A0A096NQD1_PAPAN Loading...

sn-1-specific diacylglycerol lipase ABHD11

Catalyzes the hydrolysis of diacylglycerol in vitro and may function as a key regulator in lipid metabolism, namely by regulating the intracellular levels of diacylglycerol. 1,2-diacyl-sn-glycerols are the preferred substrate over 1,3-diacyl-sn-glycerols. The enzyme hydrolyzes stearate in preference to palmitate from the sn-1 position of 1,2-diacyl-sn-glycerols. Maintains the functional lipoylation of the 2-oxoglutarate dehydrogenase complex (OGDHc) through its interaction with the OGDHc by preventing the formation of lipoyl adducts. In addition, is also required for the expansion and differentiation of embryonic stem cells (ESCs).

AlphaFold DB , UniProt , Accession A0A096NQD1, Species PAPAN (Papio anubis, Olive baboon), Gene ABHD11, Length 314 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	V	34.8	Very low	28.8	Very low	189 Å²	189	150.7 Å²	150.7	100%	1.145	83%	0.827	S	S	*	*				0	109.9	0	-175.4	0	0	0	0	106
2	R	31.1	Very low	28.5	Very low	227 Å²	227	156.3 Å²	156.3	86%	0.857	83%	0.826	S	S	*	*			cis	-144.6	136.5	16.9	-91.7	166.4	-179.5	-159.4	-0.3	106.1
3	A	29.1	Very low	28.2	Very low	106 Å²	106	154.7 Å²	154.7	88%	0.876	83%	0.833	S	S	*	*				62	132.5	104.4	0	0	0	0	0	114.1
4	G	29.7	Very low	28	Very low	68 Å²	68	152.9 Å²	152.9	70%	0.701	83%	0.831	S	S	*	*			cis	164.1	144.3	9	0	0	0	0	0	108.6
5	Q	31.1	Very low	28	Very low	184 Å²	184	159.4 Å²	159.4	86%	0.86	84%	0.838	S	S	*	*			trans	40.2	124.4	147.6	-65	178.1	-16.7	0	0	120.8
6	R	30.1	Very low	27.8	Very low	258 Å²	258	154.7 Å²	154.7	97%	0.974	83%	0.829	S	S	*	*				-138.2	129.5	127.6	-76.3	-163.3	178.7	-147.3	-1.4	110.8
7	L	26.8	Very low	27.7	Very low	163 Å²	163	160.2 Å²	160.2	85%	0.853	84%	0.836	S	S	*	*			trans	-106.9	145	-179.4	-144.1	99.8	0	0	0	109.1
8	A	26.8	Very low	27.5	Very low	91 Å²	91	164.6 Å²	164.6	75%	0.752	84%	0.839	S	S	*	*			trans	70	130	141.6	0	0	0	0	0	122.5
9	S	26.3	Very low	27.6	Very low	101 Å²	101	164.4 Å²	164.4	71%	0.706	84%	0.839	S	S	*	*			trans	143.1	129.1	143	164.3	0	0	0	0	108.7
10	M	24.6	Very low	27.7	Very low	156 Å²	156	162.3 Å²	162.3	77%	0.768	84%	0.837	S	S	*	*			cis	-174.4	145.6	14.3	-111.6	177.8	-178.9	0	0	109.8
11	L	25.9	Very low	27.7	Very low	115 Å²	115	163 Å²	163	60%	0.602	84%	0.841	S	S	*	*			trans	80.5	114.8	133.7	-64.4	162.6	0	0	0	124
12	R	25.2	Very low	27.3	Very low	218 Å²	218	163.1 Å²	163.1	82%	0.823	83%	0.83	S	S	*	*				67.4	112.6	128.9	-65.3	179.5	-160.3	-140.2	10.1	120
13	C	24.6	Very low	27.3	Very low	135 Å²	135	156 Å²	156	91%	0.912	83%	0.826	S	S	*	*				-145.6	121.9	123.9	-136.8	0	0	0	0	110
14	T	26.1	Very low	27.4	Very low	130 Å²	130	158.4 Å²	158.4	80%	0.798	82%	0.824	S	S	*	*			trans	-106.1	131.7	174.6	37	0	0	0	0	107.7
15	R	27.1	Very low	27.4	Very low	250 Å²	250	157.7 Å²	157.7	94%	0.943	82%	0.816	S	S	*	*			trans	-146.2	125.3	154	-109.4	178.8	-174.2	-146.9	0.7	110
16	A	25.6	Very low	27.4	Very low	84 Å²	84	155 Å²	155	69%	0.694	82%	0.815	S	S	*	*			trans	-78.7	145.7	-174.5	0	0	0	0	0	111.5
17	W	25.6	Very low	27.4	Very low	249 Å²	249	150.8 Å²	150.8	94%	0.943	81%	0.806	S	S	*	*			trans	-118.6	115.1	154.3	-79.7	70.7	0	0	0	107.2
18	R	24.1	Very low	27.5	Very low	238 Å²	238	147.8 Å²	147.8	90%	0.898	80%	0.799	S	S	*	*			trans	-92.5	133.5	170.8	-72.6	-178.8	-178.2	-119.1	2.3	107.9
19	L	30.6	Very low	27.7	Very low	161 Å²	161	148.9 Å²	148.9	84%	0.843	80%	0.798	S	S	*	*			trans	-126.7	154.8	160.4	-79.2	169.5	0	0	0	108.6
20	P	28.7	Very low	27.6	Very low	122 Å²	122	149.5 Å²	149.5	79%	0.792	80%	0.802	S	S	*	*			trans	-80	143.4	-158.3	-6.8	24.4	0	0	0	113.2
21	L	27	Very low	28	Very low	177 Å²	177	151.7 Å²	151.7	93%	0.927	81%	0.808	S	S	*	*			trans	-80.4	115.1	165.6	-81	147.7	0	0	0	108.9
22	E	26.8	Very low	28.1	Very low	193 Å²	193	150.2 Å²	150.2	90%	0.902	81%	0.812	S	S	*	*			trans	-127.9	144.4	150.9	-76.2	-152.5	153.8	0	0	109.5
23	G	31.6	Very low	28.6	Very low	76 Å²	76	151.5 Å²	151.5	78%	0.784	82%	0.817	S	S	*	*			trans	-77.4	144.8	-149.8	0	0	0	0	0	116.2
24	L	30	Very low	29.3	Very low	157 Å²	157	151.4 Å²	151.4	82%	0.822	81%	0.812	S	S	*	*			trans	-128.3	110.1	160.3	-76	167.2	0	0	0	107.4
25	G	31.4	Very low	29.5	Very low	53 Å²	53	150.7 Å²	150.7	55%	0.546	81%	0.809	S	S	.	*			trans	-64.8	162.9	171.3	0	0	0	0	0	111.5	H27	G25-H27 PolarHBondContact O-N 2.9Å
26	P	31.4	Very low	29.8	Very low	127 Å²	127	145.6 Å²	145.6	83%	0.825	81%	0.806	S	S	*	*			trans	-71	107.5	-178	28.2	-31.2	0	0	0	109.9	S28	P26-S28 PolarHBondContact O-N 3.22Å
27	H	29.4	Very low	30.3	Very low	171 Å²	171	145.5 Å²	145.5	79%	0.792	81%	0.805	S	S	*	*			trans	-70.2	94.6	164.3	-74.8	-73.7	0	0	0	109	G25	G25-H27 PolarHBondContact O-N 2.9Å
28	S	28.8	Very low	30.6	Very low	100 Å²	100	139.5 Å²	139.5	70%	0.699	80%	0.798	S	S	*	*			trans	-74.8	130.9	161.3	-58.1	0	0	0	0	109.1	P26 S30	P26-S28 PolarHBondContact O-N 3.22Å; S28-S30 PolarHBondContact O-N 2.72Å
29	P	30.2	Very low	31.1	Very low	114 Å²	114	134 Å²	134	74%	0.74	80%	0.796	S	S	*	*			trans	-69.2	107.8	168	26.8	-29.1	0	0	0	108.2	F31	P29-F31 PolarHBondContact O-N 2.68Å
30	S	25.4	Very low	31.3	Very low	113 Å²	113	132 Å²	132	79%	0.79	80%	0.795	S	S	*	*			trans	-66.5	112.9	172.6	175.5	0	0	0	0	109.1	S28 A32	S28-S30 PolarHBondContact O-N 2.72Å; S30-A32 PolarHBondContact O-N 2.77Å
31	F	32.1	Very low	31.9	Very low	203 Å²	203	132.1 Å²	132.1	89%	0.89	80%	0.799	S	S	*	*			trans	-67.2	99.2	164.8	-74.1	-88.8	0	0	0	108.3	P29 R33	P29-F31 PolarHBondContact O-N 2.68Å; F31-R33 PolarHBondContact O-N 3.05Å
32	A	29.3	Very low	32.1	Very low	84 Å²	84	127.6 Å²	127.6	69%	0.694	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.4	126.4	168.5	0	0	0	0	0	109	S30 V34	S30-A32 PolarHBondContact O-N 2.77Å; A32-V34 PolarHBondContact O-N 3.34Å
33	R	35.3	Very low	32.4	Very low	245 Å²	245	122 Å²	122	93%	0.925	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-52.6	125.9	172.6	-76.3	175.8	173.3	176.2	-2.7	110.2	F31	F31-R33 PolarHBondContact O-N 3.05Å
34	V	38.8	Very low	32.9	Very low	132 Å²	132	131.1 Å²	131.1	80%	0.8	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.6	123.6	165.1	-179.5	0	0	0	0	107.6	A32 V36	A32-V34 PolarHBondContact O-N 3.34Å; V34-V36 PolarHBondContact O-N 2.61Å
35	P	30.2	Very low	33.3	Very low	115 Å²	115	126.3 Å²	126.3	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.1	175.9	-11.6	25.9	0	0	0	110.4	A37	P35-A37 PolarHBondContact O-N 3.07Å
36	V	34.6	Very low	33.9	Very low	144 Å²	144	133.6 Å²	133.6	87%	0.873	81%	0.809	S	S	*	*			trans	-75.3	110.9	161.6	179.2	0	0	0	0	107	V34	V34-V36 PolarHBondContact O-N 2.61Å
37	A	35.5	Very low	35.1	Very low	81 Å²	81	131.8 Å²	131.8	67%	0.669	81%	0.805	S	S	*	*			trans	-74.2	144.3	174.1	0	0	0	0	0	110.6	P35	P35-A37 PolarHBondContact O-N 3.07Å
38	P	31	Very low	36.7	Very low	123 Å²	123	132 Å²	132	80%	0.799	81%	0.806	S	S	*	*			trans	-71.4	145.8	178.2	30.4	-32.7	0	0	0	110.8	S40	P38-S40 PolarHBondContact O-N 2.84Å
39	S	34.5	Very low	38.5	Very low	123 Å²	123	129.6 Å²	129.6	86%	0.86	79%	0.788	S	S	*	*			trans	-64.5	111.5	175.8	52.2	0	0	0	0	110.9
40	S	35.4	Very low	40.6	Very low	118 Å²	118	133.5 Å²	133.5	83%	0.825	79%	0.788	S	S	*	*			trans	-91.4	114.2	165.8	58.3	0	0	0	0	109.9	P38	P38-S40 PolarHBondContact O-N 2.84Å
41	S	40.4	Very low	43.2	Very low	125 Å²	125	132.2 Å²	132.2	87%	0.874	78%	0.777	S	S	*	*			trans	-76.2	126.7	166.4	43	0	0	0	0	110.3
42	G	32.9	Very low	46	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	74%	0.741	S	S	*	*			trans	150.1	112.8	163.7	0	0	0	0	0	115.2
43	G	33.2	Very low	49.1	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	74%	0.741	S	S	*	*			trans	116.5	96.6	161.7	0	0	0	0	0	115.2	G45	G43-G45 VanDerWaalsContact C-N 3.3Å; G43-G45 PolarHBondContact O-N 3.25Å
44	R	41.7	Very low	52.1	Low	267 Å²	267	113.8 Å²	113.8	100%	1.008	70%	0.7	S	S	*	*			trans	-75.4	82.9	164.2	-74.7	-176.4	179.1	-162.9	-0.5	109.4
45	G	37.6	Very low	54.9	Low	57 Å²	57	109 Å²	109	59%	0.588	67%	0.672	S	S	*	*	S	Bend	trans	-118.7	142.8	144.4	0	0	0	0	0	105.8	G43 A47	G43-G45 VanDerWaalsContact C-N 3.3Å; G43-G45 PolarHBondContact O-N 3.25Å; G45-A47 PolarHBondContact O-N 3.24Å
46	E	45.3	Very low	58.2	Low	205 Å²	205	108.1 Å²	108.1	96%	0.958	66%	0.655	S	S	*	*			trans	-60	95.6	170.3	-73	-179.2	163.3	0	0	107.4	E48	E46-E48 PolarHBondContact O-N 3.37Å
47	A	56.5	Low	61.2	Low	90 Å²	90	103.4 Å²	103.4	74%	0.744	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-67.2	125.9	177.9	0	0	0	0	0	107.1	G45	G45-A47 PolarHBondContact O-N 3.24Å
48	E	61.3	Low	64.2	Low	174 Å²	174	102.6 Å²	102.6	81%	0.813	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-46.7	131.4	172.3	-77.7	-70.7	165.7	0	0	109.7	E46 R50	E46-E48 PolarHBondContact O-N 3.37Å; E48-R50 PolarHBondContact O-N 3.32Å
49	P	66.7	Low	67.3	Low	50 Å²	50	99.3 Å²	99.3	33%	0.325	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-54.3	127.4	-178.5	-19.5	27.4	0	0	0	110.1	I117	P49-I117 HydrophobicContact CB-CD1 4.02Å; P49-I117 HydrophobicContact CB-CG1 4.04Å; P49-I117 HydrophobicContact CB-CG2 4.16Å; P49-I117 HydrophobicContact CG-CD1 3.75Å; P49-I117 HydrophobicContact CG-CG1 3.69Å
50	R	75.9	Confident	70.1	Confident	197 Å²	197	100 Å²	100	74%	0.743	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-64.1	131	-178.8	-171.1	-179.7	-71.2	169.1	-1.6	110.1	E48 L52	E48-R50 PolarHBondContact O-N 3.32Å; R50-L52 PolarHBondContact O-N 2.98Å
51	P	79.2	Confident	72.6	Confident	85 Å²	85	96 Å²	96	55%	0.552	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-56.8	135.6	170.9	-24.3	33.3	0	0	0	110.8
52	L	90.3	Very high	74.6	Confident	28 Å²	28	96 Å²	96	15%	0.147	55%	0.546	C	S	.	.			trans	-111.3	133.4	178.8	-64	-179.4	0	0	0	111.2	R50 L54 R102 P108	R50-L52 PolarHBondContact O-N 2.98Å; L52-L54 VanDerWaalsContact C-N 3.31Å; L52-L54 HydrophobicContact CB-CD2 4.27Å; L52-L54 PolarHBondContact O-N 3.39Å; L52-R102 HydrophobicContact CD1-CB 3.58Å; L52-P108 HydrophobicContact CD2-CB 4.25Å
53	P	94.6	Very high	76.6	Confident	106 Å²	106	96 Å²	96	69%	0.688	54%	0.537	S	S	*	.			trans	-71.3	89.7	170.4	30	-34	0	0	0	109.1	P108	P53-P108 HydrophobicContact CG-CG 4.03Å; P53-P108 VanDerWaalsContact O-CD 3.28Å; P53-P108 WeakPolarHBondContact O-CD 3.42Å
54	L	98	Very high	79	Confident	12 Å²	12	97 Å²	97	6%	0.063	54%	0.538	C	S	.	.			trans	-61.4	139.9	-179.9	-62.9	-169.7	0	0	0	111	L52 Y56 V99 R102 S107 D121 L122 L125	L52-L54 VanDerWaalsContact C-N 3.31Å; L52-L54 HydrophobicContact CB-CD2 4.27Å; L52-L54 PolarHBondContact O-N 3.39Å; L54-Y56 WeakPolarHBondContact O-CD1 3.46Å; L54-V99 HydrophobicContact CB-CG1 3.98Å; L54-V99 HydrophobicContact CD1-CG1 3.63Å; L54-V99 HydrophobicContact CG-CG1 4.47Å; L54-R102 HydrophobicContact CD2-CB 4.44Å; L54-S107 WeakPolarHBondContact CA-OG 3.31Å; L54-D121 HydrophobicContact CD1-CB 3.65Å; L54-D121 HydrophobicContact CD2-CB 4.27Å; L54-D121 HydrophobicContact CG-CB 4.05Å; L54-L122 HydrophobicContact CD1-CD2 4.4Å; L54-L125 HydrophobicContact CB-CD2 4.27Å; L54-L125 HydrophobicContact CD1-CD2 4.33Å
55	S	98.4	Very high	81.4	Confident	31 Å²	31	86.9 Å²	86.9	22%	0.217	50%	0.504	C	S	.	.			trans	-79	130.6	171.7	-172	0	0	0	0	110.1	K78 D100 S107	S55-K78 PolarHBondContact OG-NZ 3.24Å; S55-D100 WeakPolarHBondContact O-CB 3.23Å; S55-D100 PolarHBondContact O-N 3.16Å; S55-S107 PolarHBondContact N-OG 3.47Å
