	-179.6	-168.9	174.6	-175.6	-173	2.6	112.2	H56 V109 L110 F111 S117	H56-R113 PolarHBondContact O-NH2 3.33Å; V109-R113 WeakPolarHBondContact O-CB 3.24Å; V109-R113 PolarHBondContact O-N 3.27Å; L110-R113 PolarHBondContact O-N 3.01Å; F111-R113 VanDerWaalsContact C-N 3.35Å; F111-R113 PolarHBondContact O-N 3Å; R113-S117 PolarHBondContact O-N 2.97Å; R113-S117 PolarHBondContact O-OG 3.12Å; R113-S117 VanDerWaalsContact O-OG 3.07Å
114	F	93.6	Very high	94.1	Very high	66 Å²	66	53.7 Å²	53.7	29%	0.289	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-51.3	175.2	-175.6	-89.7	0	0	0	111.5	L110 F111 H112 Y116 S117 K118 H123 V128	L110-F114 WeakPolarHBondContact O-CB 3.44Å; L110-F114 PolarHBondContact O-N 3.22Å; F111-F114 PolarHBondContact O-N 3.12Å; H112-F114 VanDerWaalsContact C-N 3.27Å; H112-F114 PolarHBondContact O-N 3.46Å; F114-Y116 VanDerWaalsContact C-N 3.34Å; F114-Y116 PolarHBondContact O-N 2.91Å; F114-S117 CarbonylContact O-C 3.6Å; F114-S117 WeakPolarHBondContact O-CA 3.46Å; F114-S117 PolarHBondContact O-N 3.46Å; F114-K118 HydrophobicContact CD1-CB 4.15Å; F114-K118 HydrophobicContact CE1-CB 3.73Å; F114-K118 HydrophobicContact CE1-CG 4.12Å; F114-K118 HydrophobicContact CE2-CG 4.06Å; F114-K118 HydrophobicContact CZ-CB 3.96Å; F114-K118 HydrophobicContact CZ-CG 3.85Å; F114-K118 WeakPolarHBondContact O-CB 3.29Å; F114-K118 PolarHBondContact O-N 3.38Å; F114-H123 HydrophobicContact CE1-CB 4Å; F114-H123 AromaticContact CE1-CG 3.95Å; F114-H123 HydrophobicContact CZ-CB 4.36Å; F114-H123 AromaticContact CZ-CD2 3.78Å; F114-H123 AromaticContact CZ-CG 3.95Å; F114-V128 HydrophobicContact CB-CG1 4.21Å; F114-V128 HydrophobicContact CD1-CB 4.42Å; F114-V128 HydrophobicContact CD1-CG1 3.58Å; F114-V128 HydrophobicContact CD1-CG2 3.98Å; F114-V128 HydrophobicContact CD2-CG1 4.47Å; F114-V128 HydrophobicContact CE1-CB 4.45Å; F114-V128 HydrophobicContact CE1-CG1 4.03Å; F114-V128 HydrophobicContact CE1-CG2 3.54Å; F114-V128 HydrophobicContact CG-CG1 3.82Å; F114-V128 HydrophobicContact CZ-CG2 3.97Å
115	F	92.8	Very high	93.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-79.4	-10.1	-175.1	-76.4	-66.3	0	0	0	115.5	R83 F111 H112 S117 K118 F120 H123 F125 V128	R83-F115 PolarHBondContact NH2-O 3.06Å; F111-F115 HydrophobicContact CD1-CD2 4.16Å; F111-F115 HydrophobicContact CD2-CD2 4.16Å; F111-F115 AromaticContact CD2-CE2 3.92Å; F111-F115 HydrophobicContact CD2-CE2 3.92Å; F111-F115 AromaticContact CE1-CD2 3.81Å; F111-F115 HydrophobicContact CE1-CD2 3.81Å; F111-F115 HydrophobicContact CE1-CE2 4.12Å; F111-F115 AromaticContact CE2-CD2 3.86Å; F111-F115 HydrophobicContact CE2-CD2 3.86Å; F111-F115 AromaticContact CE2-CE2 3.37Å; F111-F115 HydrophobicContact CE2-CE2 3.37Å; F111-F115 HydrophobicContact CE2-CZ 4.48Å; F111-F115 HydrophobicContact CG-CD2 4.32Å; F111-F115 AromaticContact CZ-CD2 3.65Å; F111-F115 HydrophobicContact CZ-CD2 3.65Å; F111-F115 AromaticContact CZ-CE2 3.46Å; F111-F115 HydrophobicContact CZ-CE2 3.46Å; F111-F115 VanDerWaalsContact CZ-CE2 3.46Å; F111-F115 WeakPolarHBondContact O-CD2 3.44Å; F111-F115 PolarHBondContact O-N 3.47Å; F111-F115 VanDerWaalsContact O-N 3.15Å; H112-F115 PolarHBondContact O-N 3.03Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-K118 CarbonylContact C-O 3.32Å; F115-K118 VanDerWaalsContact CA-O 3.29Å; F115-K118 WeakPolarHBondContact CA-O 3.47Å; F115-F120 HydrophobicContact CB-CD2 4.09Å; F115-F120 HydrophobicContact CB-CE1 4.34Å; F115-F120 HydrophobicContact CB-CE2 3.45Å; F115-F120 VanDerWaalsContact CB-CE2 3.45Å; F115-F120 HydrophobicContact CB-CZ 3.6Å; F115-F120 HydrophobicContact CD1-CB 4.31Å; F115-F120 AromaticContact CD1-CD1 3.53Å; F115-F120 HydrophobicContact CD1-CD1 3.53Å; F115-F120 AromaticContact CD1-CD2 3.64Å; F115-F120 HydrophobicContact CD1-CD2 3.64Å; F115-F120 AromaticContact CD1-CE1 3.62Å; F115-F120 HydrophobicContact CD1-CE1 3.62Å; F115-F120 AromaticContact CD1-CE2 3.73Å; F115-F120 HydrophobicContact CD1-CE2 3.73Å; F115-F120 AromaticContact CD1-CG 3.54Å; F115-F120 HydrophobicContact CD1-CG 3.54Å; F115-F120 AromaticContact CD1-CZ 3.72Å; F115-F120 HydrophobicContact CD1-CZ 3.72Å; F115-F120 HydrophobicContact CD2-CD1 4.18Å; F115-F120 AromaticContact CD2-CE1 3.44Å; F115-F120 HydrophobicContact CD2-CE1 3.44Å; F115-F120 VanDerWaalsContact CD2-CE1 3.44Å; F115-F120 HydrophobicContact CD2-CE2 4.15Å; F115-F120 AromaticContact CD2-CZ 3.42Å; F115-F120 HydrophobicContact CD2-CZ 3.42Å; F115-F120 VanDerWaalsContact CD2-CZ 3.42Å; F115-F120 HydrophobicContact CE1-CB 4.27Å; F115-F120 AromaticContact CE1-CD1 3.37Å; F115-F120 HydrophobicContact CE1-CD1 3.37Å; F115-F120 HydrophobicContact CE1-CD2 4.3Å; F115-F120 AromaticContact CE1-CE1 3.69Å; F115-F120 HydrophobicContact CE1-CE1 3.69Å; F115-F120 AromaticContact CE1-CG 3.72Å; F115-F120 HydrophobicContact CE1-CG 3.72Å; F115-F120 HydrophobicContact CE1-CZ 4.27Å; F115-F120 HydrophobicContact CE2-CD1 4.03Å; F115-F120 AromaticContact CE2-CE1 3.49Å; F115-F120 HydrophobicContact CE2-CE1 3.49Å; F115-F120 VanDerWaalsContact CE2-CE1 3.49Å; F115-F120 AromaticContact CE2-CZ 4Å; F115-F120 HydrophobicContact CE2-CZ 4Å; F115-F120 AromaticContact CG-CD1 3.95Å; F115-F120 HydrophobicContact CG-CD1 3.95Å; F115-F120 AromaticContact CG-CD2 3.93Å; F115-F120 HydrophobicContact CG-CD2 3.93Å; F115-F120 AromaticContact CG-CE1 3.51Å; F115-F120 HydrophobicContact CG-CE1 3.51Å; F115-F120 AromaticContact CG-CE2 3.5Å; F115-F120 