56	Y	98.6	Very high	84.2	Confident	96 Å²	96	85.4 Å²	85.4	38%	0.376	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	166.9	180	62.7	-94.9	0	0	0	112.2	L54 L58 L97 T98 L125 L129	L54-Y56 WeakPolarHBondContact O-CD1 3.46Å; Y56-L58 HydrophobicContact CD2-CB 4.4Å; Y56-L58 HydrophobicContact CE2-CB 4.42Å; Y56-L97 HydrophobicContact CD2-CD1 3.42Å; Y56-L97 VanDerWaalsContact CD2-CD1 3.42Å; Y56-L97 HydrophobicContact CE2-CD1 4.22Å; Y56-L97 HydrophobicContact CG-CD1 3.83Å; Y56-T98 CarbonylContact C-O 3.51Å; Y56-T98 WeakPolarHBondContact CA-O 3.45Å; Y56-T98 WeakPolarHBondContact CB-O 3.23Å; Y56-L125 HydrophobicContact CD1-CD1 3.94Å; Y56-L125 HydrophobicContact CD1-CD2 4.43Å; Y56-L125 HydrophobicContact CE1-CD1 3.91Å; Y56-L129 HydrophobicContact CD1-CD1 4.5Å; Y56-L129 HydrophobicContact CD2-CD1 4.41Å; Y56-L129 HydrophobicContact CE1-CD1 4.21Å; Y56-L129 HydrophobicContact CE1-CD2 4.38Å; Y56-L129 HydrophobicContact CE2-CD1 4.09Å; Y56-L129 HydrophobicContact CE2-CD2 4.37Å; Y56-L129 WeakPolarHBondContact OH-CD2 3.01Å
57	S	98.3	Very high	86.7	Confident	46 Å²	46	75.7 Å²	75.7	32%	0.322	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.8	165.4	-62.3	0	0	0	0	108.5	L97 T98	S57-L97 WeakPolarHBondContact O-CA 3.23Å; S57-T98 PolarHBondContact N-O 3.26Å; S57-T98 PolarHBondContact O-N 3.4Å
58	L	97.8	Very high	88.7	Confident	63 Å²	63	71.4 Å²	71.4	33%	0.33	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.9	175.8	-179.8	60.1	0	0	0	109.2	Y56 R95 L97 L131	Y56-L58 HydrophobicContact CD2-CB 4.4Å; Y56-L58 HydrophobicContact CE2-CB 4.42Å; L58-R95 HydrophobicContact CD1-CB 4.42Å; L58-L97 HydrophobicContact CB-CD1 3.91Å; L58-L97 HydrophobicContact CD1-CB 4.32Å; L58-L97 HydrophobicContact CD1-CD1 4.07Å; L58-L131 HydrophobicContact CD1-CD2 4.44Å
59	L	97.1	Very high	90.4	Very high	55 Å²	55	63.1 Å²	63.1	29%	0.288	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.2	167.6	-57.3	-179.2	0	0	0	108.1	A85 K86 A89 R95 V96	L59-A85 HydrophobicContact CD1-CB 3.88Å; L59-K86 HydrophobicContact CD1-CB 4.47Å; L59-K86 HydrophobicContact CD1-CG 3.91Å; L59-A89 HydrophobicContact CB-CB 4.35Å; L59-A89 HydrophobicContact CD1-CB 4.33Å; L59-R95 CarbonylContact O-C 3.6Å; L59-R95 WeakPolarHBondContact O-CA 3.39Å; L59-V96 HydrophobicContact CB-CB 4.37Å; L59-V96 PolarHBondContact N-O 2.85Å; L59-V96 PolarHBondContact O-N 3Å
60	D	92.6	Very high	92	Very high	137 Å²	137	60.7 Å²	60.7	73%	0.733	35%	0.349	S	S	*	.			trans	-67.8	160.8	178.2	-74.3	-43.2	0	0	0	112.4
61	G	88.3	Confident	93.1	Very high	34 Å²	34	51.9 Å²	51.9	35%	0.351	32%	0.316	S	S	.	.			trans	-169.6	-175.3	-179.2	0	0	0	0	0	110.7	A63 G93	G61-A63 PolarHBondContact O-N 3.36Å; G61-G93 CarbonylContact C-O 3.53Å; G61-G93 VanDerWaalsContact CA-O 3.26Å; G61-G93 WeakPolarHBondContact CA-O 3.24Å
62	E	82.9	Confident	94	Very high	125 Å²	125	48 Å²	48	58%	0.584	29%	0.291	S	S	*	.			trans	-63.2	121.1	176.1	-63.2	-179.3	-167.8	0	0	111.1	A64 L65 G93	E62-A64 PolarHBondContact O-N 2.99Å; E62-L65 PolarHBondContact O-N 3.35Å; E62-G93 PolarHBondContact N-O 3.01Å
63	A	75.2	Confident	94.3	Very high	82 Å²	82	46.8 Å²	46.8	68%	0.678	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.4	-174.6	0	0	0	0	0	114.1	G61 L65	G61-A63 PolarHBondContact O-N 3.36Å; A63-L65 VanDerWaalsContact C-N 3.27Å; A63-L65 PolarHBondContact O-N 2.97Å
64	A	83.9	Confident	94.5	Very high	97 Å²	97	42.6 Å²	42.6	80%	0.802	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-18.4	-178.9	0	0	0	0	0	113.2	E62	E62-A64 PolarHBondContact O-N 2.99Å
65	L	91.5	Very high	94.4	Very high	54 Å²	54	42.3 Å²	42.3	28%	0.283	26%	0.255	S	S	.	.	S	Bend	trans	-96	139.2	178.5	-61.4	176.9	0	0	0	111	E62 A63 A67 T92 R94	E62-L65 PolarHBondContact O-N 3.35Å; A63-L65 VanDerWaalsContact C-N 3.27Å; A63-L65 PolarHBondContact O-N 2.97Å; L65-A67 PolarHBondContact O-N 3.38Å; L65-T92 WeakPolarHBondContact CD1-O 3.41Å; L65-R94 HydrophobicContact CB-CG 3.77Å; L65-R94 HydrophobicContact CD1-CG 3.88Å; L65-R94 HydrophobicContact CG-CG 4.49Å
66	P	95.3	Very high	94.4	Very high	27 Å²	27	40.8 Å²	40.8	18%	0.175	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-55.1	133.1	173.7	-23.1	27.6	0	0	0	111.9	R94 V135 E158	P66-R94 VanDerWaalsContact CD-NH1 3.26Å; P66-R94 PolarHBondContact O-NH1 3.05Å; P66-V135 HydrophobicContact CB-CG2 4.5Å; P66-E158 WeakPolarHBondContact CB-OE2 3.39Å; P66-E158 VanDerWaalsContact CG-CD 3.42Å; P66-E158 WeakPolarHBondContact CG-OE1 3.42Å; P66-E158 WeakPolarHBondContact CG-OE2 3.31Å
67	A	97.8	Very high	94.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-67.1	153.3	178.9	0	0	0	0	0	111.3	L65 I69 R95 L131 C134 V135	L65-A67 PolarHBondContact O-N 3.38Å; A67-I69 HydrophobicContact CB-CD1 4.3Å; A67-R95 CarbonylContact C-O 3.53Å; A67-R95 WeakPolarHBondContact CA-O 3.26Å; A67-R95 HydrophobicContact CB-CB 3.97Å; A67-L131 HydrophobicContact CB-CB 4.28Å; A67-L131 HydrophobicContact CB-CD2 3.73Å; A67-L131 HydrophobicContact CB-CG 4.47Å; A67-C134 WeakPolarHBondContact O-CB 3.41Å; A67-V135 PolarHBondContact O-N 3.2Å
68	V	98.4	Very high	94.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.2	175.7	-172.7	0	0	0	0	110.2	F70 F88 R94 R95 V96 L97 V135 V137 L313	V68-F70 HydrophobicContact CB-CE2 4.39Å; V68-F70 HydrophobicContact CG1-CD2 4.23Å; V68-F70 HydrophobicContact CG1-CE2 3.66Å; V68-F70 HydrophobicContact CG1-CZ 3.97Å; V68-F88 HydrophobicContact CB-CE1 4.31Å; V68-F88 HydrophobicContact CG1-CE1 4.47Å; V68-F88 HydrophobicContact CG2-CD1 4.35Å; V68-F88 HydrophobicContact CG2-CE1 3.64Å; V68-F88 HydrophobicContact CG2-CZ 4.37Å; V68-R94 HydrophobicContact CG2-CB 4.27Å; V68-R95 PolarHBondContact N-O 2.87Å; V68-V96 CarbonylContact O-C 3.57Å; V68-V96 WeakPolarHBondContact O-CA 3.27Å; V68-L97 PolarHBondContact O-N 3.18Å; V68-V135 CarbonylContact C-O 3.53Å; V68-V135 WeakPolarHBondContact CA-O 3.48Å; V68-V135 HydrophobicContact CG1-CB 4.41Å; V68-V135 HydrophobicContact CG1-CG1 4.25Å; V68-V135 HydrophobicContact CG2-CB 4.13Å; V68-V135 HydrophobicContact CG2-CG2 4.48Å; V68-V137 HydrophobicContact CG1-CG2 3.69Å; V68-L313 HydrophobicContact CG2-CD1 4.16Å
69	I	98.7	Very high	94.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.6	-176.6	-42.9	-55.9	0	0	0	109.2	A67 L71 L97 V99 L126 L131 C134 V135 V137	A67-I69 HydrophobicContact CB-CD1 4.3Å; I69-L71 HydrophobicContact CG2-CD2 4.06Å; I69-L97 CarbonylContact C-O 3.48Å; I69-L97 WeakPolarHBondContact CA-O 3.48Å; I69-L97 HydrophobicContact CD1-CB 3.51Å; I69-L97 HydrophobicContact CD1-CD2 3.89Å; I69-L97 HydrophobicContact CD1-CG 4.33Å; I69-L97 HydrophobicContact CG2-CB 4.32Å; I69-L97 HydrophobicContact CG2-CD2 4.05Å; I69-V99 HydrophobicContact CG2-CG2 4.16Å; I69-L126 HydrophobicContact CD1-CD2 3.79Å; I69-L126 HydrophobicContact CG1-CD2 3.82Å; I69-L126 HydrophobicContact CG2-CD2 4.21Å; I69-L131 HydrophobicContact CD1-CB 4.48Å; I69-L131 HydrophobicContact CD1-CD1 3.94Å; I69-C134 HydrophobicContact CD1-CB 4.29Å; I69-C134 HydrophobicContact CG1-CB 3.88Å; I69-V135 PolarHBondContact N-O 3.07Å; I69-V137 PolarHBondContact O-N 2.77Å
70	F	98.8	Very high	94.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.8	176.5	-71.8	-86.8	0	0	0	111.7	V68 F81 I84 V96 L97 T98 V99 V137 F305 I309	V68-F70 HydrophobicContact CB-CE2 4.39Å; V68-F70 HydrophobicContact CG1-CD2 4.23Å; V68-F70 HydrophobicContact CG1-CE2 3.66Å; V68-F70 HydrophobicContact CG1-CZ 3.97Å; F70-F81 HydrophobicContact CB-CB 4.16Å; F70-F81 HydrophobicContact CB-CD1 4.36Å; F70-F81 HydrophobicContact CB-CD2 3.72Å; F70-F81 HydrophobicContact CB-CE2 4.12Å; F70-F81 HydrophobicContact CB-CG 3.83Å; F70-F81 AromaticContact CD1-CD1 3.69Å; F70-F81 HydrophobicContact CD1-CD1 3.69Å; F70-F81 AromaticContact CD1-CE1 3.88Å; F70-F81 HydrophobicContact CD1-CE1 3.88Å; F70-F81 HydrophobicContact CD1-CG 4.03Å; F70-F81 HydrophobicContact CD1-CZ 4.35Å; F70-F81 HydrophobicContact CE1-CD1 4.33Å; F70-F81 HydrophobicContact CG-CB 4.33Å; F70-F81 HydrophobicContact CG-CD1 4.23Å; F70-F81 HydrophobicContact CG-CD2 4.45Å; F70-F81 HydrophobicContact CG-CG 4.1Å; F70-I84 HydrophobicContact CE1-CG2 4.09Å; F70-I84 HydrophobicContact CZ-CG2 4Å; F70-V96 HydrophobicContact CD2-CG1 3.57Å; F70-V96 HydrophobicContact CE2-CG1 3.6Å; F70-L97 PolarHBondContact N-O 3.1Å; F70-T98 HydrophobicContact CB-CG2 4.16Å; F70-V99 PolarHBondContact O-N 2.71Å; F70-V137 CarbonylContact C-O 3.59Å; F70-V137 WeakPolarHBondContact CA-O 3.37Å; F70-V137 HydrophobicContact CD1-CB 3.75Å; F70-V137 HydrophobicContact CD1-CG1 3.82Å; F70-V137 HydrophobicContact CD1-CG2 4.35Å; F70-V137 HydrophobicContact CE1-CB 3.86Å; F70-V137 HydrophobicContact CE1-CG1 3.75Å; F70-V137 HydrophobicContact CE1-CG2 4.03Å; F70-V137 HydrophobicContact CG-CB 4.43Å; F70-V137 HydrophobicContact CZ-CG2 4.37Å; F70-F305 AromaticContact CE1-CE1 3.89Å; F70-F305 HydrophobicContact CE1-CE1 3.89Å; F70-F305 HydrophobicContact CE1-CZ 4.22Å; F70-I309 HydrophobicContact CE1-CD1 4Å; F70-I309 HydrophobicContact CZ-CD1 4.35Å
71	L	98.9	Very high	94.5	Very high	11 Å²	11	28.6 Å²	28.6	6%	0.058	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.4	178.1	-50.9	177.5	0	0	0	110.3	I69 V99 L122 V136 V137 H139 T145 A146	I69-L71 HydrophobicContact CG2-CD2 4.06Å; L71-V99 HydrophobicContact CD2-CB 4.12Å; L71-V99 HydrophobicContact CD2-CG2 4.38Å; L71-L122 HydrophobicContact CD1-CD1 3.51Å; L71-L122 HydrophobicContact CD2-CD1 4.05Å; L71-L122 HydrophobicContact CD2-CD2 3.91Å; L71-L122 HydrophobicContact CG-CD1 4.43Å; L71-V136 HydrophobicContact CD1-CG1 3.76Å; L71-V136 HydrophobicContact CG-CG1 4.27Å; L71-V137 PolarHBondContact N-O 3.06Å; L71-H139 PolarHBondContact O-N 2.98Å; L71-T145 HydrophobicContact CD1-CG2 4.44Å; L71-A146 HydrophobicContact CD1-CB 4.1Å
72	H	98.7	Very high	94.8	Very high	3 Å²	3	30 Å²	30	1%	0.014	19%	0.185	C	C	.	.			trans	-79	166	-176.8	70.1	75.2	0	0	0	113.4	G76 C77 F81 V99 A101 H104 H139 G142	H72-G76 PolarHBondContact CE1-O 3.01Å; H72-G76 VanDerWaalsContact CE1-O 3.31Å; H72-G76 VanDerWaalsContact ND1-C 3.31Å; H72-G76 PolarHBondContact ND1-O 3.39Å; H72-C77 VanDerWaalsContact CD2-C 3.46Å; H72-C77 VanDerWaalsContact CD2-CA 3.41Å; H72-C77 WeakPolarHBondContact CD2-CA 3.41Å; H72-F81 HydrophobicContact CB-CE2 4.1Å; H72-V99 PolarHBondContact CD2-O 2.68Å; H72-V99 VanDerWaalsContact CD2-O 3.24Å; H72-A101 PolarHBondContact NE2-N 3.45Å; H72-H104 VanDerWaalsContact CE1-CB 3.45Å; H72-H104 WeakPolarHBondContact CE1-CB 3.47Å; H72-H104 AromaticContact CE1-CD2 3.64Å; H72-H104 AromaticContact CE1-CG 3.57Å; H72-H139 CarbonylContact C-O 3.56Å; H72-G142 WeakPolarHBondContact O-CA 3.36Å; H72-G142 PolarHBondContact O-N 3.42Å; H72-G142 VanDerWaalsContact O-N 3.1Å
73	G	97.6	Very high	95.4	Very high	4 Å²	4	29 Å²	29	4%	0.041	19%	0.191	C	C	.	.			trans	-83.3	175.4	175.5	0	0	0	0	0	113.2	G76 H139	G73-G76 WeakPolarHBondContact O-CA 3.49Å; G73-G76 PolarHBondContact O-N 3.4Å; G73-H139 WeakPolarHBondContact CA-O 3.39Å; G73-H139 PolarHBondContact N-O 3.08Å
74	L	97	Very high	96.4	Very high	17 Å²	17	25.4 Å²	25.4	9%	0.089	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	139.4	174.9	-173.9	65	0	0	0	110.6	G76 M141 F176 L238 L242 L245	L74-G76 PolarHBondContact O-N 2.91Å; L74-G76 VanDerWaalsContact O-N 3.15Å; L74-M141 HydrophobicContact CB-CB 4.26Å; L74-M141 HydrophobicContact CB-SD 4.4Å; L74-M141 HydrophobicContact CD1-SD 4.01Å; L74-F176 HydrophobicContact CD2-CB 4.18Å; L74-F176 HydrophobicContact CD2-CD1 4.23Å; L74-F176 HydrophobicContact CD2-CD2 3.79Å; L74-F176 HydrophobicContact CD2-CE2 4.22Å; L74-F176 HydrophobicContact CD2-CG 3.82Å; L74-L238 HydrophobicContact CD1-CD2 3.68Å; L74-L242 HydrophobicContact CD2-CD1 4.03Å; L74-L245 HydrophobicContact CD1-CD1 4.1Å
75	F	97.4	Very high	97	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.026	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	2.7	-173.5	-42.6	-55.9	0	0	0	115.4	H104 F176 Y179 V180 H217 L218 N221 L233 L238	F75-H104 PolarHBondContact N-NE2 3.47Å; F75-H104 VanDerWaalsContact N-NE2 3.2Å; F75-F176 AromaticContact CE2-CD1 3.68Å; F75-F176 HydrophobicContact CE2-CD1 3.68Å; F75-F176 HydrophobicContact CE2-CE1 4.21Å; F75-F176 HydrophobicContact CE2-CG 4.3Å; F75-F176 HydrophobicContact CZ-CB 4.43Å; F75-F176 HydrophobicContact CZ-CD1 4.4Å; F75-Y179 HydrophobicContact CE2-CD2 4.41Å; F75-V180 HydrophobicContact CE1-CG2 3.78Å; F75-V180 HydrophobicContact CZ-CG2 3.83Å; F75-H217 PolarHBondContact O-NE2 2.91Å; F75-L218 HydrophobicContact CB-CD2 3.78Å; F75-L218 HydrophobicContact CD1-CD2 4.06Å; F75-L218 HydrophobicContact CD2-CD2 3.39Å; F75-L218 HydrophobicContact CE2-CD2 3.91Å; F75-L218 HydrophobicContact CG-CD2 3.46Å; F75-L218 VanDerWaalsContact CG-CD2 3.46Å; F75-L218 HydrophobicContact CZ-CD2 4.44Å; F75-N221 PolarHBondContact O-ND2 3.38Å; F75-L233 HydrophobicContact CB-CD1 4.26Å; F75-L233 HydrophobicContact CD1-CD1 3.77Å; F75-L233 HydrophobicContact CG-CD1 4.49Å; F75-L238 HydrophobicContact CD1-CD1 4.38Å; F75-L238 HydrophobicContact CE1-CD1 4.19Å
76	G	96.9	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.			trans	-86.4	-174.3	175.4	0	0	0	0	0	114	H72 G73 L74 N80	H72-G76 PolarHBondContact CE1-O 3.01Å; H72-G76 VanDerWaalsContact CE1-O 3.31Å; H72-G76 VanDerWaalsContact ND1-C 3.31Å; H72-G76 PolarHBondContact ND1-O 3.39Å; G73-G76 WeakPolarHBondContact O-CA 3.49Å; G73-G76 PolarHBondContact O-N 3.4Å; L74-G76 PolarHBondContact O-N 2.91Å; L74-G76 VanDerWaalsContact O-N 3.15Å; G76-N80 WeakPolarHBondContact CA-OD1 3.35Å
77	C	98.1	Very high	97.2	Very high	4 Å²	4	25 Å²	25	3%	0.027	14%	0.141	C	C	.	.			trans	-155.7	167.4	168	57.7	0	0	0	0	109.8	H72 T79 N80 D100	H72-C77 VanDerWaalsContact CD2-C 3.46Å; H72-C77 VanDerWaalsContact CD2-CA 3.41Å; H72-C77 WeakPolarHBondContact CD2-CA 3.41Å; C77-T79 PolarHBondContact O-N 2.68Å; C77-T79 PolarHBondContact SG-OG1 3.4Å; C77-N80 PolarHBondContact N-OD1 3.31Å; C77-N80 VanDerWaalsContact O-CB 3.29Å; C77-N80 WeakPolarHBondContact O-CB 3.44Å; C77-N80 PolarHBondContact O-N 2.81Å; C77-N80 PolarHBondContact O-OD1 3.47Å; C77-D100 WeakPolarHBondContact CA-OD1 2.73Å; C77-D100 VanDerWaalsContact CB-OD1 3.23Å; C77-D100 WeakPolarHBondContact CB-OD1 3.02Å
78	K	97.8	Very high	97	Very high	14 Å²	14	25 Å²	25	6%	0.061	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-51	-30.1	-178.8	70.9	179.7	175.8	-86.3	0	113.6	S55 N80 F81 D100	S55-K78 PolarHBondContact OG-NZ 3.24Å; K78-N80 PolarHBondContact O-N 2.98Å; K78-F81 PolarHBondContact O-N 3.38Å; K78-D100 WeakPolarHBondContact CB-OD1 3.41Å; K78-D100 WeakPolarHBondContact CG-OD1 3.39Å; K78-D100 PolarHBondContact N-OD1 3.18Å; K78-D100 IonicContact NZ-OD2 2.77Å; K78-D100 PolarHBondContact NZ-OD2 3.37Å
79	T	97	Very high	96.9	Very high	70 Å²	70	25.6 Å²	25.6	43%	0.429	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-69.5	-14.8	179.7	62.3	0	0	0	0	113.7	C77 F81 N82	C77-T79 PolarHBondContact O-N 2.68Å; C77-T79 PolarHBondContact SG-OG1 3.4Å; T79-F81 PolarHBondContact O-N 3.45Å; T79-N82 PolarHBondContact O-N 2.89Å; T79-N82 VanDerWaalsContact O-N 3.13Å
80	N	96.3	Very high	96.6	Very high	52 Å²	52	33.8 Å²	33.8	28%	0.278	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-58.4	-25.5	171.4	-63.8	141.1	0	0	0	112.2	G76 C77 K78	G76-N80 WeakPolarHBondContact CA-OD1 3.35Å; C77-N80 PolarHBondContact N-OD1 3.31Å; C77-N80 VanDerWaalsContact O-CB 3.29Å; C77-N80 WeakPolarHBondContact O-CB 3.44Å; C77-N80 PolarHBondContact O-N 2.81Å; C77-N80 PolarHBondContact O-OD1 3.47Å; K78-N80 PolarHBondContact O-N 2.98Å
81	F	97.2	Very high	96.4	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-103	6.7	178.1	-64.4	-72.6	0	0	0	114.2	F70 H72 K78 T79 S83 I84 A85 T98 H139 H298 F305	F70-F81 HydrophobicContact CB-CB 4.16Å; F70-F81 HydrophobicContact CB-CD1 4.36Å; F70-F81 HydrophobicContact CB-CD2 3.72Å; F70-F81 HydrophobicContact CB-CE2 4.12Å; F70-F81 HydrophobicContact CB-CG 3.83Å; F70-F81 AromaticContact CD1-CD1 3.69Å; F70-F81 HydrophobicContact CD1-CD1 3.69Å; F70-F81 AromaticContact CD1-CE1 3.88Å; F70-F81 HydrophobicContact CD1-CE1 3.88Å; F70-F81 HydrophobicContact CD1-CG 4.03Å; F70-F81 HydrophobicContact CD1-CZ 4.35Å; F70-F81 HydrophobicContact CE1-CD1 4.33Å; F70-F81 HydrophobicContact CG-CB 4.33Å; F70-F81 HydrophobicContact CG-CD1 4.23Å; F70-F81 HydrophobicContact CG-CD2 4.45Å; F70-F81 HydrophobicContact CG-CG 4.1Å; H72-F81 HydrophobicContact CB-CE2 4.1Å; K78-F81 PolarHBondContact O-N 3.38Å; T79-F81 PolarHBondContact O-N 3.45Å; F81-S83 PolarHBondContact O-N 3.41Å; F81-I84 HydrophobicContact CD1-CB 4.48Å; F81-I84 CarbonylContact O-C 3.6Å; F81-I84 PolarHBondContact O-N 3.31Å; F81-I84 VanDerWaalsContact O-N 3.16Å; F81-A85 VanDerWaalsContact O-CB 3.25Å; F81-A85 WeakPolarHBondContact O-CB 3.38Å; F81-A85 PolarHBondContact O-N 3.01Å; F81-T98 HydrophobicContact CB-CG2 3.89Å; F81-H139 HydrophobicContact CZ-CB 4.07Å; F81-H298 HydrophobicContact CD1-CB 4.39Å; F81-H298 HydrophobicContact CE1-CB 3.92Å; F81-H298 AromaticContact CE1-CD2 3.89Å; F81-H298 AromaticContact CE1-CG 3.74Å; F81-F305 HydrophobicContact CE1-CE1 4.39Å; F81-F305 HydrophobicContact CE1-CZ 4.26Å
82	N	95.1	Very high	96.1	Very high	64 Å²	64	38.5 Å²	38.5	34%	0.342	21%	0.209	S	C	.	.	H	α-helix	trans	-55	-49.6	-172.2	-86	-4.2	0	0	0	113.9	T79 K86	T79-N82 PolarHBondContact O-N 2.89Å; T79-N82 VanDerWaalsContact O-N 3.13Å; N82-K86 WeakPolarHBondContact O-CG 3.18Å; N82-K86 PolarHBondContact O-N 2.9Å
83	S	96.2	Very high	95.8	Very high	102 Å²	102	39.2 Å²	39.2	71%	0.713	22%	0.218	S	C	*	.	H	α-helix	trans	-68.5	-39.9	179.8	-56.7	0	0	0	0	111.6	F81 A87	F81-S83 PolarHBondContact O-N 3.41Å; S83-A87 WeakPolarHBondContact O-CB 2.95Å; S83-A87 PolarHBondContact O-N 2.62Å
84	I	96.8	Very high	95.8	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-50.7	176.1	-63.3	-61.4	0	0	0	110.5	F70 F81 K86 A87 F88 P302 F305 I306	F70-I84 HydrophobicContact CE1-CG2 4.09Å; F70-I84 HydrophobicContact CZ-CG2 4Å; F81-I84 HydrophobicContact CD1-CB 4.48Å; F81-I84 CarbonylContact O-C 3.6Å; F81-I84 PolarHBondContact O-N 3.31Å; F81-I84 VanDerWaalsContact O-N 3.16Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.42Å; I84-A87 PolarHBondContact O-N 3.34Å; I84-F88 WeakPolarHBondContact O-CB 3.21Å; I84-F88 PolarHBondContact O-N 2.71Å; I84-P302 HydrophobicContact CD1-CB 3.67Å; I84-F305 HydrophobicContact CD1-CD1 4.26Å; I84-F305 HydrophobicContact CG2-CD1 4.12Å; I84-F305 HydrophobicContact CG2-CE1 3.94Å; I84-I306 HydrophobicContact CD1-CD1 3.79Å; I84-I306 HydrophobicContact CD1-CG1 3.98Å; I84-I306 HydrophobicContact CG2-CG1 4.17Å
85	A	96.2	Very high	95.8	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-44	-178.3	0	0	0	0	0	111.8	L59 F81 F88 A89 V96 T98	L59-A85 HydrophobicContact CD1-CB 3.88Å; F81-A85 VanDerWaalsContact O-CB 3.25Å; F81-A85 WeakPolarHBondContact O-CB 3.38Å; F81-A85 PolarHBondContact O-N 3.01Å; A85-F88 PolarHBondContact O-N 2.81Å; A85-A89 VanDerWaalsContact O-CB 3.27Å; A85-A89 WeakPolarHBondContact O-CB 3.31Å; A85-A89 PolarHBondContact O-N 3.09Å; A85-V96 HydrophobicContact CB-CB 4.47Å; A85-V96 HydrophobicContact CB-CG1 3.61Å; A85-T98 HydrophobicContact CB-CG2 3.78Å
86	K	96.3	Very high	95.8	Very high	139 Å²	139	41.5 Å²	41.5	60%	0.604	22%	0.224	S	C	*	.	H	α-helix	trans	-63.4	-49.8	176.3	-72.4	178.2	-178.6	-174.8	0	112.1	L59 N82 I84 F88 Q90	L59-K86 HydrophobicContact CD1-CB 4.47Å; L59-K86 HydrophobicContact CD1-CG 3.91Å; N82-K86 WeakPolarHBondContact O-CG 3.18Å; N82-K86 PolarHBondContact O-N 2.9Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.42Å; K86-F88 VanDerWaalsContact C-N 3.31Å; K86-F88 PolarHBondContact O-N 3.49Å; K86-Q90 WeakPolarHBondContact O-CB 3.33Å; K86-Q90 PolarHBondContact O-N 3.44Å
87	A	95.1	Very high	95.9	Very high	27 Å²	27	41.5 Å²	41.5	22%	0.223	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-43.1	178.5	0	0	0	0	0	111.1	S83 I84 Q90 Q91 I306	S83-A87 WeakPolarHBondContact O-CB 2.95Å; S83-A87 PolarHBondContact O-N 2.62Å; I84-A87 PolarHBondContact O-N 3.34Å; A87-Q90 PolarHBondContact O-N 3.34Å; A87-Q91 WeakPolarHBondContact O-CB 3.15Å; A87-Q91 WeakPolarHBondContact O-CG 3.45Å; A87-Q91 PolarHBondContact O-N 3.22Å; A87-I306 HydrophobicContact CB-CD1 3.88Å
88	F	93.4	Very high	96	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-46.9	-178.9	-161.9	-84.2	0	0	0	112.3	V68 I84 A85 K86 Q90 Q91 T92 V96 I306 I309 R310 L313	V68-F88 HydrophobicContact CB-CE1 4.31Å; V68-F88 HydrophobicContact CG1-CE1 4.47Å; V68-F88 HydrophobicContact CG2-CD1 4.35Å; V68-F88 HydrophobicContact CG2-CE1 3.64Å; V68-F88 HydrophobicContact CG2-CZ 4.37Å; I84-F88 WeakPolarHBondContact O-CB 3.21Å; I84-F88 PolarHBondContact O-N 2.71Å; A85-F88 PolarHBondContact O-N 2.81Å; K86-F88 VanDerWaalsContact C-N 3.31Å; K86-F88 PolarHBondContact O-N 3.49Å; F88-Q90 VanDerWaalsContact C-N 3.32Å; F88-Q90 PolarHBondContact O-N 2.79Å; F88-Q91 PolarHBondContact O-N 2.66Å; F88-T92 HydrophobicContact CD1-CG2 4Å; F88-T92 WeakPolarHBondContact CD1-OG1 3.29Å; F88-T92 HydrophobicContact CE1-CG2 3.62Å; F88-T92 WeakPolarHBondContact CE1-OG1 3.49Å; F88-T92 HydrophobicContact CE2-CG2 4.22Å; F88-T92 HydrophobicContact CG-CG2 4.43Å; F88-T92 HydrophobicContact CZ-CG2 3.75Å; F88-T92 WeakPolarHBondContact O-CB 3.32Å; F88-T92 WeakPolarHBondContact O-CG2 3.48Å; F88-T92 PolarHBondContact O-N 3.35Å; F88-T92 PolarHBondContact O-OG1 3.38Å; F88-V96 HydrophobicContact CD1-CG2 4.09Å; F88-I306 HydrophobicContact CD2-CG2 4.16Å; F88-I309 HydrophobicContact CD2-CG2 4.44Å; F88-I309 HydrophobicContact CE2-CB 3.9Å; F88-I309 HydrophobicContact CE2-CG2 3.36Å; F88-I309 HydrophobicContact CZ-CG2 3.53Å; F88-R310 HydrophobicContact CD2-CG 4.3Å; F88-R310 HydrophobicContact CE2-CG 3.63Å; F88-R310 HydrophobicContact CZ-CG 4.13Å; F88-L313 HydrophobicContact CE1-CD1 4.12Å; F88-L313 HydrophobicContact CZ-CD1 3.65Å
89	A	94.7	Very high	96	Very high	14 Å²	14	41 Å²	41	12%	0.116	22%	0.221	C	C	.	.	H	α-helix	trans	-58.1	-46.2	175.1	0	0	0	0	0	110.7	L59 A85 Q91 G93 V96	L59-A89 HydrophobicContact CB-CB 4.35Å; L59-A89 HydrophobicContact CD1-CB 4.33Å; A85-A89 VanDerWaalsContact O-CB 3.27Å; A85-A89 WeakPolarHBondContact O-CB 3.31Å; A85-A89 PolarHBondContact O-N 3.09Å; A89-Q91 PolarHBondContact O-N 2.77Å; A89-G93 WeakPolarHBondContact O-CA 3.24Å; A89-G93 PolarHBondContact O-N 3.43Å; A89-V96 HydrophobicContact CB-CB 4.48Å; A89-V96 HydrophobicContact CB-CG2 3.83Å
90	Q	94.3	Very high	96.1	Very high	172 Å²	172	37.7 Å²	37.7	80%	0.804	20%	0.201	S	C	*	.	H	α-helix	trans	-62.5	-39	178.1	-174.2	-179.9	10.7	0	0	113	K86 A87 F88	K86-Q90 WeakPolarHBondContact O-CB 3.33Å; K86-Q90 PolarHBondContact O-N 3.44Å; A87-Q90 PolarHBondContact O-N 3.34Å; F88-Q90 VanDerWaalsContact C-N 3.32Å; F88-Q90 PolarHBondContact O-N 2.79Å
91	Q	92.6	Very high	96.2	Very high	77 Å²	77	36.1 Å²	36.1	36%	0.36	20%	0.195	S	C	.	.	H	α-helix	trans	-83.9	-23.2	-175.4	-72.3	175.2	7	0	0	114.3	A87 F88 A89 I306	A87-Q91 WeakPolarHBondContact O-CB 3.15Å; A87-Q91 WeakPolarHBondContact O-CG 3.45Å; A87-Q91 PolarHBondContact O-N 3.22Å; F88-Q91 PolarHBondContact O-N 2.66Å; A89-Q91 PolarHBondContact O-N 2.77Å; Q91-I306 VanDerWaalsContact OE1-CG2 3.25Å
92	T	92.9	Very high	96.2	Very high	32 Å²	32	36.2 Å²	36.2	20%	0.196	20%	0.196	C	C	.	.	H	α-helix	trans	-115.1	-14.1	-173.8	64.5	0	0	0	0	113.8	L65 F88 R94 R310	L65-T92 WeakPolarHBondContact CD1-O 3.41Å; F88-T92 HydrophobicContact CD1-CG2 4Å; F88-T92 WeakPolarHBondContact CD1-OG1 3.29Å; F88-T92 HydrophobicContact CE1-CG2 3.62Å; F88-T92 WeakPolarHBondContact CE1-OG1 3.49Å; F88-T92 HydrophobicContact CE2-CG2 4.22Å; F88-T92 HydrophobicContact CG-CG2 4.43Å; F88-T92 HydrophobicContact CZ-CG2 3.75Å; F88-T92 WeakPolarHBondContact O-CB 3.32Å; F88-T92 WeakPolarHBondContact O-CG2 3.48Å; F88-T92 PolarHBondContact O-N 3.35Å; F88-T92 PolarHBondContact O-OG1 3.38Å; T92-R94 PolarHBondContact O-N 3.28Å; T92-R94 VanDerWaalsContact O-N 3.16Å; T92-R94 WeakPolarHBondContact OG1-CB 3.38Å; T92-R94 PolarHBondContact OG1-N 3.21Å; T92-R310 HydrophobicContact CG2-CG 3.82Å