HydrophobicContact CG-CE2 3.5Å; F115-F120 VanDerWaalsContact CG-CE2 3.5Å; F115-F120 HydrophobicContact CG-CG 4.14Å; F115-F120 AromaticContact CG-CZ 3.27Å; F115-F120 HydrophobicContact CG-CZ 3.27Å; F115-F120 AromaticContact CZ-CD1 3.63Å; F115-F120 HydrophobicContact CZ-CD1 3.63Å; F115-F120 AromaticContact CZ-CE1 3.61Å; F115-F120 HydrophobicContact CZ-CE1 3.61Å; F115-F120 HydrophobicContact CZ-CG 4.42Å; F115-F120 HydrophobicContact CZ-CZ 4.38Å; F115-H123 HydrophobicContact CE1-CB 4.25Å; F115-F125 HydrophobicContact CE2-CB 4.27Å; F115-F125 HydrophobicContact CZ-CB 4.09Å; F115-V128 HydrophobicContact CD2-CG1 4.43Å; F115-V128 HydrophobicContact CE2-CB 3.86Å; F115-V128 HydrophobicContact CE2-CG1 3.66Å; F115-V128 HydrophobicContact CE2-CG2 4.2Å; F115-V128 HydrophobicContact CZ-CB 3.95Å; F115-V128 HydrophobicContact CZ-CG1 4.13Å; F115-V128 HydrophobicContact CZ-CG2 3.8Å
116	Y	90.2	Very high	93.8	Very high	61 Å²	61	54.9 Å²	54.9	24%	0.239	28%	0.275	C	S	.	.	H	α-helix	trans	-79.8	-17.4	162.1	-79.7	-66.4	0	0	0	113.2	I59 L64 T67 P68 H112 F114	I59-Y116 VanDerWaalsContact CD1-CB 3.41Å; I59-Y116 HydrophobicContact CD1-CD2 3.53Å; I59-Y116 HydrophobicContact CD1-CG 3.67Å; L64-Y116 HydrophobicContact CD2-CD1 3.76Å; L64-Y116 HydrophobicContact CD2-CE1 3.49Å; L64-Y116 VanDerWaalsContact CD2-CE1 3.49Å; L64-Y116 HydrophobicContact CD2-CE2 4.45Å; L64-Y116 HydrophobicContact CD2-CG 4.36Å; T67-Y116 HydrophobicContact CG2-CD1 4.41Å; T67-Y116 HydrophobicContact CG2-CE1 4.32Å; P68-Y116 WeakPolarHBondContact CD-O 3.41Å; P68-Y116 WeakPolarHBondContact CG-O 3.45Å; H112-Y116 HydrophobicContact CB-CD2 4.45Å; H112-Y116 HydrophobicContact CB-CE2 4.43Å; H112-Y116 WeakPolarHBondContact O-CD2 3.47Å; H112-Y116 PolarHBondContact O-N 2.99Å; F114-Y116 VanDerWaalsContact C-N 3.34Å; F114-Y116 PolarHBondContact O-N 2.91Å
117	S	88.3	Confident	93.7	Very high	76 Å²	76	58.6 Å²	58.6	53%	0.531	29%	0.292	S	S	.	.	H	α-helix	trans	-102.1	-22.2	177.5	-53.9	0	0	0	0	113	R113 F114 F115	R113-S117 PolarHBondContact O-N 2.97Å; R113-S117 PolarHBondContact O-OG 3.12Å; R113-S117 VanDerWaalsContact O-OG 3.07Å; F114-S117 CarbonylContact O-C 3.6Å; F114-S117 WeakPolarHBondContact O-CA 3.46Å; F114-S117 PolarHBondContact O-N 3.46Å; F115-S117 VanDerWaalsContact C-N 3.33Å
118	K	91.4	Very high	93.7	Very high	103 Å²	103	59.3 Å²	59.3	45%	0.448	30%	0.297	S	S	.	.	S	Bend	trans	-135.7	152.4	-174.4	-62	-66.9	-178.1	163.7	0	110.3	F114 F115	F114-K118 HydrophobicContact CD1-CB 4.15Å; F114-K118 HydrophobicContact CE1-CB 3.73Å; F114-K118 HydrophobicContact CE1-CG 4.12Å; F114-K118 HydrophobicContact CE2-CG 4.06Å; F114-K118 HydrophobicContact CZ-CB 3.96Å; F114-K118 HydrophobicContact CZ-CG 3.85Å; F114-K118 WeakPolarHBondContact O-CB 3.29Å; F114-K118 PolarHBondContact O-N 3.38Å; F115-K118 CarbonylContact C-O 3.32Å; F115-K118 VanDerWaalsContact CA-O 3.29Å; F115-K118 WeakPolarHBondContact CA-O 3.47Å
119	S	92.1	Very high	93.7	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.021	29%	0.285	C	S	.	.			trans	-83.7	140.6	-178.6	169.6	0	0	0	0	112.8	S69 D72 V121 K122 H123	S69-S119 WeakPolarHBondContact CA-OG 3.41Å; S69-S119 WeakPolarHBondContact OG-CA 3.47Å; D72-S119 WeakPolarHBondContact OD2-CB 3.33Å; D72-S119 PolarHBondContact OD2-OG 3.37Å; S119-V121 PolarHBondContact O-N 3.39Å; S119-V121 WeakPolarHBondContact OG-CB 3.47Å; S119-V121 PolarHBondContact OG-N 2.91Å; S119-K122 PolarHBondContact O-N 3.39Å; S119-H123 PolarHBondContact O-N 3.03Å; S119-H123 PolarHBondContact O-ND1 3.4Å
120	F	93.7	Very high	93.8	Very high	17 Å²	17	54.1 Å²	54.1	8%	0.075	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.4	168.3	-82	-76.6	0	0	0	113.1	S69 L74 E79 L82 R83 F111 F115 K122 H123 F125	S69-F120 WeakPolarHBondContact OG-CD2 3.14Å; S69-F120 PolarHBondContact OG-N 3.44Å; L74-F120 HydrophobicContact CD2-CB 3.95Å; E79-F120 HydrophobicContact CG-CD2 3.85Å; E79-F120 HydrophobicContact CG-CE2 3.91Å; L82-F120 HydrophobicContact CB-CD1 3.98Å; L82-F120 HydrophobicContact CB-CE1 3.89Å; L82-F120 HydrophobicContact CB-CE2 4.49Å; L82-F120 HydrophobicContact CB-CG 4.33Å; L82-F120 HydrophobicContact CB-CZ 4.15Å; L82-F120 HydrophobicContact CD1-CB 3.79Å; L82-F120 HydrophobicContact CD1-CD1 3.93Å; L82-F120 HydrophobicContact CD1-CG 3.84Å; R83-F120 HydrophobicContact CG-CE2 3.63Å; R83-F120 HydrophobicContact CG-CZ 3.6Å; F111-F120 HydrophobicContact CE1-CE1 4.28Å; F111-F120 HydrophobicContact CE1-CZ 4.1Å; F111-F120 AromaticContact CZ-CE1 3.91Å; F111-F120 HydrophobicContact CZ-CE1 3.91Å; F111-F120 HydrophobicContact CZ-CZ 4.2Å; F115-F120 HydrophobicContact CB-CD2 4.09Å; F115-F120 HydrophobicContact CB-CE1 4.34Å; F115-F120 HydrophobicContact CB-CE2 3.45Å; F115-F120 VanDerWaalsContact CB-CE2 3.45Å; F115-F120 HydrophobicContact CB-CZ 3.6Å; F115-F120 HydrophobicContact CD1-CB 4.31Å; F115-F120 AromaticContact CD1-CD1 3.53Å; F115-F120 HydrophobicContact CD1-CD1 3.53Å; F115-F120 AromaticContact CD1-CD2 3.64Å; F115-F120 HydrophobicContact CD1-CD2 3.64Å; F115-F120 AromaticContact CD1-CE1 3.62Å; F115-F120 HydrophobicContact CD1-CE1 3.62Å; F115-F120 AromaticContact CD1-CE2 3.73Å; F115-F120 HydrophobicContact CD1-CE2 3.73Å; F115-F120 AromaticContact CD1-CG 3.54Å; F115-F120 HydrophobicContact CD1-CG 3.54Å; F115-F120 AromaticContact CD1-CZ 3.72Å; F115-F120 HydrophobicContact CD1-CZ 3.72Å; F115-F120 HydrophobicContact CD2-CD1 4.18Å; F115-F120 AromaticContact CD2-CE1 3.44Å; F115-F120 HydrophobicContact CD2-CE1 3.44Å; F115-F120 VanDerWaalsContact CD2-CE1 3.44Å; F115-F120 HydrophobicContact CD2-CE2 4.15Å; F115-F120 AromaticContact CD2-CZ 3.42Å; F115-F120 HydrophobicContact CD2-CZ 3.42Å; F115-F120 VanDerWaalsContact CD2-CZ 3.42Å; F115-F120 HydrophobicContact CE1-CB 4.27Å; F115-F120 AromaticContact CE1-CD1 3.37Å; F115-F120 HydrophobicContact CE1-CD1 3.37Å; F115-F120 HydrophobicContact CE1-CD2 4.3Å; F115-F120 AromaticContact CE1-CE1 3.69Å; F115-F120 HydrophobicContact CE1-CE1 3.69Å; F115-F120 AromaticContact CE1-CG 3.72Å; F115-F120 HydrophobicContact CE1-CG 3.72Å; F115-F120 HydrophobicContact CE1-CZ 4.27Å; F115-F120 HydrophobicContact CE2-CD1 4.03Å; F115-F120 AromaticContact CE2-CE1 3.49Å; F115-F120 HydrophobicContact CE2-CE1 3.49Å; F115-F120 VanDerWaalsContact CE2-CE1 3.49Å; F115-F120 AromaticContact CE2-CZ 4Å; F115-F120 HydrophobicContact CE2-CZ 4Å; F115-F120 AromaticContact CG-CD1 3.95Å; F115-F120 HydrophobicContact CG-CD1 3.95Å; F115-F120 AromaticContact CG-CD2 3.93Å; F115-F120 HydrophobicContact CG-CD2 3.93Å; F115-F120 AromaticContact CG-CE1 3.51Å; F115-F120 HydrophobicContact CG-CE1 3.51Å; F115-F120 AromaticContact CG-CE2 3.5Å; F115-F120 HydrophobicContact CG-CE2 3.5Å; F115-F120 VanDerWaalsContact CG-CE2 3.5Å; F115-F120 HydrophobicContact CG-CG 4.14Å; F115-F120 AromaticContact CG-CZ 3.27Å; F115-F120 HydrophobicContact CG-CZ 3.27Å; F115-F120 AromaticContact CZ-CD1 3.63Å; F115-F120 HydrophobicContact CZ-CD1 3.63Å; F115-F120 AromaticContact CZ-CE1 3.61Å; F115-F120 HydrophobicContact CZ-CE1 3.61Å; F115-F120 HydrophobicContact CZ-CG 4.42Å; F115-F120 HydrophobicContact CZ-CZ 4.38Å; F120-K122 VanDerWaalsContact C-N 3.28Å; F120-K122 PolarHBondContact O-N 3.41Å; F120-H123 VanDerWaalsContact O-O 3.07Å; F120-F125 HydrophobicContact CD1-CB 4.02Å; F120-F125 HydrophobicContact CE1-CB 3.89Å
121	V	93	Very high	93.8	Very high	87 Å²	87	54.8 Å²	54.8	53%	0.527	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.4	178.8	-176.1	0	0	0	0	110.9	D72 L74 S119	D72-V121 HydrophobicContact CB-CB 4.09Å; D72-V121 HydrophobicContact CB-CG2 4.01Å; L74-V121 HydrophobicContact CB-CG2 4.06Å; S119-V121 PolarHBondContact O-N 3.39Å; S119-V121 WeakPolarHBondContact OG-CB 3.47Å; S119-V121 PolarHBondContact OG-N 2.91Å
122	K	92.6	Very high	93.9	Very high	141 Å²	141	55.3 Å²	55.3	61%	0.613	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-19	-176.3	-69.2	177.5	176.3	131.8	0	114.2	D72 S119 F120	D72-K122 IonicContact OD1-NZ 2.68Å; D72-K122 PolarHBondContact OD1-NZ 3.5Å; D72-K122 WeakPolarHBondContact OD2-CD 3.38Å; D72-K122 WeakPolarHBondContact OD2-CE 3.09Å; D72-K122 IonicContact OD2-NZ 3.27Å; D72-K122 PolarHBondContact OD2-NZ 2.83Å; S119-K122 PolarHBondContact O-N 3.39Å; F120-K122 VanDerWaalsContact C-N 3.28Å; F120-K122 PolarHBondContact O-N 3.41Å
123	H	93.9	Very high	94.1	Very high	65 Å²	65	52.3 Å²	52.3	30%	0.301	27%	0.267	S	S	.	.	S	Bend	trans	-133.8	127.2	-173.6	-56	81.2	0	0	0	111	F114 F115 S119 F120 F125 V128	F114-H123 HydrophobicContact CE1-CB 4Å; F114-H123 AromaticContact CE1-CG 3.95Å; F114-H123 HydrophobicContact CZ-CB 4.36Å; F114-H123 AromaticContact CZ-CD2 3.78Å; F114-H123 AromaticContact CZ-CG 3.95Å; F115-H123 HydrophobicContact CE1-CB 4.25Å; S119-H123 PolarHBondContact O-N 3.03Å; S119-H123 PolarHBondContact O-ND1 3.4Å; F120-H123 VanDerWaalsContact O-O 3.07Å; H123-F125 PolarHBondContact O-N 3.35Å; H123-V128 HydrophobicContact CB-CG2 4.2Å
124	S	93.7	Very high	94.3	Very high	58 Å²	58	48.6 Å²	48.6	41%	0.406	26%	0.256	S	S	.	.			trans	-63.5	117.9	174.9	174.1	0	0	0	0	110.9	E126 I127 V128	S124-E126 PolarHBondContact O-N 3.01Å; S124-I127 PolarHBondContact O-N 3.35Å; S124-I127 VanDerWaalsContact O-N 3.16Å; S124-V128 WeakPolarHBondContact O-CG2 3.27Å; S124-V128 PolarHBondContact O-N 3.45Å; S124-V128 VanDerWaalsContact O-N 3.11Å
125	F	93.5	Very high	94.5	Very high	33 Å²	33	49.4 Å²	49.4	15%	0.145	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-32.1	179.7	79.6	-86.2	0	0	0	112.5	L82 L85 L89 F111 F115 F120 H123 I127 V128 A129	L82-F125 HydrophobicContact CD2-CD1 4.34Å; L82-F125 HydrophobicContact CD2-CE1 4.49Å; L85-F125 HydrophobicContact CD2-CE1 4.31Å; L85-F125 HydrophobicContact CD2-CE2 3.9Å; L85-F125 HydrophobicContact CD2-CZ 3.6Å; L85-F125 HydrophobicContact CG-CE2 3.99Å; L85-F125 HydrophobicContact CG-CZ 4.2Å; L89-F125 HydrophobicContact CD2-CE2 4.06Å; F111-F125 HydrophobicContact CE2-CB 4.27Å; F111-F125 HydrophobicContact CZ-CB 4.11Å; F115-F125 HydrophobicContact CE2-CB 4.27Å; F115-F125 HydrophobicContact CZ-CB 4.09Å; F120-F125 HydrophobicContact CD1-CB 4.02Å; F120-F125 HydrophobicContact CE1-CB 3.89Å; H123-F125 PolarHBondContact O-N 3.35Å; F125-I127 PolarHBondContact O-N 2.98Å; F125-V128 PolarHBondContact O-N 3.47Å; F125-A129 VanDerWaalsContact O-CB 3.24Å; F125-A129 WeakPolarHBondContact O-CB 3.43Å; F125-A129 PolarHBondContact O-N 3.45Å
126	E	94.4	Very high	94.7	Very high	43 Å²	43	49.4 Å²	49.4	20%	0.201	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-43.4	177.1	-62.8	-170.6	154.6	0	0	111.3	L89 S124 A129 M130	L89-E126 HydrophobicContact CD2-CB 4.48Å; L89-E126 HydrophobicContact CD2-CG 4.21Å; S124-E126 PolarHBondContact O-N 3.01Å; E126-A129 PolarHBondContact O-N 3.15Å; E126-M130 WeakPolarHBondContact O-CE 3.46Å; E126-M130 WeakPolarHBondContact O-CG 3.34Å; E126-M130 PolarHBondContact O-N 3.15Å