93	G	93.8	Very high	96.4	Very high	19 Å²	19	33.1 Å²	33.1	20%	0.196	18%	0.179	C	C	.	.			trans	67.5	3.7	-171.3	0	0	0	0	0	113.5	G61 E62 A89	G61-G93 CarbonylContact C-O 3.53Å; G61-G93 VanDerWaalsContact CA-O 3.26Å; G61-G93 WeakPolarHBondContact CA-O 3.24Å; E62-G93 PolarHBondContact N-O 3.01Å; A89-G93 WeakPolarHBondContact O-CA 3.24Å; A89-G93 PolarHBondContact O-N 3.43Å
94	R	96.1	Very high	96.5	Very high	24 Å²	24	28.3 Å²	28.3	9%	0.091	15%	0.145	C	C	.	.			trans	-78.4	147.1	-178.2	-67.5	177.4	177.8	-101.1	4.1	111.5	L65 P66 V68 T92	L65-R94 HydrophobicContact CB-CG 3.77Å; L65-R94 HydrophobicContact CD1-CG 3.88Å; L65-R94 HydrophobicContact CG-CG 4.49Å; P66-R94 VanDerWaalsContact CD-NH1 3.26Å; P66-R94 PolarHBondContact O-NH1 3.05Å; V68-R94 HydrophobicContact CG2-CB 4.27Å; T92-R94 PolarHBondContact O-N 3.28Å; T92-R94 VanDerWaalsContact O-N 3.16Å; T92-R94 WeakPolarHBondContact OG1-CB 3.38Å; T92-R94 PolarHBondContact OG1-N 3.21Å
95	R	97.8	Very high	96.5	Very high	51 Å²	51	28.1 Å²	28.1	19%	0.192	15%	0.146	C	C	.	.			trans	-60.1	136.2	162.1	-70.1	-176.8	-70.5	166.8	1.9	109.3	L58 L59 A67 V68 G130	L58-R95 HydrophobicContact CD1-CB 4.42Å; L59-R95 CarbonylContact O-C 3.6Å; L59-R95 WeakPolarHBondContact O-CA 3.39Å; A67-R95 CarbonylContact C-O 3.53Å; A67-R95 WeakPolarHBondContact CA-O 3.26Å; A67-R95 HydrophobicContact CB-CB 3.97Å; V68-R95 PolarHBondContact N-O 2.87Å; R95-G130 PolarHBondContact NH1-O 3.46Å; R95-G130 PolarHBondContact NH2-O 2.89Å
96	V	98.3	Very high	96.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.2	179.9	-177.5	0	0	0	0	110.8	L59 V68 F70 A85 F88 A89	L59-V96 HydrophobicContact CB-CB 4.37Å; L59-V96 PolarHBondContact N-O 2.85Å; L59-V96 PolarHBondContact O-N 3Å; V68-V96 CarbonylContact O-C 3.57Å; V68-V96 WeakPolarHBondContact O-CA 3.27Å; F70-V96 HydrophobicContact CD2-CG1 3.57Å; F70-V96 HydrophobicContact CE2-CG1 3.6Å; A85-V96 HydrophobicContact CB-CB 4.47Å; A85-V96 HydrophobicContact CB-CG1 3.61Å; F88-V96 HydrophobicContact CD1-CG2 4.09Å; A89-V96 HydrophobicContact CB-CB 4.48Å; A89-V96 HydrophobicContact CB-CG2 3.83Å
97	L	98.6	Very high	96.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.6	174.7	-169.3	73.9	0	0	0	109.7	Y56 S57 L58 V68 I69 F70 V99 L125 L126 L129 L131	Y56-L97 HydrophobicContact CD2-CD1 3.42Å; Y56-L97 VanDerWaalsContact CD2-CD1 3.42Å; Y56-L97 HydrophobicContact CE2-CD1 4.22Å; Y56-L97 HydrophobicContact CG-CD1 3.83Å; S57-L97 WeakPolarHBondContact O-CA 3.23Å; L58-L97 HydrophobicContact CB-CD1 3.91Å; L58-L97 HydrophobicContact CD1-CB 4.32Å; L58-L97 HydrophobicContact CD1-CD1 4.07Å; V68-L97 PolarHBondContact O-N 3.18Å; I69-L97 CarbonylContact C-O 3.48Å; I69-L97 WeakPolarHBondContact CA-O 3.48Å; I69-L97 HydrophobicContact CD1-CB 3.51Å; I69-L97 HydrophobicContact CD1-CD2 3.89Å; I69-L97 HydrophobicContact CD1-CG 4.33Å; I69-L97 HydrophobicContact CG2-CB 4.32Å; I69-L97 HydrophobicContact CG2-CD2 4.05Å; F70-L97 PolarHBondContact N-O 3.1Å; L97-V99 HydrophobicContact CD2-CG2 3.49Å; L97-V99 VanDerWaalsContact CD2-CG2 3.49Å; L97-V99 HydrophobicContact CG-CG2 3.69Å; L97-L125 HydrophobicContact CD2-CD2 4.32Å; L97-L126 HydrophobicContact CD2-CD2 3.99Å; L97-L129 HydrophobicContact CD1-CD1 4.02Å; L97-L129 HydrophobicContact CD2-CD1 4.04Å; L97-L131 HydrophobicContact CB-CD1 4.26Å; L97-L131 HydrophobicContact CD1-CD1 4.34Å; L97-L131 HydrophobicContact CD2-CD1 3.81Å; L97-L131 HydrophobicContact CG-CD1 4.37Å
98	T	98.8	Very high	96.7	Very high	3 Å²	3	28 Å²	28	2%	0.018	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.9	164.8	65.8	0	0	0	0	109	Y56 S57 F70 F81 A85	Y56-T98 CarbonylContact C-O 3.51Å; Y56-T98 WeakPolarHBondContact CA-O 3.45Å; Y56-T98 WeakPolarHBondContact CB-O 3.23Å; S57-T98 PolarHBondContact N-O 3.26Å; S57-T98 PolarHBondContact O-N 3.4Å; F70-T98 HydrophobicContact CB-CG2 4.16Å; F81-T98 HydrophobicContact CB-CG2 3.89Å; A85-T98 HydrophobicContact CB-CG2 3.78Å
99	V	98.5	Very high	96.8	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.1	-170.7	-172.3	0	0	0	0	110.4	L54 I69 F70 L71 H72 L97 L125	L54-V99 HydrophobicContact CB-CG1 3.98Å; L54-V99 HydrophobicContact CD1-CG1 3.63Å; L54-V99 HydrophobicContact CG-CG1 4.47Å; I69-V99 HydrophobicContact CG2-CG2 4.16Å; F70-V99 PolarHBondContact O-N 2.71Å; L71-V99 HydrophobicContact CD2-CB 4.12Å; L71-V99 HydrophobicContact CD2-CG2 4.38Å; H72-V99 PolarHBondContact CD2-O 2.68Å; H72-V99 VanDerWaalsContact CD2-O 3.24Å; L97-V99 HydrophobicContact CD2-CG2 3.49Å; L97-V99 VanDerWaalsContact CD2-CG2 3.49Å; L97-V99 HydrophobicContact CG-CG2 3.69Å; V99-L125 HydrophobicContact CG1-CD2 4.03Å; V99-L125 HydrophobicContact CG2-CD2 4.12Å
100	D	98.8	Very high	96.9	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.011	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-81.7	121.7	164.7	-76.2	-32.5	0	0	0	108.6	S55 C77 K78 N106 S107	S55-D100 WeakPolarHBondContact O-CB 3.23Å; S55-D100 PolarHBondContact O-N 3.16Å; C77-D100 WeakPolarHBondContact CA-OD1 2.73Å; C77-D100 VanDerWaalsContact CB-OD1 3.23Å; C77-D100 WeakPolarHBondContact CB-OD1 3.02Å; K78-D100 WeakPolarHBondContact CB-OD1 3.41Å; K78-D100 WeakPolarHBondContact CG-OD1 3.39Å; K78-D100 PolarHBondContact N-OD1 3.18Å; K78-D100 IonicContact NZ-OD2 2.77Å; K78-D100 PolarHBondContact NZ-OD2 3.37Å; D100-N106 PolarHBondContact OD2-N 3.26Å; D100-S107 VanDerWaalsContact CB-OG 3.25Å; D100-S107 WeakPolarHBondContact CB-OG 3.48Å; D100-S107 WeakPolarHBondContact O-CB 3.48Å; D100-S107 PolarHBondContact O-OG 2.81Å
101	A	98.4	Very high	97	Very high	19 Å²	19	28.3 Å²	28.3	16%	0.157	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-62.5	156.8	170.8	0	0	0	0	0	110.2	H72 H104 S107 M118 M141	H72-A101 PolarHBondContact NE2-N 3.45Å; A101-H104 WeakPolarHBondContact O-CB 3.4Å; A101-H104 PolarHBondContact O-N 2.96Å; A101-H104 VanDerWaalsContact O-N 3.11Å; A101-S107 VanDerWaalsContact O-CB 3.29Å; A101-S107 WeakPolarHBondContact O-CB 3.24Å; A101-M118 HydrophobicContact CB-SD 4.26Å; A101-M141 HydrophobicContact CB-CE 3.7Å
102	R	98	Very high	97.1	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.008	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	150.5	168.4	63.5	170.9	55	-149.5	0.3	111.3	L52 L54 H104 D112 M118 D121	L52-R102 HydrophobicContact CD1-CB 3.58Å; L54-R102 HydrophobicContact CD2-CB 4.44Å; R102-H104 PolarHBondContact O-N 2.77Å; R102-H104 PolarHBondContact O-ND1 3.27Å; R102-D112 WeakPolarHBondContact CD-O 3.08Å; R102-D112 PolarHBondContact NH1-O 3.3Å; R102-M118 HydrophobicContact CG-CG 3.91Å; R102-D121 IonicContact CZ-OD1 3.59Å; R102-D121 IonicContact CZ-OD2 3.56Å; R102-D121 VanDerWaalsContact CZ-OD2 3.32Å; R102-D121 IonicContact NE-OD1 3.81Å; R102-D121 IonicContact NE-OD2 2.71Å; R102-D121 PolarHBondContact NE-OD2 3.38Å; R102-D121 VanDerWaalsContact NH2-CG 3.25Å; R102-D121 IonicContact NH2-OD1 3.61Å; R102-D121 PolarHBondContact NH2-OD1 3.49Å; R102-D121 IonicContact NH2-OD2 3.73Å; R102-D121 PolarHBondContact NH2-OD2 2.86Å; R102-D121 VanDerWaalsContact NH2-OD2 3.1Å
103	N	98.1	Very high	97.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	6.3	-177.4	-65	-39.6	0	0	0	115.4	P108 H109 S110 M113 L233 N234	N103-P108 PolarHBondContact N-O 3.33Å; N103-H109 WeakPolarHBondContact OD1-CA 3.41Å; N103-S110 PolarHBondContact ND2-O 3.4Å; N103-S110 PolarHBondContact OD1-N 2.97Å; N103-S110 PolarHBondContact OD1-O 2.73Å; N103-M113 HydrophobicContact CB-SD 4.21Å; N103-L233 WeakPolarHBondContact O-CA 3.4Å; N103-N234 HydrophobicContact CB-CB 3.77Å; N103-N234 PolarHBondContact O-N 2.71Å; N103-N234 VanDerWaalsContact O-N 3.15Å; N103-N234 VanDerWaalsContact OD1-CB 3.3Å; N103-N234 WeakPolarHBondContact OD1-CB 3.27Å; N103-N234 PolarHBondContact OD1-ND2 2.51Å
104	H	98.3	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-130	159.6	-179.8	-66.5	74.6	0	0	0	111.5	H72 F75 A101 R102 N106 S107 L233	H72-H104 VanDerWaalsContact CE1-CB 3.45Å; H72-H104 WeakPolarHBondContact CE1-CB 3.47Å; H72-H104 AromaticContact CE1-CD2 3.64Å; H72-H104 AromaticContact CE1-CG 3.57Å; F75-H104 PolarHBondContact N-NE2 3.47Å; F75-H104 VanDerWaalsContact N-NE2 3.2Å; A101-H104 WeakPolarHBondContact O-CB 3.4Å; A101-H104 PolarHBondContact O-N 2.96Å; A101-H104 VanDerWaalsContact O-N 3.11Å; R102-H104 PolarHBondContact O-N 2.77Å; R102-H104 PolarHBondContact O-ND1 3.27Å; H104-N106 PolarHBondContact O-N 3.4Å; H104-S107 PolarHBondContact O-N 3.02Å; H104-S107 VanDerWaalsContact O-N 3.09Å; H104-L233 HydrophobicContact CB-CD2 4.3Å; H104-L233 WeakPolarHBondContact CD2-CD2 3.47Å
105	G	97.1	Very high	97.4	Very high	5 Å²	5	24.8 Å²	24.8	5%	0.052	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-133.5	172.3	0	0	0	0	0	112.5	R232	G105-R232 VanDerWaalsContact CA-CD 3.49Å; G105-R232 WeakPolarHBondContact O-CD 3.45Å; G105-R232 WeakPolarHBondContact O-CG 3.46Å
106	N	97	Very high	97.4	Very high	113 Å²	113	26.1 Å²	26.1	60%	0.604	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	7.2	175.8	-59.9	-18.3	0	0	0	112.4	D100 H104	D100-N106 PolarHBondContact OD2-N 3.26Å; H104-N106 PolarHBondContact O-N 3.4Å
107	S	98.1	Very high	97.3	Very high	5 Å²	5	27.2 Å²	27.2	4%	0.035	15%	0.152	C	C	.	.	S	Bend	trans	-72.3	149.2	173.8	-76.8	0	0	0	0	110.4	L54 S55 D100 A101 H104	L54-S107 WeakPolarHBondContact CA-OG 3.31Å; S55-S107 PolarHBondContact N-OG 3.47Å; D100-S107 VanDerWaalsContact CB-OG 3.25Å; D100-S107 WeakPolarHBondContact CB-OG 3.48Å; D100-S107 WeakPolarHBondContact O-CB 3.48Å; D100-S107 PolarHBondContact O-OG 2.81Å; A101-S107 VanDerWaalsContact O-CB 3.29Å; A101-S107 WeakPolarHBondContact O-CB 3.24Å; H104-S107 PolarHBondContact O-N 3.02Å; H104-S107 VanDerWaalsContact O-N 3.09Å
108	P	96.6	Very high	97.3	Very high	47 Å²	47	27.4 Å²	27.4	31%	0.305	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-56	147.6	-179.9	-26.4	35.1	0	0	0	113.2	L52 P53 N103	L52-P108 HydrophobicContact CD2-CB 4.25Å; P53-P108 HydrophobicContact CG-CG 4.03Å; P53-P108 VanDerWaalsContact O-CD 3.28Å; P53-P108 WeakPolarHBondContact O-CD 3.42Å; N103-P108 PolarHBondContact N-O 3.33Å
109	H	96.4	Very high	97.3	Very high	99 Å²	99	27.3 Å²	27.3	46%	0.458	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-78.7	140.2	169.3	-70.7	-168.5	0	0	0	109.8	N103 R232 N234	N103-H109 WeakPolarHBondContact OD1-CA 3.41Å; H109-R232 PolarHBondContact CE1-O 2.98Å; H109-R232 PolarHBondContact NE2-O 3.46Å; H109-N234 HydrophobicContact CB-CB 4.21Å
110	S	96.6	Very high	97.2	Very high	11 Å²	11	31.1 Å²	31.1	8%	0.077	17%	0.17	C	C	.	.			trans	-138.9	144.7	175.4	172	0	0	0	0	109.4	N103 D112 N234 A237	N103-S110 PolarHBondContact ND2-O 3.4Å; N103-S110 PolarHBondContact OD1-N 2.97Å; N103-S110 PolarHBondContact OD1-O 2.73Å; S110-D112 PolarHBondContact O-N 3.08Å; S110-D112 PolarHBondContact OG-N 3.33Å; S110-N234 PolarHBondContact O-ND2 2.93Å; S110-N234 VanDerWaalsContact O-ND2 3.12Å; S110-A237 WeakPolarHBondContact O-CB 3.49Å
111	P	96.1	Very high	97.2	Very high	83 Å²	83	31.2 Å²	31.2	54%	0.539	17%	0.17	S	C	.	.	S	Bend	trans	-63.9	-21.3	172.9	29.2	-36.3	0	0	0	112.3	H241	P111-H241 PolarHBondContact O-CD2 3.5Å; P111-H241 VanDerWaalsContact O-CD2 3.3Å; P111-H241 PolarHBondContact O-NE2 3.09Å
112	D	94.8	Very high	97.2	Very high	64 Å²	64	30.5 Å²	30.5	34%	0.342	16%	0.164	S	C	.	.			trans	-99.2	134.6	-173.4	-54.4	-55.4	0	0	0	112.7	R102 S110 I117	R102-D112 WeakPolarHBondContact CD-O 3.08Å; R102-D112 PolarHBondContact NH1-O 3.3Å; S110-D112 PolarHBondContact O-N 3.08Å; S110-D112 PolarHBondContact OG-N 3.33Å; D112-I117 HydrophobicContact CB-CD1 3.88Å