127	I	96	Very high	95.1	Very high	110 Å²	110	46.5 Å²	46.5	56%	0.564	25%	0.252	S	S	*	.	H	α-helix	trans	-67.4	-44.1	179	-60.5	179.1	0	0	0	110.4	S124 F125 M130 A131	S124-I127 PolarHBondContact O-N 3.35Å; S124-I127 VanDerWaalsContact O-N 3.16Å; F125-I127 PolarHBondContact O-N 2.98Å; I127-M130 HydrophobicContact CB-CE 4.48Å; I127-M130 HydrophobicContact CG1-CE 4.17Å; I127-M130 PolarHBondContact O-N 2.96Å; I127-A131 PolarHBondContact O-N 2.86Å
128	V	97.1	Very high	95.5	Very high	15 Å²	15	48.6 Å²	48.6	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-43.4	177.3	177.2	0	0	0	0	110.5	F111 F114 F115 H123 S124 F125 M130 A131 C132	F111-V128 HydrophobicContact CD2-CG1 4.02Å; F111-V128 HydrophobicContact CE2-CG1 4.35Å; F114-V128 HydrophobicContact CB-CG1 4.21Å; F114-V128 HydrophobicContact CD1-CB 4.42Å; F114-V128 HydrophobicContact CD1-CG1 3.58Å; F114-V128 HydrophobicContact CD1-CG2 3.98Å; F114-V128 HydrophobicContact CD2-CG1 4.47Å; F114-V128 HydrophobicContact CE1-CB 4.45Å; F114-V128 HydrophobicContact CE1-CG1 4.03Å; F114-V128 HydrophobicContact CE1-CG2 3.54Å; F114-V128 HydrophobicContact CG-CG1 3.82Å; F114-V128 HydrophobicContact CZ-CG2 3.97Å; F115-V128 HydrophobicContact CD2-CG1 4.43Å; F115-V128 HydrophobicContact CE2-CB 3.86Å; F115-V128 HydrophobicContact CE2-CG1 3.66Å; F115-V128 HydrophobicContact CE2-CG2 4.2Å; F115-V128 HydrophobicContact CZ-CB 3.95Å; F115-V128 HydrophobicContact CZ-CG1 4.13Å; F115-V128 HydrophobicContact CZ-CG2 3.8Å; H123-V128 HydrophobicContact CB-CG2 4.2Å; S124-V128 WeakPolarHBondContact O-CG2 3.27Å; S124-V128 PolarHBondContact O-N 3.45Å; S124-V128 VanDerWaalsContact O-N 3.11Å; F125-V128 PolarHBondContact O-N 3.47Å; V128-M130 PolarHBondContact O-N 2.98Å; V128-A131 WeakPolarHBondContact O-CB 3.14Å; V128-A131 PolarHBondContact O-N 3.04Å; V128-A131 VanDerWaalsContact O-N 3.15Å; V128-C132 WeakPolarHBondContact O-CB 3.46Å; V128-C132 PolarHBondContact O-N 2.98Å; V128-C132 PolarHBondContact O-SG 3.46Å
129	A	97.2	Very high	95.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-42.7	176.5	0	0	0	0	0	112.7	L89 I90 F111 F125 E126 A131 C132 I133 F153	L89-A129 HydrophobicContact CD2-CB 4.31Å; I90-A129 HydrophobicContact CD1-CB 4.26Å; I90-A129 HydrophobicContact CG1-CB 3.85Å; F111-A129 HydrophobicContact CD2-CB 4.21Å; F111-A129 HydrophobicContact CE2-CB 4.07Å; F125-A129 VanDerWaalsContact O-CB 3.24Å; F125-A129 WeakPolarHBondContact O-CB 3.43Å; F125-A129 PolarHBondContact O-N 3.45Å; E126-A129 PolarHBondContact O-N 3.15Å; A129-A131 VanDerWaalsContact C-N 3.34Å; A129-A131 PolarHBondContact O-N 2.99Å; A129-C132 PolarHBondContact O-N 3.49Å; A129-I133 PolarHBondContact O-N 2.8Å; A129-F153 HydrophobicContact CB-CE1 3.7Å; A129-F153 HydrophobicContact CB-CZ 3.96Å
130	M	97.2	Very high	95.9	Very high	42 Å²	42	50.5 Å²	50.5	21%	0.207	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-45	172.4	-76.2	-175.1	-79.1	0	0	111.8	E126 I127 V128 I133 N134 V149 F153	E126-M130 WeakPolarHBondContact O-CE 3.46Å; E126-M130 WeakPolarHBondContact O-CG 3.34Å; E126-M130 PolarHBondContact O-N 3.15Å; I127-M130 HydrophobicContact CB-CE 4.48Å; I127-M130 HydrophobicContact CG1-CE 4.17Å; I127-M130 PolarHBondContact O-N 2.96Å; V128-M130 PolarHBondContact O-N 2.98Å; M130-I133 PolarHBondContact O-N 3.21Å; M130-N134 WeakPolarHBondContact O-CB 3.27Å; M130-N134 PolarHBondContact O-N 2.82Å; M130-V149 HydrophobicContact CB-CG1 4.39Å; M130-V149 HydrophobicContact CG-CG1 4.42Å; M130-F153 HydrophobicContact CB-CE1 4.46Å; M130-F153 HydrophobicContact CB-CE2 4.41Å; M130-F153 HydrophobicContact CB-CZ 4.39Å; M130-F153 HydrophobicContact CG-CB 3.77Å; M130-F153 HydrophobicContact CG-CD1 3.32Å; M130-F153 HydrophobicContact CG-CD2 3.45Å; M130-F153 VanDerWaalsContact CG-CD2 3.45Å; M130-F153 HydrophobicContact CG-CE1 3.6Å; M130-F153 HydrophobicContact CG-CE2 3.72Å; M130-F153 HydrophobicContact CG-CG 3.22Å; M130-F153 HydrophobicContact CG-CZ 3.8Å; M130-F153 HydrophobicContact SD-CB 3.63Å; M130-F153 HydrophobicContact SD-CD1 4.15Å; M130-F153 HydrophobicContact SD-CD2 4.37Å; M130-F153 HydrophobicContact SD-CG 3.82Å
131	A	97.6	Very high	96	Very high	56 Å²	56	57.6 Å²	57.6	46%	0.463	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-42.5	178.4	0	0	0	0	0	111.9	I127 V128 A129 N134 L135	I127-A131 PolarHBondContact O-N 2.86Å; V128-A131 WeakPolarHBondContact O-CB 3.14Å; V128-A131 PolarHBondContact O-N 3.04Å; V128-A131 VanDerWaalsContact O-N 3.15Å; A129-A131 VanDerWaalsContact C-N 3.34Å; A129-A131 PolarHBondContact O-N 2.99Å; A131-N134 PolarHBondContact O-N 3.15Å; A131-L135 WeakPolarHBondContact O-CB 3.5Å; A131-L135 PolarHBondContact O-N 3.41Å
132	C	97.8	Very high	96.1	Very high	10 Å²	10	54.4 Å²	54.4	7%	0.068	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-45.6	176.4	-70	0	0	0	0	111.7	I90 L110 V128 A129 L135 A136	I90-C132 HydrophobicContact CD1-CB 4.47Å; L110-C132 HydrophobicContact CB-CB 4.31Å; V128-C132 WeakPolarHBondContact O-CB 3.46Å; V128-C132 PolarHBondContact O-N 2.98Å; V128-C132 PolarHBondContact O-SG 3.46Å; A129-C132 PolarHBondContact O-N 3.49Å; C132-L135 PolarHBondContact O-N 3.2Å; C132-A136 WeakPolarHBondContact O-CB 3.48Å; C132-A136 PolarHBondContact O-N 3.34Å
133	I	97.4	Very high	96.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-46	175.3	-77.4	-70.3	0	0	0	111.3	I90 L97 L99 A129 M130 L135 A136 S137 V149 F153	I90-I133 HydrophobicContact CB-CD1 4.37Å; I90-I133 HydrophobicContact CB-CG1 4.47Å; I90-I133 HydrophobicContact CG1-CG1 4.3Å; I90-I133 HydrophobicContact CG2-CD1 3.61Å; I90-I133 HydrophobicContact CG2-CG1 4.12Å; L97-I133 HydrophobicContact CD1-CG2 3.76Å; L99-I133 HydrophobicContact CD1-CD1 4.11Å; L99-I133 HydrophobicContact CD1-CG2 3.92Å; A129-I133 PolarHBondContact O-N 2.8Å; M130-I133 PolarHBondContact O-N 3.21Å; I133-L135 VanDerWaalsContact C-N 3.32Å; I133-L135 PolarHBondContact O-N 3.41Å; I133-A136 PolarHBondContact O-N 2.94Å; I133-S137 WeakPolarHBondContact O-CB 3.25Å; I133-S137 PolarHBondContact O-N 3.21Å; I133-S137 PolarHBondContact O-OG 3.4Å; I133-V149 HydrophobicContact CG2-CG1 4.1Å; I133-V149 HydrophobicContact CG2-CG2 4.37Å; I133-F153 HydrophobicContact CG1-CE2 4.3Å; I133-F153 HydrophobicContact CG1-CZ 4.29Å
134	N	97.2	Very high	96.3	Very high	34 Å²	34	52.1 Å²	52.1	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-42.3	178.4	-177.7	55.5	0	0	0	111.4	M130 A131 S137 K138 I146	M130-N134 WeakPolarHBondContact O-CB 3.27Å; M130-N134 PolarHBondContact O-N 2.82Å; A131-N134 PolarHBondContact O-N 3.15Å; N134-S137 PolarHBondContact O-OG 2.83Å; N134-K138 WeakPolarHBondContact O-CG 3.29Å; N134-K138 PolarHBondContact O-N 3.32Å; N134-I146 HydrophobicContact CB-CD1 4.32Å
135	L	97.6	Very high	96.4	Very high	83 Å²	83	57.2 Å²	57.2	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-47.8	177.1	-179.6	57.8	0	0	0	112.2	L110 A131 C132 I133 S137 K138 I139	L110-L135 HydrophobicContact CD1-CB 4.27Å; L110-L135 HydrophobicContact CD1-CD2 3.9Å; L110-L135 HydrophobicContact CD1-CG 3.97Å; L110-L135 HydrophobicContact CD2-CD2 4.26Å; A131-L135 WeakPolarHBondContact O-CB 3.5Å; A131-L135 PolarHBondContact O-N 3.41Å; C132-L135 PolarHBondContact O-N 3.2Å; I133-L135 VanDerWaalsContact C-N 3.32Å; I133-L135 PolarHBondContact O-N 3.41Å; L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 2.73Å; L135-K138 WeakPolarHBondContact O-CB 3.47Å; L135-K138 PolarHBondContact O-N 2.96Å; L135-I139 HydrophobicContact CD1-CD1 4.24Å; L135-I139 HydrophobicContact CD1-CG1 4.39Å; L135-I139 HydrophobicContact CG-CD1 3.9Å; L135-I139 HydrophobicContact CG-CG1 4.49Å; L135-I139 WeakPolarHBondContact O-CG1 3.48Å; L135-I139 PolarHBondContact O-N 3.3Å
136	A	97.7	Very high	96.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-38.4	179	0	0	0	0	0	112.1	A103 T106 L110 C132 I133 K138 I139 E140	A103-A136 VanDerWaalsContact O-CB 3.31Å; A103-A136 WeakPolarHBondContact O-CB 3.33Å; T106-A136 HydrophobicContact CG2-CB 4.09Å; L110-A136 HydrophobicContact CD1-CB 4.24Å; C132-A136 WeakPolarHBondContact O-CB 3.48Å; C132-A136 PolarHBondContact O-N 3.34Å; I133-A136 PolarHBondContact O-N 2.94Å; A136-K138 PolarHBondContact O-N 2.95Å; A136-I139 PolarHBondContact O-N 3.1Å; A136-E140 PolarHBondContact O-N 2.99Å
137	S	97	Very high	96.6	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.007	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-29.9	174.9	79.1	0	0	0	0	113	I133 N134 L135 A142 P143	I133-S137 WeakPolarHBondContact O-CB 3.25Å; I133-S137 PolarHBondContact O-N 3.21Å; I133-S137 PolarHBondContact O-OG 3.4Å; N134-S137 PolarHBondContact O-OG 2.83Å; L135-S137 VanDerWaalsContact C-N 3.29Å; L135-S137 PolarHBondContact O-N 2.73Å; S137-A142 WeakPolarHBondContact CB-O 3.41Å; S137-A142 CarbonylContact O-C 3.47Å; S137-A142 WeakPolarHBondContact O-CA 3.31Å; S137-A142 PolarHBondContact O-N 3.18Å; S137-P143 VanDerWaalsContact O-N 3.15Å
138	K	97	Very high	96.7	Very high	119 Å²	119	63.3 Å²	63.3	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-78.6	-41.8	174.9	-66.3	174.8	-178.9	-175	0	111.7	N134 L135 A136 E140 E141	N134-K138 WeakPolarHBondContact O-CG 3.29Å; N134-K138 PolarHBondContact O-N 3.32Å; L135-K138 WeakPolarHBondContact O-CB 3.47Å; L135-K138 PolarHBondContact O-N 2.96Å; A136-K138 PolarHBondContact O-N 2.95Å; K138-E140 VanDerWaalsContact C-N 3.3Å; K138-E140 PolarHBondContact O-N 3.28Å; K138-E141 PolarHBondContact O-N 3.46Å
139	I	96.8	Very high	96.7	Very high	83 Å²	83	62.6 Å²	62.6	43%	0.426	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-41.9	179.3	-68.4	167.5	0	0	0	111.1	T106 L110 L135 A136 E141	T106-I139 HydrophobicContact CG2-CD1 4.17Å; T106-I139 HydrophobicContact CG2-CG2 4.22Å; L110-I139 HydrophobicContact CD1-CD1 4.02Å; L135-I139 HydrophobicContact CD1-CD1 4.24Å; L135-I139 HydrophobicContact CD1-CG1 4.39Å; L135-I139 HydrophobicContact CG-CD1 3.9Å; L135-I139 HydrophobicContact CG-CG1 4.49Å; L135-I139 WeakPolarHBondContact O-CG1 3.48Å; L135-I139 PolarHBondContact O-N 3.3Å; A136-I139 PolarHBondContact O-N 3.1Å; I139-E141 VanDerWaalsContact C-N 3.27Å; I139-E141 PolarHBondContact O-N 3.27Å
140	E	96.3	Very high	96.7	Very high	63 Å²	63	66.6 Å²	66.6	29%	0.294	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	20.3	-178.5	-58	-59.6	155	0	0	113.3	V102 A103 T106 A136 K138 A142	V102-E140 HydrophobicContact CG1-CG 4.4Å; V102-E140 WeakPolarHBondContact CG1-OE2 3.48Å; A103-E140 HydrophobicContact CB-CB 3.93Å; A103-E140 HydrophobicContact CB-CG 3.74Å; T106-E140 PolarHBondContact OG1-OE1 3.45Å; A136-E140 PolarHBondContact O-N 2.99Å; K138-E140 VanDerWaalsContact C-N 3.3Å; K138-E140 PolarHBondContact O-N 3.28Å; E140-A142 PolarHBondContact O-N 3.11Å
141	E	95.3	Very high	96.6	Very high	167 Å²	167	69.4 Å²	69.4	78%	0.78	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	30	176.5	-59.2	-60.5	141.3	0	0	114.1	K138 I139	K138-E141 PolarHBondContact O-N 3.46Å; I139-E141 VanDerWaalsContact C-N 3.27Å; I139-E141 PolarHBondContact O-N 3.27Å