113	M	94.8	Very high	97.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.168	C	C	.	.			trans	-151.2	124.7	176.1	-165.3	167.6	177.6	0	0	111.6	N103 M118 M141 L238 H241 L245	N103-M113 HydrophobicContact CB-SD 4.21Å; M113-M118 HydrophobicContact CE-CE 4.22Å; M113-M118 HydrophobicContact CE-SD 3.81Å; M113-M141 HydrophobicContact CE-SD 3.61Å; M113-L238 HydrophobicContact CE-CD2 4Å; M113-L238 HydrophobicContact SD-CD2 3.67Å; M113-H241 HydrophobicContact CB-CB 4.1Å; M113-H241 VanDerWaalsContact O-CB 3.31Å; M113-H241 WeakPolarHBondContact O-CB 3.35Å; M113-L245 HydrophobicContact CE-CD1 3.47Å; M113-L245 VanDerWaalsContact CE-CD1 3.47Å; M113-L245 HydrophobicContact CE-CD2 4.07Å; M113-L245 HydrophobicContact CE-CG 4.4Å; M113-L245 HydrophobicContact CG-CD1 4.38Å; M113-L245 HydrophobicContact CG-CD2 4.34Å; M113-L245 HydrophobicContact SD-CD1 3.89Å
114	S	96.6	Very high	97.1	Very high	8 Å²	8	33.6 Å²	33.6	6%	0.056	18%	0.18	C	C	.	.			trans	-158.1	171.9	168.1	82.9	0	0	0	0	108.8	E116 I117 M118	S114-E116 VanDerWaalsContact CB-OE2 3.24Å; S114-E116 WeakPolarHBondContact CB-OE2 3.38Å; S114-E116 PolarHBondContact OG-N 3.31Å; S114-E116 PolarHBondContact OG-OE2 3.02Å; S114-I117 PolarHBondContact O-N 3.23Å; S114-I117 WeakPolarHBondContact OG-CG1 3.34Å; S114-I117 PolarHBondContact OG-N 3.29Å; S114-M118 WeakPolarHBondContact O-CG 3.19Å; S114-M118 PolarHBondContact O-N 2.68Å
115	Y	97.7	Very high	97.1	Very high	5 Å²	5	34.4 Å²	34.4	2%	0.02	18%	0.184	C	C	.	.	H	α-helix	trans	-67.1	-37.8	175.1	-69.9	-61.6	0	0	0	112.4	I117 M118 S119 M141 R144 L148 K244 L245 T247	Y115-I117 VanDerWaalsContact C-N 3.27Å; Y115-I117 PolarHBondContact O-N 2.87Å; Y115-M118 HydrophobicContact CD1-CE 3.53Å; Y115-M118 HydrophobicContact CE1-CE 3.75Å; Y115-M118 HydrophobicContact CG-CE 4.39Å; Y115-M118 PolarHBondContact O-N 3.03Å; Y115-S119 VanDerWaalsContact O-CB 3.27Å; Y115-S119 WeakPolarHBondContact O-CB 3.48Å; Y115-S119 PolarHBondContact O-N 2.77Å; Y115-M141 HydrophobicContact CE1-CG 4.02Å; Y115-M141 WeakPolarHBondContact CE1-O 3.38Å; Y115-R144 HydrophobicContact CD1-CB 3.79Å; Y115-R144 HydrophobicContact CD2-CB 4.47Å; Y115-R144 HydrophobicContact CE1-CB 3.39Å; Y115-R144 HydrophobicContact CE1-CG 4.47Å; Y115-R144 HydrophobicContact CE2-CB 4.1Å; Y115-R144 HydrophobicContact CG-CB 4.32Å; Y115-R144 VanDerWaalsContact CZ-CD 3.47Å; Y115-R144 VanDerWaalsContact OH-CD 3.22Å; Y115-R144 WeakPolarHBondContact OH-CD 3.33Å; Y115-L148 WeakPolarHBondContact O-CD2 3.41Å; Y115-K244 WeakPolarHBondContact CE2-O 3.26Å; Y115-L245 HydrophobicContact CE1-CD2 4.23Å; Y115-L245 HydrophobicContact CE2-CD2 4.31Å; Y115-L245 PolarHBondContact OH-O 3.46Å; Y115-T247 WeakPolarHBondContact CE2-O 3.38Å
116	E	97.1	Very high	97.1	Very high	78 Å²	78	34.2 Å²	34.2	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-57.7	-45.7	176.3	-61.9	78.3	-176.7	0	0	110.6	S114 S119 Q120 L148 P249	S114-E116 VanDerWaalsContact CB-OE2 3.24Å; S114-E116 WeakPolarHBondContact CB-OE2 3.38Å; S114-E116 PolarHBondContact OG-N 3.31Å; S114-E116 PolarHBondContact OG-OE2 3.02Å; E116-S119 WeakPolarHBondContact O-CB 3.15Å; E116-S119 PolarHBondContact O-N 2.86Å; E116-Q120 PolarHBondContact O-N 3.28Å; E116-L148 VanDerWaalsContact CA-CD2 3.49Å; E116-L148 HydrophobicContact CB-CD2 4.34Å; E116-L148 HydrophobicContact CG-CD2 4.07Å; E116-L148 VanDerWaalsContact N-CD2 3.29Å; E116-P249 WeakPolarHBondContact OE1-CB 3.33Å; E116-P249 WeakPolarHBondContact OE1-CG 3.33Å
117	I	97.1	Very high	97.2	Very high	23 Å²	23	31.7 Å²	31.7	12%	0.118	17%	0.172	C	C	.	.	H	α-helix	trans	-67.7	-44.7	-179.1	-67.3	-178.7	0	0	0	111	P49 D112 S114 Y115 S119 Q120 D121	P49-I117 HydrophobicContact CB-CD1 4.02Å; P49-I117 HydrophobicContact CB-CG1 4.04Å; P49-I117 HydrophobicContact CB-CG2 4.16Å; P49-I117 HydrophobicContact CG-CD1 3.75Å; P49-I117 HydrophobicContact CG-CG1 3.69Å; D112-I117 HydrophobicContact CB-CD1 3.88Å; S114-I117 PolarHBondContact O-N 3.23Å; S114-I117 WeakPolarHBondContact OG-CG1 3.34Å; S114-I117 PolarHBondContact OG-N 3.29Å; Y115-I117 VanDerWaalsContact C-N 3.27Å; Y115-I117 PolarHBondContact O-N 2.87Å; I117-S119 VanDerWaalsContact C-N 3.31Å; I117-S119 PolarHBondContact O-N 3.42Å; I117-Q120 WeakPolarHBondContact O-CB 3.48Å; I117-Q120 PolarHBondContact O-N 3.46Å; I117-D121 PolarHBondContact O-N 3.35Å
118	M	98.1	Very high	97.1	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-32.3	176.5	-71.2	-172.1	-66.9	0	0	112.5	A101 R102 M113 S114 Y115 L122 M141 T145 L245	A101-M118 HydrophobicContact CB-SD 4.26Å; R102-M118 HydrophobicContact CG-CG 3.91Å; M113-M118 HydrophobicContact CE-CE 4.22Å; M113-M118 HydrophobicContact CE-SD 3.81Å; S114-M118 WeakPolarHBondContact O-CG 3.19Å; S114-M118 PolarHBondContact O-N 2.68Å; Y115-M118 HydrophobicContact CD1-CE 3.53Å; Y115-M118 HydrophobicContact CE1-CE 3.75Å; Y115-M118 HydrophobicContact CG-CE 4.39Å; Y115-M118 PolarHBondContact O-N 3.03Å; M118-L122 PolarHBondContact O-N 2.94Å; M118-M141 HydrophobicContact CE-CG 3.91Å; M118-M141 HydrophobicContact CE-SD 4.24Å; M118-M141 HydrophobicContact SD-CE 4.26Å; M118-M141 HydrophobicContact SD-CG 4.4Å; M118-M141 HydrophobicContact SD-SD 4.13Å; M118-T145 HydrophobicContact CB-CG2 3.63Å; M118-L245 HydrophobicContact CE-CD2 3.73Å
119	S	98.1	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-46.1	171.1	174.4	0	0	0	0	110.3	Y115 E116 I117 D121 L122 Q123 L149 Q152	Y115-S119 VanDerWaalsContact O-CB 3.27Å; Y115-S119 WeakPolarHBondContact O-CB 3.48Å; Y115-S119 PolarHBondContact O-N 2.77Å; E116-S119 WeakPolarHBondContact O-CB 3.15Å; E116-S119 PolarHBondContact O-N 2.86Å; I117-S119 VanDerWaalsContact C-N 3.31Å; I117-S119 PolarHBondContact O-N 3.42Å; S119-D121 VanDerWaalsContact C-N 3.32Å; S119-D121 PolarHBondContact O-N 2.69Å; S119-L122 WeakPolarHBondContact O-CB 3.36Å; S119-L122 PolarHBondContact O-N 3.05Å; S119-Q123 WeakPolarHBondContact O-CG 3.28Å; S119-Q123 PolarHBondContact O-N 3.44Å; S119-Q123 PolarHBondContact OG-NE2 2.88Å; S119-L149 WeakPolarHBondContact OG-CA 3.49Å; S119-Q152 PolarHBondContact OG-OE1 3.12Å
120	Q	97.9	Very high	97.1	Very high	83 Å²	83	36.1 Å²	36.1	39%	0.388	20%	0.202	S	C	.	.	H	α-helix	trans	-59	-41.5	177.2	-171.2	58.9	48	0	0	112.3	E116 I117 L122 Q123 D124	E116-Q120 PolarHBondContact O-N 3.28Å; I117-Q120 WeakPolarHBondContact O-CB 3.48Å; I117-Q120 PolarHBondContact O-N 3.46Å; Q120-L122 PolarHBondContact O-N 2.93Å; Q120-Q123 WeakPolarHBondContact O-CB 3.25Å; Q120-Q123 PolarHBondContact O-N 3.41Å; Q120-Q123 VanDerWaalsContact O-N 3.07Å; Q120-D124 PolarHBondContact NE2-OD1 2.87Å; Q120-D124 PolarHBondContact O-N 3.27Å
121	D	98.2	Very high	97.1	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.027	20%	0.199	C	C	.	.	H	α-helix	trans	-56.7	-36.6	175.7	-66.3	-36.8	0	0	0	112.5	L54 R102 I117 S119 L125	L54-D121 HydrophobicContact CD1-CB 3.65Å; L54-D121 HydrophobicContact CD2-CB 4.27Å; L54-D121 HydrophobicContact CG-CB 4.05Å; R102-D121 IonicContact CZ-OD1 3.59Å; R102-D121 IonicContact CZ-OD2 3.56Å; R102-D121 VanDerWaalsContact CZ-OD2 3.32Å; R102-D121 IonicContact NE-OD1 3.81Å; R102-D121 IonicContact NE-OD2 2.71Å; R102-D121 PolarHBondContact NE-OD2 3.38Å; R102-D121 VanDerWaalsContact NH2-CG 3.25Å; R102-D121 IonicContact NH2-OD1 3.61Å; R102-D121 PolarHBondContact NH2-OD1 3.49Å; R102-D121 IonicContact NH2-OD2 3.73Å; R102-D121 PolarHBondContact NH2-OD2 2.86Å; R102-D121 VanDerWaalsContact NH2-OD2 3.1Å; I117-D121 PolarHBondContact O-N 3.35Å; S119-D121 VanDerWaalsContact C-N 3.32Å; S119-D121 PolarHBondContact O-N 2.69Å; D121-L125 VanDerWaalsContact O-CB 3.26Å; D121-L125 WeakPolarHBondContact O-CB 3.49Å; D121-L125 PolarHBondContact O-N 2.61Å
122	L	98.4	Very high	97.2	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-76	-36.1	176.8	-63.1	177.5	0	0	0	112.4	L54 L71 M118 S119 Q120 D124 L125 L126 T145 L149	L54-L122 HydrophobicContact CD1-CD2 4.4Å; L71-L122 HydrophobicContact CD1-CD1 3.51Å; L71-L122 HydrophobicContact CD2-CD1 4.05Å; L71-L122 HydrophobicContact CD2-CD2 3.91Å; L71-L122 HydrophobicContact CG-CD1 4.43Å; M118-L122 PolarHBondContact O-N 2.94Å; S119-L122 WeakPolarHBondContact O-CB 3.36Å; S119-L122 PolarHBondContact O-N 3.05Å; Q120-L122 PolarHBondContact O-N 2.93Å; L122-D124 PolarHBondContact O-N 3.16Å; L122-L125 PolarHBondContact O-N 2.85Å; L122-L126 HydrophobicContact CB-CD1 4.18Å; L122-L126 WeakPolarHBondContact O-CB 3.41Å; L122-L126 VanDerWaalsContact O-CG 3.24Å; L122-L126 WeakPolarHBondContact O-CG 3.29Å; L122-L126 PolarHBondContact O-N 2.83Å; L122-T145 HydrophobicContact CD1-CG2 3.82Å; L122-L149 HydrophobicContact CB-CD1 4.45Å; L122-L149 HydrophobicContact CB-CD2 4.04Å; L122-L149 HydrophobicContact CD1-CD2 4.06Å
123	Q	97.9	Very high	97.3	Very high	18 Å²	18	34.6 Å²	34.6	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-33.6	173.3	-66.4	178.8	61	0	0	111.7	S119 Q120 P127 L149 R153 L156	S119-Q123 WeakPolarHBondContact O-CG 3.28Å; S119-Q123 PolarHBondContact O-N 3.44Å; S119-Q123 PolarHBondContact OG-NE2 2.88Å; Q120-Q123 WeakPolarHBondContact O-CB 3.25Å; Q120-Q123 PolarHBondContact O-N 3.41Å; Q120-Q123 VanDerWaalsContact O-N 3.07Å; Q123-P127 WeakPolarHBondContact O-CD 3.29Å; Q123-P127 VanDerWaalsContact O-CG 3.23Å; Q123-P127 WeakPolarHBondContact O-CG 3.43Å; Q123-L149 HydrophobicContact CG-CD1 3.51Å; Q123-R153 HydrophobicContact CG-CG 3.76Å; Q123-R153 VanDerWaalsContact OE1-CD 3.31Å; Q123-L156 HydrophobicContact CB-CD1 4.39Å; Q123-L156 HydrophobicContact CG-CD1 4.14Å
124	D	96.9	Very high	97.5	Very high	48 Å²	48	34.6 Å²	34.6	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-79	-45.5	176.6	-64.2	-13.8	0	0	0	111.2	Q120 L122 Q128	Q120-D124 PolarHBondContact NE2-OD1 2.87Å; Q120-D124 PolarHBondContact O-N 3.27Å; L122-D124 PolarHBondContact O-N 3.16Å; D124-Q128 VanDerWaalsContact O-CD 3.31Å; D124-Q128 VanDerWaalsContact O-CG 3.23Å; D124-Q128 WeakPolarHBondContact O-CG 3.38Å; D124-Q128 PolarHBondContact O-NE2 2.8Å
125	L	97.8	Very high	97.6	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-69	-48.6	-174.2	-179.8	66.2	0	0	0	113.3	L54 Y56 L97 V99 D121 L122 Q128 L129	L54-L125 HydrophobicContact CB-CD2 4.27Å; L54-L125 HydrophobicContact CD1-CD2 4.33Å; Y56-L125 HydrophobicContact CD1-CD1 3.94Å; Y56-L125 HydrophobicContact CD1-CD2 4.43Å; Y56-L125 HydrophobicContact CE1-CD1 3.91Å; L97-L125 HydrophobicContact CD2-CD2 4.32Å; V99-L125 HydrophobicContact CG1-CD2 4.03Å; V99-L125 HydrophobicContact CG2-CD2 4.12Å; D121-L125 VanDerWaalsContact O-CB 3.26Å; D121-L125 WeakPolarHBondContact O-CB 3.49Å; D121-L125 PolarHBondContact O-N 2.61Å; L122-L125 PolarHBondContact O-N 2.85Å; L125-Q128 PolarHBondContact O-N 2.81Å; L125-L129 HydrophobicContact CD1-CD1 3.84Å; L125-L129 HydrophobicContact CD1-CG 4.18Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 WeakPolarHBondContact O-CG 3.49Å; L125-L129 PolarHBondContact O-N 3.12Å
126	L	97.9	Very high	97.6	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-42.4	-166.6	-62.9	171.6	0	0	0	113.7	I69 L97 L122 L129 G130 L131 V132 L149	I69-L126 HydrophobicContact CD1-CD2 3.79Å; I69-L126 HydrophobicContact CG1-CD2 3.82Å; I69-L126 HydrophobicContact CG2-CD2 4.21Å; L97-L126 HydrophobicContact CD2-CD2 3.99Å; L122-L126 HydrophobicContact CB-CD1 4.18Å; L122-L126 WeakPolarHBondContact O-CB 3.41Å; L122-L126 VanDerWaalsContact O-CG 3.24Å; L122-L126 WeakPolarHBondContact O-CG 3.29Å; L122-L126 PolarHBondContact O-N 2.83Å; L126-L129 PolarHBondContact O-N 3.03Å; L126-G130 PolarHBondContact O-N 3.26Å; L126-L131 HydrophobicContact CD2-CD1 4.47Å; L126-L131 PolarHBondContact O-N 3.04Å; L126-L131 VanDerWaalsContact O-N 3.16Å; L126-V132 HydrophobicContact CB-CG1 3.59Å; L126-L149 HydrophobicContact CD1-CD2 4.01Å