142	A	94.4	Very high	96.6	Very high	19 Å²	19	67.7 Å²	67.7	16%	0.157	33%	0.325	C	S	.	.			trans	-126.8	55.4	179.4	0	0	0	0	0	111.3	P100 S137 E140 R144	P100-A142 HydrophobicContact CG-CB 4.27Å; S137-A142 WeakPolarHBondContact CB-O 3.41Å; S137-A142 CarbonylContact O-C 3.47Å; S137-A142 WeakPolarHBondContact O-CA 3.31Å; S137-A142 PolarHBondContact O-N 3.18Å; E140-A142 PolarHBondContact O-N 3.11Å; A142-R144 PolarHBondContact O-NH1 3.16Å
143	P	95.2	Very high	96.5	Very high	85 Å²	85	67.7 Å²	67.7	55%	0.552	32%	0.323	S	S	*	.			trans	-62.1	149.2	-170.9	26.3	-35.3	0	0	0	112.1	S137	S137-P143 VanDerWaalsContact O-N 3.15Å
144	R	95.9	Very high	96.4	Very high	73 Å²	73	72.1 Å²	72.1	28%	0.275	34%	0.344	S	S	.	.			trans	-120.2	152.9	172.3	-64	-66.8	-179.7	-84.6	-0.2	110	L97 R98 L99 A142 I146 V149	L97-R144 HydrophobicContact CB-CG 4.45Å; L97-R144 PolarHBondContact O-NE 3.26Å; L97-R144 PolarHBondContact O-NH2 3.45Å; R98-R144 PolarHBondContact O-NH2 3.45Å; L99-R144 HydrophobicContact CD2-CG 3.77Å; L99-R144 HydrophobicContact CG-CG 4.5Å; A142-R144 PolarHBondContact O-NH1 3.16Å; R144-I146 PolarHBondContact O-N 3.4Å; R144-V149 HydrophobicContact CB-CG2 4.2Å
145	R	95.6	Very high	96.3	Very high	165 Å²	165	74.6 Å²	74.6	62%	0.623	35%	0.354	S	S	*	.			trans	-67.9	134.5	174.3	-62.7	177.8	171.4	-173.4	-2	108.2	R147 D148 V149	R145-R147 PolarHBondContact O-N 2.92Å; R145-R147 VanDerWaalsContact O-N 3.12Å; R145-D148 WeakPolarHBondContact CB-OD2 3.43Å; R145-D148 WeakPolarHBondContact O-CB 3.33Å; R145-D148 PolarHBondContact O-N 2.59Å; R145-V149 PolarHBondContact O-N 2.68Å
146	I	95.6	Very high	96.2	Very high	87 Å²	87	71.5 Å²	71.5	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-56.4	-33.3	-180	-171	59.8	0	0	0	112.5	N134 R144 D148 V149 I150	N134-I146 HydrophobicContact CB-CD1 4.32Å; R144-I146 PolarHBondContact O-N 3.4Å; I146-D148 VanDerWaalsContact C-N 3.32Å; I146-D148 PolarHBondContact O-N 3.48Å; I146-V149 PolarHBondContact O-N 2.99Å; I146-I150 HydrophobicContact CG1-CD1 4.03Å; I146-I150 WeakPolarHBondContact O-CG1 3.35Å; I146-I150 PolarHBondContact O-N 3.42Å
147	R	97.2	Very high	95.9	Very high	161 Å²	161	78.6 Å²	78.6	61%	0.608	37%	0.365	S	S	*	.	H	α-helix	trans	-60.8	-40.1	174.3	-73.1	-173	-83	135.5	-9.9	112.3	R145 I150 N151	R145-R147 PolarHBondContact O-N 2.92Å; R145-R147 VanDerWaalsContact O-N 3.12Å; R147-I150 PolarHBondContact O-N 3.42Å; R147-N151 WeakPolarHBondContact O-CB 3.36Å; R147-N151 PolarHBondContact O-N 3.24Å; R147-N151 PolarHBondContact O-ND2 2.97Å
148	D	97.1	Very high	95.6	Very high	66 Å²	66	82.9 Å²	82.9	35%	0.353	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-40.9	179.6	-56.4	-18.6	0	0	0	110	L97 R145 I146 N151 V152	L97-D148 HydrophobicContact CD2-CB 3.97Å; R145-D148 WeakPolarHBondContact CB-OD2 3.43Å; R145-D148 WeakPolarHBondContact O-CB 3.33Å; R145-D148 PolarHBondContact O-N 2.59Å; I146-D148 VanDerWaalsContact C-N 3.32Å; I146-D148 PolarHBondContact O-N 3.48Å; D148-N151 PolarHBondContact O-N 2.83Å; D148-V152 WeakPolarHBondContact O-CB 3.5Å; D148-V152 WeakPolarHBondContact O-CG2 2.83Å; D148-V152 PolarHBondContact O-N 3.04Å
149	V	97.1	Very high	95.2	Very high	0 Å²	0	80.8 Å²	80.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-50.8	175.1	-177.6	0	0	0	0	110.8	L97 M130 I133 R144 R145 I146 N151 V152 F153	L97-V149 HydrophobicContact CD1-CB 4.43Å; L97-V149 HydrophobicContact CD1-CG2 3.94Å; M130-V149 HydrophobicContact CB-CG1 4.39Å; M130-V149 HydrophobicContact CG-CG1 4.42Å; I133-V149 HydrophobicContact CG2-CG1 4.1Å; I133-V149 HydrophobicContact CG2-CG2 4.37Å; R144-V149 HydrophobicContact CB-CG2 4.2Å; R145-V149 PolarHBondContact O-N 2.68Å; I146-V149 PolarHBondContact O-N 2.99Å; V149-N151 VanDerWaalsContact C-N 3.33Å; V149-N151 PolarHBondContact O-N 3.07Å; V149-V152 PolarHBondContact O-N 3.15Å; V149-F153 HydrophobicContact CG1-CD2 4Å; V149-F153 HydrophobicContact CG1-CE2 4.03Å; V149-F153 WeakPolarHBondContact O-CD2 3.24Å; V149-F153 PolarHBondContact O-N 2.84Å
150	I	96.7	Very high	94.6	Very high	84 Å²	84	81.2 Å²	81.2	43%	0.431	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-44.9	179.4	-67.2	165.7	0	0	0	110.8	I146 R147 V152 F153 H154	I146-I150 HydrophobicContact CG1-CD1 4.03Å; I146-I150 WeakPolarHBondContact O-CG1 3.35Å; I146-I150 PolarHBondContact O-N 3.42Å; R147-I150 PolarHBondContact O-N 3.42Å; I150-V152 VanDerWaalsContact C-N 3.34Å; I150-V152 PolarHBondContact O-N 3.42Å; I150-F153 PolarHBondContact O-N 2.91Å; I150-H154 VanDerWaalsContact O-CB 3.27Å; I150-H154 WeakPolarHBondContact O-CB 3.5Å; I150-H154 PolarHBondContact O-N 3.15Å
151	N	97.1	Very high	93.7	Very high	101 Å²	101	80 Å²	80	54%	0.54	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-42.1	179.6	-73	-15.2	0	0	0	112	R147 D148 V149 H154 H155	R147-N151 WeakPolarHBondContact O-CB 3.36Å; R147-N151 PolarHBondContact O-N 3.24Å; R147-N151 PolarHBondContact O-ND2 2.97Å; D148-N151 PolarHBondContact O-N 2.83Å; V149-N151 VanDerWaalsContact C-N 3.33Å; V149-N151 PolarHBondContact O-N 3.07Å; N151-H154 PolarHBondContact O-N 3.3Å; N151-H155 WeakPolarHBondContact O-CB 3.43Å; N151-H155 PolarHBondContact O-N 3.49Å