127	P	97.1	Very high	97.7	Very high	60 Å²	60	30.2 Å²	30.2	39%	0.39	17%	0.173	S	C	.	.	H	α-helix	trans	-65	-38.8	174.3	-22.8	35.6	0	0	0	112.9	Q123 L129 G130 V132 L156	Q123-P127 WeakPolarHBondContact O-CD 3.29Å; Q123-P127 VanDerWaalsContact O-CG 3.23Å; Q123-P127 WeakPolarHBondContact O-CG 3.43Å; P127-L129 PolarHBondContact O-N 2.81Å; P127-G130 PolarHBondContact O-N 2.79Å; P127-V132 HydrophobicContact CB-CG2 4.41Å; P127-V132 HydrophobicContact CG-CG1 4.18Å; P127-L156 HydrophobicContact CG-CD2 4.45Å
128	Q	96.8	Very high	97.8	Very high	156 Å²	156	29.1 Å²	29.1	73%	0.729	17%	0.167	S	C	*	.	H	α-helix	trans	-60.3	-31.8	178.2	-71.2	177.1	49.1	0	0	112.3	D124 L125	D124-Q128 VanDerWaalsContact O-CD 3.31Å; D124-Q128 VanDerWaalsContact O-CG 3.23Å; D124-Q128 WeakPolarHBondContact O-CG 3.38Å; D124-Q128 PolarHBondContact O-NE2 2.8Å; L125-Q128 PolarHBondContact O-N 2.81Å
129	L	96.6	Very high	97.8	Very high	42 Å²	42	29.1 Å²	29.1	22%	0.22	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.9	177	-61	-176.9	0	0	0	113.8	Y56 L97 L125 L126 P127 L131	Y56-L129 HydrophobicContact CD1-CD1 4.5Å; Y56-L129 HydrophobicContact CD2-CD1 4.41Å; Y56-L129 HydrophobicContact CE1-CD1 4.21Å; Y56-L129 HydrophobicContact CE1-CD2 4.38Å; Y56-L129 HydrophobicContact CE2-CD1 4.09Å; Y56-L129 HydrophobicContact CE2-CD2 4.37Å; Y56-L129 WeakPolarHBondContact OH-CD2 3.01Å; L97-L129 HydrophobicContact CD1-CD1 4.02Å; L97-L129 HydrophobicContact CD2-CD1 4.04Å; L125-L129 HydrophobicContact CD1-CD1 3.84Å; L125-L129 HydrophobicContact CD1-CG 4.18Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 WeakPolarHBondContact O-CG 3.49Å; L125-L129 PolarHBondContact O-N 3.12Å; L126-L129 PolarHBondContact O-N 3.03Å; P127-L129 PolarHBondContact O-N 2.81Å; L129-L131 VanDerWaalsContact C-N 3.27Å; L129-L131 HydrophobicContact CB-CD1 3.67Å; L129-L131 HydrophobicContact CB-CG 3.69Å; L129-L131 HydrophobicContact CD1-CD1 3.87Å; L129-L131 HydrophobicContact CG-CD1 4.44Å; L129-L131 PolarHBondContact O-N 2.96Å
130	G	96.4	Very high	97.8	Very high	47 Å²	47	29.5 Å²	29.5	49%	0.485	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	38.5	-176.7	0	0	0	0	0	112.6	R95 L126 P127	R95-G130 PolarHBondContact NH1-O 3.46Å; R95-G130 PolarHBondContact NH2-O 2.89Å; L126-G130 PolarHBondContact O-N 3.26Å; P127-G130 PolarHBondContact O-N 2.79Å
131	L	97.2	Very high	97.8	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.016	15%	0.152	C	C	.	.			trans	-103.7	-2.1	-176.8	-62.4	177.2	0	0	0	113.4	L58 A67 I69 L97 L126 L129 P133 C134	L58-L131 HydrophobicContact CD1-CD2 4.44Å; A67-L131 HydrophobicContact CB-CB 4.28Å; A67-L131 HydrophobicContact CB-CD2 3.73Å; A67-L131 HydrophobicContact CB-CG 4.47Å; I69-L131 HydrophobicContact CD1-CB 4.48Å; I69-L131 HydrophobicContact CD1-CD1 3.94Å; L97-L131 HydrophobicContact CB-CD1 4.26Å; L97-L131 HydrophobicContact CD1-CD1 4.34Å; L97-L131 HydrophobicContact CD2-CD1 3.81Å; L97-L131 HydrophobicContact CG-CD1 4.37Å; L126-L131 HydrophobicContact CD2-CD1 4.47Å; L126-L131 PolarHBondContact O-N 3.04Å; L126-L131 VanDerWaalsContact O-N 3.16Å; L129-L131 VanDerWaalsContact C-N 3.27Å; L129-L131 HydrophobicContact CB-CD1 3.67Å; L129-L131 HydrophobicContact CB-CG 3.69Å; L129-L131 HydrophobicContact CD1-CD1 3.87Å; L129-L131 HydrophobicContact CG-CD1 4.44Å; L129-L131 PolarHBondContact O-N 2.96Å; L131-P133 CarbonylContact O-C 3.51Å; L131-C134 VanDerWaalsContact O-CB 3.27Å; L131-C134 WeakPolarHBondContact O-CB 3.38Å
132	V	97.1	Very high	97.8	Very high	54 Å²	54	25.7 Å²	25.7	33%	0.327	15%	0.152	S	C	.	.			trans	-94.8	143.3	-174.3	-60	0	0	0	0	112.2	L126 P127 L156	L126-V132 HydrophobicContact CB-CG1 3.59Å; P127-V132 HydrophobicContact CB-CG2 4.41Å; P127-V132 HydrophobicContact CG-CG1 4.18Å; V132-L156 HydrophobicContact CB-CD2 4.08Å; V132-L156 HydrophobicContact CG1-CB 4.3Å; V132-L156 HydrophobicContact CG1-CD2 3.94Å; V132-L156 HydrophobicContact CG2-CD2 4.34Å
133	P	97.7	Very high	97.8	Very high	69 Å²	69	25.5 Å²	25.5	45%	0.448	15%	0.151	S	C	.	.	S	Bend	cis	-70.5	153	-10.9	33	-36.3	0	0	0	111.9	L131 L156 E158	L131-P133 CarbonylContact O-C 3.51Å; P133-L156 WeakPolarHBondContact CA-O 3.3Å; P133-E158 HydrophobicContact CB-CB 4.26Å
134	C	98.3	Very high	97.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	164.7	-175.9	60.8	0	0	0	0	113.7	A67 I69 L131 V136 L156 V157 E158	A67-C134 WeakPolarHBondContact O-CB 3.41Å; I69-C134 HydrophobicContact CD1-CB 4.29Å; I69-C134 HydrophobicContact CG1-CB 3.88Å; L131-C134 VanDerWaalsContact O-CB 3.27Å; L131-C134 WeakPolarHBondContact O-CB 3.38Å; C134-V136 VanDerWaalsContact SG-CG2 3.56Å; C134-L156 PolarHBondContact N-O 3.11Å; C134-L156 PolarHBondContact SG-O 2.64Å; C134-L156 VanDerWaalsContact SG-O 3.39Å; C134-V157 CarbonylContact O-C 3.5Å; C134-E158 PolarHBondContact O-N 3.15Å
135	V	98.7	Very high	97.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127	163.1	179.7	0	0	0	0	108.3	P66 A67 V68 I69 V137 R159 I161 L313	P66-V135 HydrophobicContact CB-CG2 4.5Å; A67-V135 PolarHBondContact O-N 3.2Å; V68-V135 CarbonylContact C-O 3.53Å; V68-V135 WeakPolarHBondContact CA-O 3.48Å; V68-V135 HydrophobicContact CG1-CB 4.41Å; V68-V135 HydrophobicContact CG1-CG1 4.25Å; V68-V135 HydrophobicContact CG2-CB 4.13Å; V68-V135 HydrophobicContact CG2-CG2 4.48Å; I69-V135 PolarHBondContact N-O 3.07Å; V135-V137 HydrophobicContact CG1-CG2 4.28Å; V135-R159 WeakPolarHBondContact CA-O 3.43Å; V135-R159 HydrophobicContact CG1-CB 4.32Å; V135-R159 HydrophobicContact CG2-CB 4.27Å; V135-I161 HydrophobicContact CG1-CD1 3.89Å; V135-L313 HydrophobicContact CB-CD2 4.42Å; V135-L313 HydrophobicContact CG1-CD2 3.84Å; V135-L313 HydrophobicContact CG2-CD2 3.73Å
136	V	98.9	Very high	98	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.5	177	-169.3	0	0	0	0	109.9	L71 C134 A146 L149 V157 R159 I161	L71-V136 HydrophobicContact CD1-CG1 3.76Å; L71-V136 HydrophobicContact CG-CG1 4.27Å; C134-V136 VanDerWaalsContact SG-CG2 3.56Å; V136-A146 HydrophobicContact CB-CB 4.25Å; V136-A146 HydrophobicContact CG1-CB 3.48Å; V136-A146 VanDerWaalsContact CG1-CB 3.48Å; V136-L149 HydrophobicContact CG2-CD2 4.25Å; V136-V157 HydrophobicContact CG2-CG1 4.21Å; V136-V157 HydrophobicContact CG2-CG2 4.11Å; V136-R159 PolarHBondContact N-O 3.26Å; V136-I161 PolarHBondContact O-N 3Å
137	V	98.9	Very high	98	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	115.5	177.1	-171.9	0	0	0	0	108.5	V68 I69 F70 L71 V135 I161 V163 F305 I309	V68-V137 HydrophobicContact CG1-CG2 3.69Å; I69-V137 PolarHBondContact O-N 2.77Å; F70-V137 CarbonylContact C-O 3.59Å; F70-V137 WeakPolarHBondContact CA-O 3.37Å; F70-V137 HydrophobicContact CD1-CB 3.75Å; F70-V137 HydrophobicContact CD1-CG1 3.82Å; F70-V137 HydrophobicContact CD1-CG2 4.35Å; F70-V137 HydrophobicContact CE1-CB 3.86Å; F70-V137 HydrophobicContact CE1-CG1 3.75Å; F70-V137 HydrophobicContact CE1-CG2 4.03Å; F70-V137 HydrophobicContact CG-CB 4.43Å; F70-V137 HydrophobicContact CZ-CG2 4.37Å; L71-V137 PolarHBondContact N-O 3.06Å; V135-V137 HydrophobicContact CG1-CG2 4.28Å; V137-I161 WeakPolarHBondContact CA-O 3.37Å; V137-I161 HydrophobicContact CB-CB 4.44Å; V137-I161 HydrophobicContact CG1-CB 4.23Å; V137-I161 HydrophobicContact CG1-CG2 4.12Å; V137-I161 HydrophobicContact CG2-CB 4.16Å; V137-I161 HydrophobicContact CG2-CD1 3.74Å; V137-V163 HydrophobicContact CG1-CG2 3.85Å; V137-F305 HydrophobicContact CG1-CZ 4.05Å; V137-I309 HydrophobicContact CG1-CD1 3.91Å; V137-I309 HydrophobicContact CG2-CD1 4.28Å
138	G	98.8	Very high	98.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.7	-177.4	0	0	0	0	0	112.7	G142 G143 I161 V163	G138-G142 VanDerWaalsContact CA-C 3.43Å; G138-G143 WeakPolarHBondContact O-CA 3.31Å; G138-G143 PolarHBondContact O-N 2.93Å; G138-I161 PolarHBondContact N-O 3.06Å; G138-V163 PolarHBondContact O-N 3.13Å
139	H	98.7	Very high	98.2	Very high	5 Å²	5	12 Å²	12	2%	0.023	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.1	174	168	-108.1	0	0	0	111.7	L71 H72 G73 F81 M141 G142 V163 H295 W296 H298	L71-H139 PolarHBondContact O-N 2.98Å; H72-H139 CarbonylContact C-O 3.56Å; G73-H139 WeakPolarHBondContact CA-O 3.39Å; G73-H139 PolarHBondContact N-O 3.08Å; F81-H139 HydrophobicContact CZ-CB 4.07Å; H139-M141 PolarHBondContact O-N 3.48Å; H139-M141 VanDerWaalsContact O-N 3.13Å; H139-G142 PolarHBondContact O-N 3.44Å; H139-V163 HydrophobicContact CB-CB 4.22Å; H139-H295 AromaticContact CE1-CD2 3.96Å; H139-H295 AromaticContact CE1-NE2 3.73Å; H139-H295 AromaticContact NE2-CD2 3.65Å; H139-H295 AromaticContact NE2-CE1 3.66Å; H139-H295 AromaticContact NE2-CG 3.94Å; H139-H295 AromaticContact NE2-ND1 3.93Å; H139-H295 AromaticContact NE2-NE2 3.48Å; H139-H295 PolarHBondContact NE2-NE2 2.86Å; H139-H295 PolarHBondContact NE2-O 3.06Å; H139-H295 VanDerWaalsContact NE2-O 3.14Å; H139-W296 AromaticContact CE1-CD1 3.53Å; H139-W296 AromaticContact CE1-NE1 3.97Å; H139-W296 AromaticContact NE2-CD1 3.88Å; H139-H298 AromaticContact CE1-CE1 3.94Å; H139-H298 AromaticContact CG-CE1 3.85Å; H139-H298 AromaticContact ND1-CE1 3.76Å
140	S	97.2	Very high	98.3	Very high	8 Å²	8	10 Å²	10	6%	0.056	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	-117.1	173.9	-168.8	0	0	0	0	111.9	G142 G143 R144 V163 I165 H295	S140-G142 VanDerWaalsContact C-N 3.26Å; S140-G142 PolarHBondContact O-N 3.03Å; S140-G143 WeakPolarHBondContact O-CA 3.27Å; S140-G143 PolarHBondContact O-N 2.83Å; S140-R144 PolarHBondContact O-N 2.83Å; S140-R144 VanDerWaalsContact O-N 3.09Å; S140-V163 PolarHBondContact N-O 2.9Å; S140-I165 WeakPolarHBondContact O-CG2 3.12Å; S140-H295 WeakPolarHBondContact CB-NE2 3.38Å; S140-H295 PolarHBondContact OG-NE2 3.26Å
141	M	98.1	Very high	98.4	Very high	5 Å²	5	8.3 Å²	8.3	3%	0.025	5%	0.05	C	C	.	.	H	α-helix	trans	-48	-44.7	170.7	-176	-168.6	76.1	0	0	113.4	L74 A101 M113 Y115 M118 H139 G143 R144 T145	L74-M141 HydrophobicContact CB-CB 4.26Å; L74-M141 HydrophobicContact CB-SD 4.4Å; L74-M141 HydrophobicContact CD1-SD 4.01Å; A101-M141 HydrophobicContact CB-CE 3.7Å; M113-M141 HydrophobicContact CE-SD 3.61Å; Y115-M141 HydrophobicContact CE1-CG 4.02Å; Y115-M141 WeakPolarHBondContact CE1-O 3.38Å; M118-M141 HydrophobicContact CE-CG 3.91Å; M118-M141 HydrophobicContact CE-SD 4.24Å; M118-M141 HydrophobicContact SD-CE 4.26Å; M118-M141 HydrophobicContact SD-CG 4.4Å; M118-M141 HydrophobicContact SD-SD 4.13Å; H139-M141 PolarHBondContact O-N 3.48Å; H139-M141 VanDerWaalsContact O-N 3.13Å; M141-G143 VanDerWaalsContact C-N 3.26Å; M141-G143 PolarHBondContact O-N 2.8Å; M141-R144 PolarHBondContact O-N 3.39Å; M141-T145 PolarHBondContact O-N 2.87Å; M141-T145 PolarHBondContact O-OG1 3.28Å
142	G	98.7	Very high	98.4	Very high	2 Å²	2	10.7 Å²	10.7	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-64.9	-31.1	176.2	0	0	0	0	0	112.6	H72 G138 H139 S140 T145 A146	H72-G142 WeakPolarHBondContact O-CA 3.36Å; H72-G142 PolarHBondContact O-N 3.42Å; H72-G142 VanDerWaalsContact O-N 3.1Å; G138-G142 VanDerWaalsContact CA-C 3.43Å; H139-G142 PolarHBondContact O-N 3.44Å; S140-G142 VanDerWaalsContact C-N 3.26Å; S140-G142 PolarHBondContact O-N 3.03Å; G142-T145 PolarHBondContact O-N 3.42Å; G142-A146 WeakPolarHBondContact O-CB 3.41Å; G142-A146 PolarHBondContact O-N 3.13Å
143	G	98.6	Very high	98.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-68.9	-44.4	176.8	0	0	0	0	0	112.4	G138 S140 M141 T145 A146 M147	G138-G143 WeakPolarHBondContact O-CA 3.31Å; G138-G143 PolarHBondContact O-N 2.93Å; S140-G143 WeakPolarHBondContact O-CA 3.27Å; S140-G143 PolarHBondContact O-N 2.83Å; M141-G143 VanDerWaalsContact C-N 3.26Å; M141-G143 PolarHBondContact O-N 2.8Å; G143-T145 VanDerWaalsContact C-N 3.32Å; G143-T145 PolarHBondContact O-N 3.48Å; G143-A146 PolarHBondContact O-N 3.32Å; G143-M147 WeakPolarHBondContact O-CB 3.4Å; G143-M147 VanDerWaalsContact O-CG 3.25Å; G143-M147 WeakPolarHBondContact O-CG 3.27Å; G143-M147 PolarHBondContact O-N 3.48Å
144	R	98.5	Very high	98.5	Very high	11 Å²	11	12.1 Å²	12.1	4%	0.042	6%	0.061	C	C	.	.	H	α-helix	trans	-65.2	-35.7	172.7	-78.5	178	174.4	174.2	0.4	112.6	Y115 S140 M141 M147 L148 I165 S166 V168 L245 L246 T247 F248	Y115-R144 HydrophobicContact CD1-CB 3.79Å; Y115-R144 HydrophobicContact CD2-CB 4.47Å; Y115-R144 HydrophobicContact CE1-CB 3.39Å; Y115-R144 HydrophobicContact CE1-CG 4.47Å; Y115-R144 HydrophobicContact CE2-CB 4.1Å; Y115-R144 HydrophobicContact CG-CB 4.32Å; Y115-R144 VanDerWaalsContact CZ-CD 3.47Å; Y115-R144 VanDerWaalsContact OH-CD 3.22Å; Y115-R144 WeakPolarHBondContact OH-CD 3.33Å; S140-R144 PolarHBondContact O-N 2.83Å; S140-R144 VanDerWaalsContact O-N 3.09Å; M141-R144 PolarHBondContact O-N 3.39Å; R144-M147 HydrophobicContact CG-SD 4.48Å; R144-M147 PolarHBondContact O-N 3.25Å; R144-L148 PolarHBondContact O-N 3.09Å; R144-I165 HydrophobicContact CG-CG1 3.84Å; R144-S166 PolarHBondContact NE-O 2.63Å; R144-V168 PolarHBondContact NH2-O 3.06Å; R144-L245 PolarHBondContact NH1-O 2.64Å; R144-L246 VanDerWaalsContact NH1-C 3.29Å; R144-L246 PolarHBondContact NH1-O 3.3Å; R144-L246 PolarHBondContact NH2-O 3.34Å; R144-T247 PolarHBondContact NH1-O 2.84Å; R144-T247 VanDerWaalsContact NH1-O 3.12Å; R144-F248 HydrophobicContact CB-CD2 3.97Å; R144-F248 HydrophobicContact CB-CE2 4.1Å; R144-F248 HydrophobicContact CG-CD2 3.76Å; R144-F248 HydrophobicContact CG-CE2 4.21Å
145	T	98.8	Very high	98.5	Very high	7 Å²	7	17 Å²	17	4%	0.043	8%	0.083	C	C	.	.	H	α-helix	trans	-61.8	-46.6	172.3	-53.5	0	0	0	0	111	L71 M118 L122 M141 G142 G143 L148 L149	L71-T145 HydrophobicContact CD1-CG2 4.44Å; M118-T145 HydrophobicContact CB-CG2 3.63Å; L122-T145 HydrophobicContact CD1-CG2 3.82Å; M141-T145 PolarHBondContact O-N 2.87Å; M141-T145 PolarHBondContact O-OG1 3.28Å; G142-T145 PolarHBondContact O-N 3.42Å; G143-T145 VanDerWaalsContact C-N 3.32Å; G143-T145 PolarHBondContact O-N 3.48Å; T145-L148 PolarHBondContact O-N 3.24Å; T145-L149 PolarHBondContact O-N 3.24Å
146	A	98.8	Very high	98.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-41.3	177.6	0	0	0	0	0	112.9	L71 V136 G142 G143 L148 L149 A150 L160	L71-A146 HydrophobicContact CD1-CB 4.1Å; V136-A146 HydrophobicContact CB-CB 4.25Å; V136-A146 HydrophobicContact CG1-CB 3.48Å; V136-A146 VanDerWaalsContact CG1-CB 3.48Å; G142-A146 WeakPolarHBondContact O-CB 3.41Å; G142-A146 PolarHBondContact O-N 3.13Å; G143-A146 PolarHBondContact O-N 3.32Å; A146-L148 VanDerWaalsContact C-N 3.34Å; A146-L148 PolarHBondContact O-N 2.86Å; A146-L149 PolarHBondContact O-N 2.86Å; A146-A150 WeakPolarHBondContact O-CB 3.44Å; A146-A150 PolarHBondContact O-N 3.35Å; A146-L160 HydrophobicContact CB-CD1 3.47Å; A146-L160 VanDerWaalsContact CB-CD1 3.47Å
147	M	98.9	Very high	98.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-56.6	-48.9	173.6	-77	173.4	-159.2	0	0	111.2	G143 R144 A150 L151 L160 A162 I165 P167 F248 F261 F282	G143-M147 WeakPolarHBondContact O-CB 3.4Å; G143-M147 VanDerWaalsContact O-CG 3.25Å; G143-M147 WeakPolarHBondContact O-CG 3.27Å; G143-M147 PolarHBondContact O-N 3.48Å; R144-M147 HydrophobicContact CG-SD 4.48Å; R144-M147 PolarHBondContact O-N 3.25Å; M147-A150 PolarHBondContact O-N 3.43Å; M147-L151 VanDerWaalsContact O-CG 3.31Å; M147-L151 WeakPolarHBondContact O-CG 3.22Å; M147-L151 PolarHBondContact O-N 3.13Å; M147-L160 HydrophobicContact CG-CD2 4.06Å; M147-A162 HydrophobicContact CE-CB 3.21Å; M147-I165 HydrophobicContact CE-CG2 3.81Å; M147-P167 HydrophobicContact SD-CB 3.95Å; M147-P167 HydrophobicContact SD-CG 4.38Å; M147-F248 HydrophobicContact CB-CE2 4.06Å; M147-F248 HydrophobicContact CB-CZ 4.03Å; M147-F248 HydrophobicContact SD-CE2 4.49Å; M147-F261 HydrophobicContact CE-CD1 4.23Å; M147-F261 HydrophobicContact CE-CE1 3.33Å; M147-F261 HydrophobicContact CE-CZ 3.77Å; M147-F261 HydrophobicContact SD-CE1 4.41Å; M147-F261 HydrophobicContact SD-CZ 4.46Å; M147-F282 HydrophobicContact CB-CE1 4.47Å; M147-F282 HydrophobicContact CB-CE2 4.31Å; M147-F282 HydrophobicContact CB-CZ 3.64Å; M147-F282 HydrophobicContact CG-CE1 4.43Å; M147-F282 HydrophobicContact CG-CE2 3.95Å; M147-F282 HydrophobicContact CG-CZ 3.64Å; M147-F282 HydrophobicContact SD-CE2 4.22Å; M147-F282 HydrophobicContact SD-CZ 4.45Å
148	L	98.6	Very high	98.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-68.2	-38.8	-178.4	-171.1	64.1	0	0	0	112	Y115 E116 R144 T145 A146 A150 L151 Q152 F248 P249 R251	Y115-L148 WeakPolarHBondContact O-CD2 3.41Å; E116-L148 VanDerWaalsContact CA-CD2 3.49Å; E116-L148 HydrophobicContact CB-CD2 4.34Å; E116-L148 HydrophobicContact CG-CD2 4.07Å; E116-L148 VanDerWaalsContact N-CD2 3.29Å; R144-L148 PolarHBondContact O-N 3.09Å; T145-L148 PolarHBondContact O-N 3.24Å; A146-L148 VanDerWaalsContact C-N 3.34Å; A146-L148 PolarHBondContact O-N 2.86Å; L148-A150 VanDerWaalsContact C-N 3.34Å; L148-A150 PolarHBondContact O-N 2.91Å; L148-L151 PolarHBondContact O-N 2.8Å; L148-Q152 HydrophobicContact CD1-CG 4.13Å; L148-Q152 HydrophobicContact CG-CG 4.23Å; L148-Q152 WeakPolarHBondContact O-CB 3.25Å; L148-Q152 VanDerWaalsContact O-CG 3.32Å; L148-Q152 WeakPolarHBondContact O-CG 3.43Å; L148-Q152 PolarHBondContact O-N 2.83Å; L148-F248 HydrophobicContact CB-CE2 4.44Å; L148-F248 HydrophobicContact CB-CZ 4.44Å; L148-P249 HydrophobicContact CD2-CG 4.31Å; L148-R251 HydrophobicContact CD1-CG 4.28Å
149	L	98.8	Very high	98.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.1	-47.4	172.2	177.4	66.5	0	0	0	111.4	S119 L122 Q123 L126 V136 T145 A146 L151 Q152 R153 L156 V157	S119-L149 WeakPolarHBondContact OG-CA 3.49Å; L122-L149 HydrophobicContact CB-CD1 4.45Å; L122-L149 HydrophobicContact CB-CD2 4.04Å; L122-L149 HydrophobicContact CD1-CD2 4.06Å; Q123-L149 HydrophobicContact CG-CD1 3.51Å; L126-L149 HydrophobicContact CD1-CD2 4.01Å; V136-L149 HydrophobicContact CG2-CD2 4.25Å; T145-L149 PolarHBondContact O-N 3.24Å; A146-L149 PolarHBondContact O-N 2.86Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 3.37Å; L149-Q152 PolarHBondContact O-N 3.04Å; L149-R153 HydrophobicContact CD1-CB 4.34Å; L149-R153 CarbonylContact O-C 3.57Å; L149-R153 WeakPolarHBondContact O-CA 3.29Å; L149-R153 PolarHBondContact O-N 2.96Å; L149-L156 HydrophobicContact CD1-CD1 4.29Å; L149-V157 HydrophobicContact CD2-CG2 4.02Å; L149-V157 HydrophobicContact CG-CG2 3.92Å
150	A	98.8	Very high	98.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-37.3	179.7	0	0	0	0	0	112.7	A146 M147 L148 P154 V157 L160 Y255	A146-A150 WeakPolarHBondContact O-CB 3.44Å; A146-A150 PolarHBondContact O-N 3.35Å; M147-A150 PolarHBondContact O-N 3.43Å; L148-A150 VanDerWaalsContact C-N 3.34Å; L148-A150 PolarHBondContact O-N 2.91Å; A150-P154 WeakPolarHBondContact O-CA 3.49Å; A150-V157 HydrophobicContact CB-CB 4.24Å; A150-V157 HydrophobicContact CB-CG1 4.17Å; A150-V157 HydrophobicContact CB-CG2 4.13Å; A150-L160 HydrophobicContact CB-CD2 4.12Å; A150-Y255 HydrophobicContact CB-CD1 4.08Å; A150-Y255 HydrophobicContact CB-CD2 3.83Å; A150-Y255 HydrophobicContact CB-CE1 4.25Å; A150-Y255 HydrophobicContact CB-CE2 4.04Å; A150-Y255 HydrophobicContact CB-CG 3.84Å; A150-Y255 WeakPolarHBondContact O-CD2 3.22Å
151	L	98.6	Very high	98.6	Very high	10 Å²	10	22.3 Å²	22.3	5%	0.052	11%	0.106	C	C	.	.	H	α-helix	trans	-70.5	-40.4	176.5	-70.6	167.8	0	0	0	112.3	M147 L148 L149 F248 R251 E253 L281 F282	M147-L151 VanDerWaalsContact O-CG 3.31Å; M147-L151 WeakPolarHBondContact O-CG 3.22Å; M147-L151 PolarHBondContact O-N 3.13Å; L148-L151 PolarHBondContact O-N 2.8Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 3.37Å; L151-F248 HydrophobicContact CD1-CE1 4.26Å; L151-F248 HydrophobicContact CD1-CZ 4.12Å; L151-R251 HydrophobicContact CD1-CB 4.23Å; L151-R251 HydrophobicContact CD1-CG 3.94Å; L151-E253 WeakPolarHBondContact CD2-O 3.37Å; L151-L281 HydrophobicContact CD1-CD1 4.46Å; L151-L281 HydrophobicContact CD1-CD2 4.41Å; L151-L281 HydrophobicContact CD2-CD2 4.4Å; L151-F282 HydrophobicContact CD1-CE1 4.47Å; L151-F282 HydrophobicContact CD1-CZ 3.86Å; L151-F282 HydrophobicContact CD2-CE1 4.25Å; L151-F282 HydrophobicContact CD2-CZ 4.33Å; L151-F282 HydrophobicContact CG-CE1 4.1Å; L151-F282 HydrophobicContact CG-CZ 4Å
152	Q	97.9	Very high	98.6	Very high	54 Å²	54	22.1 Å²	22.1	25%	0.252	11%	0.105	S	C	.	.	H	α-helix	trans	-78.8	-40.7	-177.9	-72.9	176.5	-31.1	0	0	112.8	S119 L148 L149	S119-Q152 PolarHBondContact OG-OE1 3.12Å; L148-Q152 HydrophobicContact CD1-CG 4.13Å; L148-Q152 HydrophobicContact CG-CG 4.23Å; L148-Q152 WeakPolarHBondContact O-CB 3.25Å; L148-Q152 VanDerWaalsContact O-CG 3.32Å; L148-Q152 WeakPolarHBondContact O-CG 3.43Å; L148-Q152 PolarHBondContact O-N 2.83Å; L149-Q152 PolarHBondContact O-N 3.04Å
153	R	98.2	Very high	98.6	Very high	84 Å²	84	22 Å²	22	32%	0.317	10%	0.104	S	C	.	.			trans	-134.9	65.2	-171.1	-56.7	-60.2	-62.9	-81.9	-4.7	110.8	Q123 L149 E155 L156	Q123-R153 HydrophobicContact CG-CG 3.76Å; Q123-R153 VanDerWaalsContact OE1-CD 3.31Å; L149-R153 HydrophobicContact CD1-CB 4.34Å; L149-R153 CarbonylContact O-C 3.57Å; L149-R153 WeakPolarHBondContact O-CA 3.29Å; L149-R153 PolarHBondContact O-N 2.96Å; R153-E155 VanDerWaalsContact CA-OE2 3.23Å; R153-E155 WeakPolarHBondContact CA-OE2 3.48Å; R153-E155 IonicContact CZ-OE1 3.12Å; R153-E155 IonicContact NE-OE1 2.68Å; R153-E155 PolarHBondContact NE-OE1 2.93Å; R153-E155 IonicContact NE-OE2 3.92Å; R153-E155 IonicContact NH2-OE1 2.72Å; R153-E155 PolarHBondContact NH2-OE1 3.28Å; R153-E155 PolarHBondContact O-N 2.87Å; R153-E155 VanDerWaalsContact O-N 3.07Å; R153-L156 HydrophobicContact CB-CB 4.4Å; R153-L156 HydrophobicContact CB-CD1 3.7Å; R153-L156 HydrophobicContact CB-CG 3.86Å; R153-L156 HydrophobicContact CG-CD1 4.15Å; R153-L156 PolarHBondContact O-N 3.05Å
154	P	98.3	Very high	98.6	Very high	68 Å²	68	22.1 Å²	22.1	44%	0.442	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-57.6	-24.5	-177.2	25.1	-36	0	0	0	113.1	A150 L156 V157 Y255	A150-P154 WeakPolarHBondContact O-CA 3.49Å; P154-L156 VanDerWaalsContact C-N 3.27Å; P154-L156 PolarHBondContact O-N 3.18Å; P154-V157 PolarHBondContact O-N 3.49Å; P154-Y255 HydrophobicContact CB-CD2 3.87Å; P154-Y255 HydrophobicContact CB-CE2 4Å
155	E	98.3	Very high	98.5	Very high	102 Å²	102	22 Å²	22	48%	0.477	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-71.8	-17.3	178	79.2	-73.1	-177.5	0	0	114.2	R153	R153-E155 VanDerWaalsContact CA-OE2 3.23Å; R153-E155 WeakPolarHBondContact CA-OE2 3.48Å; R153-E155 IonicContact CZ-OE1 3.12Å; R153-E155 IonicContact NE-OE1 2.68Å; R153-E155 PolarHBondContact NE-OE1 2.93Å; R153-E155 IonicContact NE-OE2 3.92Å; R153-E155 IonicContact NH2-OE1 2.72Å; R153-E155 PolarHBondContact NH2-OE1 3.28Å; R153-E155 PolarHBondContact O-N 2.87Å; R153-E155 VanDerWaalsContact O-N 3.07Å