152	V	96.9	Very high	92.4	Very high	21 Å²	21	77.9 Å²	77.9	13%	0.127	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-47	177	163.9	0	0	0	0	111.2	A93 L96 L97 D148 V149 I150 H154 H155 L156	A93-V152 HydrophobicContact CB-CG1 3.86Å; L96-V152 HydrophobicContact CB-CG1 3.77Å; L96-V152 HydrophobicContact CB-CG2 4.07Å; L96-V152 HydrophobicContact CD1-CG1 3.83Å; L96-V152 HydrophobicContact CG-CG1 4.45Å; L97-V152 HydrophobicContact CD2-CB 4.36Å; L97-V152 HydrophobicContact CD2-CG2 3.74Å; L97-V152 HydrophobicContact CG-CB 4.36Å; L97-V152 HydrophobicContact CG-CG1 4.36Å; L97-V152 HydrophobicContact CG-CG2 4Å; D148-V152 WeakPolarHBondContact O-CB 3.5Å; D148-V152 WeakPolarHBondContact O-CG2 2.83Å; D148-V152 PolarHBondContact O-N 3.04Å; V149-V152 PolarHBondContact O-N 3.15Å; I150-V152 VanDerWaalsContact C-N 3.34Å; I150-V152 PolarHBondContact O-N 3.42Å; V152-H154 PolarHBondContact O-N 3.3Å; V152-H155 WeakPolarHBondContact O-CB 3.39Å; V152-H155 PolarHBondContact O-N 3.44Å; V152-L156 HydrophobicContact CG1-CD1 3.97Å; V152-L156 HydrophobicContact CG1-CG 4.5Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 3.05Å
153	F	96	Very high	90.9	Very high	9 Å²	9	80.5 Å²	80.5	4%	0.039	39%	0.386	C	S	.	.	H	α-helix	trans	-65.2	-39.7	177.9	-89.3	-104	0	0	0	112.5	L89 A93 A129 M130 I133 V149 I150 H155 L156 R157	L89-F153 HydrophobicContact CD1-CD1 4.23Å; L89-F153 HydrophobicContact CD1-CE1 4.29Å; L89-F153 HydrophobicContact CD2-CD1 3.73Å; L89-F153 HydrophobicContact CD2-CE1 3.44Å; L89-F153 VanDerWaalsContact CD2-CE1 3.44Å; L89-F153 HydrophobicContact CG-CD1 3.9Å; L89-F153 HydrophobicContact CG-CE1 3.49Å; L89-F153 VanDerWaalsContact CG-CE1 3.49Å; L89-F153 HydrophobicContact CG-CZ 4.3Å; A93-F153 HydrophobicContact CB-CD2 3.88Å; A93-F153 HydrophobicContact CB-CE2 3.33Å; A93-F153 HydrophobicContact CB-CZ 3.84Å; A129-F153 HydrophobicContact CB-CE1 3.7Å; A129-F153 HydrophobicContact CB-CZ 3.96Å; M130-F153 HydrophobicContact CB-CE1 4.46Å; M130-F153 HydrophobicContact CB-CE2 4.41Å; M130-F153 HydrophobicContact CB-CZ 4.39Å; M130-F153 HydrophobicContact CG-CB 3.77Å; M130-F153 HydrophobicContact CG-CD1 3.32Å; M130-F153 HydrophobicContact CG-CD2 3.45Å; M130-F153 VanDerWaalsContact CG-CD2 3.45Å; M130-F153 HydrophobicContact CG-CE1 3.6Å; M130-F153 HydrophobicContact CG-CE2 3.72Å; M130-F153 HydrophobicContact CG-CG 3.22Å; M130-F153 HydrophobicContact CG-CZ 3.8Å; M130-F153 HydrophobicContact SD-CB 3.63Å; M130-F153 HydrophobicContact SD-CD1 4.15Å; M130-F153 HydrophobicContact SD-CD2 4.37Å; M130-F153 HydrophobicContact SD-CG 3.82Å; I133-F153 HydrophobicContact CG1-CE2 4.3Å; I133-F153 HydrophobicContact CG1-CZ 4.29Å; V149-F153 HydrophobicContact CG1-CD2 4Å; V149-F153 HydrophobicContact CG1-CE2 4.03Å; V149-F153 WeakPolarHBondContact O-CD2 3.24Å; V149-F153 PolarHBondContact O-N 2.84Å; I150-F153 PolarHBondContact O-N 2.91Å; F153-H155 VanDerWaalsContact C-N 3.33Å; F153-H155 PolarHBondContact O-N 3.31Å; F153-L156 PolarHBondContact O-N 3.45Å; F153-R157 WeakPolarHBondContact O-CB 3.4Å; F153-R157 PolarHBondContact O-N 3.3Å
154	H	95.2	Very high	89.1	Confident	94 Å²	94	82.6 Å²	82.6	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-43.2	173.4	180	-104.1	0	0	0	111.5	I150 N151 V152 R157 Q158	I150-H154 VanDerWaalsContact O-CB 3.27Å; I150-H154 WeakPolarHBondContact O-CB 3.5Å; I150-H154 PolarHBondContact O-N 3.15Å; N151-H154 PolarHBondContact O-N 3.3Å; V152-H154 PolarHBondContact O-N 3.3Å; H154-R157 PolarHBondContact O-N 2.98Å; H154-Q158 PolarHBondContact CE1-NE2 3.46Å; H154-Q158 PolarHBondContact NE2-NE2 3.01Å; H154-Q158 WeakPolarHBondContact O-CG 3.38Å; H154-Q158 PolarHBondContact O-N 3.15Å
155	H	95.3	Very high	87.1	Confident	86 Å²	86	85.9 Å²	85.9	40%	0.398	41%	0.411	S	S	.	.	H	α-helix	trans	-61.1	-46.8	174.5	179.1	59.1	0	0	0	112.1	N151 V152 F153 R157 Q158 L159	N151-H155 WeakPolarHBondContact O-CB 3.43Å; N151-H155 PolarHBondContact O-N 3.49Å; V152-H155 WeakPolarHBondContact O-CB 3.39Å; V152-H155 PolarHBondContact O-N 3.44Å; F153-H155 VanDerWaalsContact C-N 3.33Å; F153-H155 PolarHBondContact O-N 3.31Å; H155-R157 VanDerWaalsContact C-N 3.34Å; H155-R157 PolarHBondContact O-N 3.06Å; H155-Q158 WeakPolarHBondContact O-CB 3.43Å; H155-Q158 PolarHBondContact O-N 3.24Å; H155-L159 WeakPolarHBondContact O-CG 3.21Å; H155-L159 PolarHBondContact O-N 2.74Å
156	L	94.6	Very high	85.2	Confident	18 Å²	18	85 Å²	85	9%	0.094	42%	0.417	C	S	.	.	H	α-helix	trans	-61	-40.9	177.1	-70.8	170	0	0	0	112.1	L89 A92 A93 L96 V152 F153 Q158 L159 R160	L89-L156 HydrophobicContact CD1-CB 3.96Å; L89-L156 HydrophobicContact CD1-CD1 3.92Å; A92-L156 HydrophobicContact CB-CD1 4Å; A92-L156 HydrophobicContact CB-CD2 3.84Å; A93-L156 HydrophobicContact CB-CD1 3.88Å; L96-L156 HydrophobicContact CD1-CD1 4.27Å; L96-L156 HydrophobicContact CD1-CD2 3.72Å; L96-L156 HydrophobicContact CD1-CG 3.93Å; V152-L156 HydrophobicContact CG1-CD1 3.97Å; V152-L156 HydrophobicContact CG1-CG 4.5Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 3.05Å; F153-L156 PolarHBondContact O-N 3.45Å; L156-Q158 VanDerWaalsContact C-N 3.33Å; L156-Q158 PolarHBondContact O-N 3.1Å; L156-L159 PolarHBondContact O-N 3.18Å; L156-R160 WeakPolarHBondContact O-CG 3.38Å; L156-R160 PolarHBondContact O-N 3.49Å; L156-R160 VanDerWaalsContact O-N 3.09Å
157	R	91.4	Very high	83.2	Confident	149 Å²	149	88.8 Å²	88.8	56%	0.562	43%	0.433	S	S	*	.	H	α-helix	trans	-62.3	-40.9	175.7	-162	179.5	90.4	176.9	6.4	112	F153 H154 H155 R160 G161	F153-R157 WeakPolarHBondContact O-CB 3.4Å; F153-R157 PolarHBondContact O-N 3.3Å; H154-R157 PolarHBondContact O-N 2.98Å; H155-R157 VanDerWaalsContact C-N 3.34Å; H155-R157 PolarHBondContact O-N 3.06Å; R157-R160 PolarHBondContact O-N 3.19Å; R157-G161 PolarHBondContact O-N 3.07Å; R157-G161 VanDerWaalsContact O-N 3.11Å
158	Q	91	Very high	80.8	Confident	91 Å²	91	87.5 Å²	87.5	43%	0.425	44%	0.437	S	S	.	.	H	α-helix	trans	-66.1	-36.6	175.9	-71.8	-178.6	-6.9	0	0	112.8	H154 H155 L156 K162	H154-Q158 PolarHBondContact CE1-NE2 3.46Å; H154-Q158 PolarHBondContact NE2-NE2 3.01Å; H154-Q158 WeakPolarHBondContact O-CG 3.38Å; H154-Q158 PolarHBondContact O-N 3.15Å; H155-Q158 WeakPolarHBondContact O-CB 3.43Å; H155-Q158 PolarHBondContact O-N 3.24Å; L156-Q158 VanDerWaalsContact C-N 3.33Å; L156-Q158 PolarHBondContact O-N 3.1Å; Q158-K162 WeakPolarHBondContact O-CG 3.46Å; Q158-K162 PolarHBondContact O-N 3.26Å
159	L	89.3	Confident	79.1	Confident	74 Å²	74	89.6 Å²	89.6	39%	0.387	45%	0.454	S	S	.	.	H	α-helix	trans	-65.3	-43.1	176.4	-70	178.1	0	0	0	111.4	H155 L156 K162 S163	H155-L159 WeakPolarHBondContact O-CG 3.21Å; H155-L159 PolarHBondContact O-N 2.74Å; L156-L159 PolarHBondContact O-N 3.18Å; L159-K162 PolarHBondContact O-N 3.28Å; L159-S163 PolarHBondContact O-N 3.05Å; L159-S163 VanDerWaalsContact O-N 3.13Å; L159-S163 PolarHBondContact O-OG 3.27Å
160	R	84.1	Confident	77.1	Confident	92 Å²	92	99 Å²	99	35%	0.347	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-44.1	177.7	-69	173.2	61	-166.2	-6.5	112.3	L156 R157 K162 S163 D164	L156-R160 WeakPolarHBondContact O-CG 3.38Å; L156-R160 PolarHBondContact O-N 3.49Å; L156-R160 VanDerWaalsContact O-N 3.09Å; R157-R160 PolarHBondContact O-N 3.19Å; R160-K162 PolarHBondContact O-N 3.37Å; R160-S163 PolarHBondContact O-N 3.36Å; R160-S163 VanDerWaalsContact O-N 3.15Å; R160-D164 PolarHBondContact O-N 2.8Å
161	G	77.2	Confident	75.4	Confident	39 Å²	39	101.1 Å²	101.1	40%	0.402	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-23.1	175.8	0	0	0	0	0	114.3	R157 Q165	R157-G161 PolarHBondContact O-N 3.07Å; R157-G161 VanDerWaalsContact O-N 3.11Å; G161-Q165 VanDerWaalsContact O-CG 3.26Å; G161-Q165 WeakPolarHBondContact O-CG 3.37Å
162	K	67.1	Low	73.4	Confident	121 Å²	121	103.4 Å²	103.4	53%	0.526	56%	0.562	S	S	.	*	H	α-helix	trans	-81	-36	173.8	-72	171.8	-178.4	180	0	112.3	Q158 L159 R160 D164 Q165 L166	Q158-K162 WeakPolarHBondContact O-CG 3.46Å; Q158-K162 PolarHBondContact O-N 3.26Å; L159-K162 PolarHBondContact O-N 3.28Å; R160-K162 PolarHBondContact O-N 3.37Å; K162-D164 VanDerWaalsContact C-N 3.29Å; K162-D164 PolarHBondContact O-N 2.66Å; K162-Q165 PolarHBondContact O-N 2.76Å; K162-Q165 VanDerWaalsContact O-N 3.17Å; K162-L166 WeakPolarHBondContact O-CG 2.96Å; K162-L166 PolarHBondContact O-N 2.82Å
163	S	63.5	Low	72.2	Confident	75 Å²	75	107.5 Å²	107.5	52%	0.524	58%	0.583	S	S	.	*	H	α-helix	trans	-62.5	-38.4	176.9	-61.7	0	0	0	0	111.9	L159 R160 Q165 L166	L159-S163 PolarHBondContact O-N 3.05Å; L159-S163 VanDerWaalsContact O-N 3.13Å; L159-S163 PolarHBondContact O-OG 3.27Å; R160-S163 PolarHBondContact O-N 3.36Å; R160-S163 VanDerWaalsContact O-N 3.15Å; S163-Q165 VanDerWaalsContact C-N 3.27Å; S163-Q165 PolarHBondContact O-N 3.27Å; S163-L166 PolarHBondContact O-N 2.9Å
164	D	58	Low	71	Confident	129 Å²	129	112.7 Å²	112.7	69%	0.69	61%	0.612	S	S	*	*	H	α-helix	trans	-66.7	-29.6	176	-67	-19.8	0	0	0	112.4	R160 K162	R160-D164 PolarHBondContact O-N 2.8Å; K162-D164 VanDerWaalsContact C-N 3.29Å; K162-D164 PolarHBondContact O-N 2.66Å
165	Q	52.1	Low	69.6	Low	142 Å²	142	113.7 Å²	113.7	66%	0.664	62%	0.622	S	S	*	*	H	α-helix	trans	-79.2	-19.3	177.7	-66.9	-74.5	-16.2	0	0	113.2	G161 K162 S163 H167	G161-Q165 VanDerWaalsContact O-CG 3.26Å; G161-Q165 WeakPolarHBondContact O-CG 3.37Å; K162-Q165 PolarHBondContact O-N 2.76Å; K162-Q165 VanDerWaalsContact O-N 3.17Å; S163-Q165 VanDerWaalsContact C-N 3.27Å; S163-Q165 PolarHBondContact O-N 3.27Å; Q165-H167 VanDerWaalsContact C-N 3.34Å
166	L	56.7	Low	68.1	Low	146 Å²	146	115.4 Å²	115.4	76%	0.764	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-3.4	-177.6	-76.9	167.4	0	0	0	113.9	K162 S163	K162-L166 WeakPolarHBondContact O-CG 2.96Å; K162-L166 PolarHBondContact O-N 2.82Å; S163-L166 PolarHBondContact O-N 2.9Å
167	H	52.6	Low	66.5	Low	167 Å²	167	121.4 Å²	121.4	77%	0.773	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	15.6	176.2	-107.6	83.2	0	0	0	114.8	Q165 P169	Q165-H167 VanDerWaalsContact C-N 3.34Å; H167-P169 WeakPolarHBondContact O-CD 3.45Å
168	L	48.5	Very low	64.8	Low	133 Å²	133	119.6 Å²	119.6	70%	0.696	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70.9	116.9	173.5	-115.2	75.5	0	0	0	110.9	K170	L168-K170 PolarHBondContact O-N 3.41Å
169	P	60.7	Low	63	Low	110 Å²	110	121.6 Å²	121.6	71%	0.714	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-63	130.7	165.4	26.5	-31.2	0	0	0	108.4	H167	H167-P169 WeakPolarHBondContact O-CD 3.45Å
170	K	55.8	Low	60.9	Low	197 Å²	197	125.3 Å²	125.3	86%	0.857	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-57.5	132.6	168.6	-78.8	-172.3	169.1	71.9	0	108.4	L168 G172	L168-K170 PolarHBondContact O-N 3.41Å; K170-G172 PolarHBondContact O-N 3.13Å
171	P	59.5	Low	59	Low	130 Å²	130	128.1 Å²	128.1	84%	0.844	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-66.4	122	164.3	28.5	-29.9	0	0	0	107.7
172	G	56.3	Low	57.3	Low	148 Å²	148	136.2 Å²	136.2	100%	1.526	78%	0.78	S	S	*	*			trans	-91.7	0	151.8	0	0	0	0	0	108.9	K170	K170-G172 PolarHBondContact O-N 3.13Å

Retrieved 172 of 172 residues in 28.8 ms (Link to these results)

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