156	L	98.6	Very high	98.4	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.047	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-89	-16.4	176.8	-54.3	-177.1	0	0	0	112.5	Q123 P127 V132 P133 C134 L149 R153 P154	Q123-L156 HydrophobicContact CB-CD1 4.39Å; Q123-L156 HydrophobicContact CG-CD1 4.14Å; P127-L156 HydrophobicContact CG-CD2 4.45Å; V132-L156 HydrophobicContact CB-CD2 4.08Å; V132-L156 HydrophobicContact CG1-CB 4.3Å; V132-L156 HydrophobicContact CG1-CD2 3.94Å; V132-L156 HydrophobicContact CG2-CD2 4.34Å; P133-L156 WeakPolarHBondContact CA-O 3.3Å; C134-L156 PolarHBondContact N-O 3.11Å; C134-L156 PolarHBondContact SG-O 2.64Å; C134-L156 VanDerWaalsContact SG-O 3.39Å; L149-L156 HydrophobicContact CD1-CD1 4.29Å; R153-L156 HydrophobicContact CB-CB 4.4Å; R153-L156 HydrophobicContact CB-CD1 3.7Å; R153-L156 HydrophobicContact CB-CG 3.86Å; R153-L156 HydrophobicContact CG-CD1 4.15Å; R153-L156 PolarHBondContact O-N 3.05Å; P154-L156 VanDerWaalsContact C-N 3.27Å; P154-L156 PolarHBondContact O-N 3.18Å
157	V	98.7	Very high	98.3	Very high	6 Å²	6	22 Å²	22	4%	0.036	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.8	-172.6	-173.9	0	0	0	0	109.3	C134 V136 L149 A150 P154 L160 Y255	C134-V157 CarbonylContact O-C 3.5Å; V136-V157 HydrophobicContact CG2-CG1 4.21Å; V136-V157 HydrophobicContact CG2-CG2 4.11Å; L149-V157 HydrophobicContact CD2-CG2 4.02Å; L149-V157 HydrophobicContact CG-CG2 3.92Å; A150-V157 HydrophobicContact CB-CB 4.24Å; A150-V157 HydrophobicContact CB-CG1 4.17Å; A150-V157 HydrophobicContact CB-CG2 4.13Å; P154-V157 PolarHBondContact O-N 3.49Å; V157-L160 HydrophobicContact CG1-CB 4.39Å; V157-Y255 HydrophobicContact CB-CE2 4.37Å; V157-Y255 PolarHBondContact O-OH 3.03Å
158	E	98.1	Very high	98	Very high	60 Å²	60	23.3 Å²	23.3	28%	0.28	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-42.6	173.8	-174.7	-179.7	148.3	0	0	111.6	P66 P133 C134 Y255	P66-E158 WeakPolarHBondContact CB-OE2 3.39Å; P66-E158 VanDerWaalsContact CG-CD 3.42Å; P66-E158 WeakPolarHBondContact CG-OE1 3.42Å; P66-E158 WeakPolarHBondContact CG-OE2 3.31Å; P133-E158 HydrophobicContact CB-CB 4.26Å; C134-E158 PolarHBondContact O-N 3.15Å; E158-Y255 PolarHBondContact O-OH 3.35Å
159	R	98.7	Very high	97.4	Very high	51 Å²	51	29.9 Å²	29.9	19%	0.192	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.5	177.3	-65.2	-173.2	-180	66.8	-1.2	110	V135 V136 P258 F312	V135-R159 WeakPolarHBondContact CA-O 3.43Å; V135-R159 HydrophobicContact CG1-CB 4.32Å; V135-R159 HydrophobicContact CG2-CB 4.27Å; V136-R159 PolarHBondContact N-O 3.26Å; R159-P258 WeakPolarHBondContact CA-O 3.32Å; R159-P258 HydrophobicContact CG-CB 4.08Å; R159-P258 HydrophobicContact CG-CG 4.25Å; R159-F312 HydrophobicContact CB-CE1 3.96Å; R159-F312 HydrophobicContact CG-CE1 4.36Å
160	L	98.9	Very high	96	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.9	176.5	173	63.2	0	0	0	110	A146 M147 A150 V157 Y255 P258 T259 L260 F282	A146-L160 HydrophobicContact CB-CD1 3.47Å; A146-L160 VanDerWaalsContact CB-CD1 3.47Å; M147-L160 HydrophobicContact CG-CD2 4.06Å; A150-L160 HydrophobicContact CB-CD2 4.12Å; V157-L160 HydrophobicContact CG1-CB 4.39Å; L160-Y255 HydrophobicContact CB-CE1 4.08Å; L160-P258 PolarHBondContact N-O 3.34Å; L160-P258 VanDerWaalsContact N-O 3.09Å; L160-T259 HydrophobicContact CB-CG2 4.09Å; L160-T259 HydrophobicContact CD2-CG2 3.8Å; L160-T259 HydrophobicContact CG-CG2 3.95Å; L160-T259 CarbonylContact O-C 3.4Å; L160-T259 VanDerWaalsContact O-CA 3.27Å; L160-T259 WeakPolarHBondContact O-CA 3.41Å; L160-L260 PolarHBondContact O-N 3.13Å; L160-F282 HydrophobicContact CD2-CD1 3.83Å; L160-F282 HydrophobicContact CD2-CE1 3.47Å; L160-F282 VanDerWaalsContact CD2-CE1 3.47Å; L160-F282 HydrophobicContact CD2-CZ 4.12Å
161	I	98.9	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	106.5	169.4	-59.7	153.5	0	0	0	108.4	V135 V136 V137 G138 V163 L260 I309 F312	V135-I161 HydrophobicContact CG1-CD1 3.89Å; V136-I161 PolarHBondContact O-N 3Å; V137-I161 WeakPolarHBondContact CA-O 3.37Å; V137-I161 HydrophobicContact CB-CB 4.44Å; V137-I161 HydrophobicContact CG1-CB 4.23Å; V137-I161 HydrophobicContact CG1-CG2 4.12Å; V137-I161 HydrophobicContact CG2-CB 4.16Å; V137-I161 HydrophobicContact CG2-CD1 3.74Å; G138-I161 PolarHBondContact N-O 3.06Å; I161-V163 HydrophobicContact CG2-CG2 4.09Å; I161-L260 CarbonylContact C-O 3.59Å; I161-L260 VanDerWaalsContact CA-O 3.31Å; I161-L260 WeakPolarHBondContact CA-O 3.27Å; I161-L260 HydrophobicContact CG1-CB 4.08Å; I161-L260 HydrophobicContact CG1-CD2 4.4Å; I161-L260 HydrophobicContact CG2-CB 4.37Å; I161-L260 HydrophobicContact CG2-CD2 4.12Å; I161-L260 HydrophobicContact CG2-CG 4.36Å; I161-I309 HydrophobicContact CD1-CB 4.36Å; I161-I309 HydrophobicContact CD1-CG1 4.13Å; I161-I309 HydrophobicContact CD1-CG2 3.74Å; I161-I309 HydrophobicContact CG2-CG1 4.44Å; I161-F312 HydrophobicContact CD1-CD1 3.92Å; I161-F312 HydrophobicContact CD1-CE1 4.42Å; I161-F312 HydrophobicContact CG1-CD1 3.67Å; I161-F312 HydrophobicContact CG1-CE1 3.81Å
162	A	98.8	Very high	91.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	119.4	174.1	0	0	0	0	0	110	M147 L260 F261 L262	M147-A162 HydrophobicContact CE-CB 3.21Å; A162-L260 PolarHBondContact N-O 3.49Å; A162-F261 HydrophobicContact CB-CD1 3.89Å; A162-F261 HydrophobicContact CB-CE1 3.9Å; A162-F261 HydrophobicContact CB-CG 4.3Å; A162-F261 HydrophobicContact CB-CZ 4.29Å; A162-F261 CarbonylContact O-C 3.53Å; A162-F261 WeakPolarHBondContact O-CA 3.4Å; A162-L262 PolarHBondContact O-N 2.83Å
163	V	98.8	Very high	89.9	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	111.2	-175.7	-172.5	0	0	0	0	109.1	V137 G138 H139 S140 I161 I165 L262 I297 F305	V137-V163 HydrophobicContact CG1-CG2 3.85Å; G138-V163 PolarHBondContact O-N 3.13Å; H139-V163 HydrophobicContact CB-CB 4.22Å; S140-V163 PolarHBondContact N-O 2.9Å; I161-V163 HydrophobicContact CG2-CG2 4.09Å; V163-I165 PolarHBondContact O-N 2.82Å; V163-L262 WeakPolarHBondContact CA-O 3.36Å; V163-I297 HydrophobicContact CG1-CB 4.45Å; V163-I297 HydrophobicContact CG1-CD1 3.93Å; V163-I297 HydrophobicContact CG1-CG1 4.41Å; V163-F305 HydrophobicContact CB-CE2 4.35Å; V163-F305 HydrophobicContact CG1-CD2 4.46Å; V163-F305 HydrophobicContact CG1-CE2 3.74Å; V163-F305 HydrophobicContact CG2-CE2 3.67Å; V163-F305 HydrophobicContact CG2-CZ 4.1Å
164	D	97.8	Very high	88.9	Confident	2 Å²	2	41 Å²	41	1%	0.011	26%	0.255	C	S	.	.	S	Bend	trans	52.3	46.3	172.2	-153.4	54.6	0	0	0	115.2	L262 G264 S267 F269 H295 I297	D164-L262 PolarHBondContact N-O 3.04Å; D164-G264 PolarHBondContact OD1-N 2.74Å; D164-S267 VanDerWaalsContact CG-OG 3.3Å; D164-S267 WeakPolarHBondContact OD1-CB 3.47Å; D164-S267 PolarHBondContact OD1-OG 3.05Å; D164-S267 WeakPolarHBondContact OD2-CB 3.47Å; D164-S267 PolarHBondContact OD2-OG 3.26Å; D164-F269 WeakPolarHBondContact O-CB 3.45Å; D164-H295 PolarHBondContact O-CE1 3.46Å; D164-H295 WeakPolarHBondContact OD2-CA 3.41Å; D164-H295 IonicContact OD2-CE1 3.32Å; D164-H295 IonicContact OD2-CG 2.71Å; D164-H295 IonicContact OD2-ND1 3.1Å; D164-H295 PolarHBondContact OD2-ND1 2.79Å; D164-I297 HydrophobicContact CB-CD1 4.17Å
165	I	97.5	Very high	88.5	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.041	26%	0.261	C	S	.	.			trans	-156.2	158.9	177	-162.9	58.3	0	0	0	110.9	S140 R144 M147 V163 F269 V270	S140-I165 WeakPolarHBondContact O-CG2 3.12Å; R144-I165 HydrophobicContact CG-CG1 3.84Å; M147-I165 HydrophobicContact CE-CG2 3.81Å; V163-I165 PolarHBondContact O-N 2.82Å; I165-F269 HydrophobicContact CD1-CD1 4.05Å; I165-V270 VanDerWaalsContact C-CG2 3.43Å
166	S	96.5	Very high	88.3	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.014	25%	0.246	C	C	.	.			trans	-134.1	159.5	-178.6	52.2	0	0	0	0	112	R144 V168 H274	R144-S166 PolarHBondContact NE-O 2.63Å; S166-V168 PolarHBondContact O-N 2.9Å; S166-V168 WeakPolarHBondContact OG-CG2 3.2Å; S166-H274 PolarHBondContact OG-ND1 2.88Å
167	P	96.4	Very high	88.1	Confident	5 Å²	5	43 Å²	43	3%	0.032	26%	0.263	C	S	.	.	S	Bend	trans	-83.8	30.2	-179.9	37.1	-38.5	0	0	0	113	M147 F248 E277 I278 L281 F282	M147-P167 HydrophobicContact SD-CB 3.95Å; M147-P167 HydrophobicContact SD-CG 4.38Å; P167-F248 HydrophobicContact CB-CD1 3.55Å; P167-F248 HydrophobicContact CB-CD2 4.35Å; P167-F248 HydrophobicContact CB-CE1 3.63Å; P167-F248 HydrophobicContact CB-CE2 4.41Å; P167-F248 HydrophobicContact CB-CG 3.93Å; P167-F248 HydrophobicContact CB-CZ 4.07Å; P167-F248 WeakPolarHBondContact O-CD1 3.01Å; P167-E277 HydrophobicContact CG-CG 4.24Å; P167-I278 HydrophobicContact CG-CG1 4.24Å; P167-L281 HydrophobicContact CB-CD1 3.67Å; P167-L281 HydrophobicContact CG-CD1 3.83Å; P167-F282 HydrophobicContact CB-CE2 4.45Å; P167-F282 HydrophobicContact CG-CE2 4.18Å
168	V	93	Very high	87.9	Confident	29 Å²	29	44.9 Å²	44.9	18%	0.176	28%	0.279	C	S	.	.	S	Bend	trans	-108.2	160.6	173	-60.3	0	0	0	0	109.9	R144 S166 G170 H274 E277	R144-V168 PolarHBondContact NH2-O 3.06Å; S166-V168 PolarHBondContact O-N 2.9Å; S166-V168 WeakPolarHBondContact OG-CG2 3.2Å; V168-G170 PolarHBondContact O-N 2.82Å; V168-H274 HydrophobicContact CG1-CB 4.2Å; V168-H274 HydrophobicContact CG2-CB 4.08Å; V168-H274 VanDerWaalsContact CG2-CG 3.47Å; V168-H274 WeakPolarHBondContact CG2-ND1 3.03Å; V168-E277 HydrophobicContact CG1-CB 3.78Å; V168-E277 HydrophobicContact CG1-CG 3.85Å
169	E	85.3	Confident	87.9	Confident	137 Å²	137	43 Å²	43	64%	0.64	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-59.5	135.3	169.6	-179	168.4	-162.9	0	0	111	T171 T247	E169-T171 PolarHBondContact O-N 2.9Å; E169-T247 HydrophobicContact CG-CG2 3.84Å
170	G	70.3	Confident	87.8	Confident	31 Å²	31	40.7 Å²	40.7	32%	0.32	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64	131.9	173.3	0	0	0	0	0	109.6	V168 G172 L246	V168-G170 PolarHBondContact O-N 2.82Å; G170-G172 PolarHBondContact O-N 2.89Å; G170-L246 PolarHBondContact N-O 3.25Å
171	T	56.2	Low	87.7	Confident	118 Å²	118	43.2 Å²	43.2	72%	0.724	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-57.1	134.6	175.8	56.3	0	0	0	0	109	E169 S173	E169-T171 PolarHBondContact O-N 2.9Å; T171-S173 PolarHBondContact O-N 2.7Å
172	G	51.2	Low	87.6	Confident	88 Å²	88	43.7 Å²	43.7	91%	0.907	29%	0.286	S	S	*	.	S	Bend	trans	-61.8	25.8	-159.9	0	0	0	0	0	119.4	G170	G170-G172 PolarHBondContact O-N 2.89Å
173	S	59	Low	87.6	Confident	104 Å²	104	43.7 Å²	43.7	73%	0.727	29%	0.286	S	S	*	.			trans	-121.4	37.1	178.5	-59.1	0	0	0	0	112.3	T171	T171-S173 PolarHBondContact O-N 2.7Å
174	S	78.4	Confident	87.5	Confident	42 Å²	42	50.6 Å²	50.6	29%	0.294	31%	0.312	S	S	.	.			trans	-69.7	133.5	173	179.4	0	0	0	0	110.9	F176 P177 L246	S174-F176 VanDerWaalsContact C-N 3.26Å; S174-F176 PolarHBondContact O-N 2.95Å; S174-F176 WeakPolarHBondContact OG-CD2 3.35Å; S174-F176 VanDerWaalsContact OG-CG 3.27Å; S174-F176 WeakPolarHBondContact OG-CG 3.38Å; S174-F176 PolarHBondContact OG-N 3.41Å; S174-P177 VanDerWaalsContact O-CD 3.3Å; S174-P177 WeakPolarHBondContact O-CD 3.23Å; S174-L246 VanDerWaalsContact CB-CD2 3.44Å; S174-L246 WeakPolarHBondContact OG-CD2 3.27Å
175	H	90.1	Very high	87.4	Confident	120 Å²	120	55.6 Å²	55.6	56%	0.556	34%	0.343	S	S	*	.	S	Bend	trans	-78.7	-7.5	174.5	-62.7	-59.5	0	0	0	113.5	A178 Y179	H175-A178 WeakPolarHBondContact O-CB 3.33Å; H175-A178 PolarHBondContact O-N 3.09Å; H175-A178 VanDerWaalsContact O-N 3.14Å; H175-Y179 HydrophobicContact CB-CD1 4.2Å; H175-Y179 HydrophobicContact CB-CD2 4.43Å; H175-Y179 HydrophobicContact CB-CE1 3.54Å; H175-Y179 HydrophobicContact CB-CE2 3.77Å; H175-Y179 WeakPolarHBondContact CB-OH 3.32Å; H175-Y179 VanDerWaalsContact O-CD1 3.31Å; H175-Y179 WeakPolarHBondContact O-CD1 3.16Å; H175-Y179 VanDerWaalsContact O-CG 3.29Å; H175-Y179 PolarHBondContact O-N 2.8Å
176	F	92.6	Very high	87.3	Confident	39 Å²	39	56.3 Å²	56.3	17%	0.171	35%	0.347	C	S	.	.	H	α-helix	trans	-57.6	-41.5	-175.8	-58.2	-37.1	0	0	0	114.3	L74 F75 S174 A178 Y179 V180 L242 L246 F269	L74-F176 HydrophobicContact CD2-CB 4.18Å; L74-F176 HydrophobicContact CD2-CD1 4.23Å; L74-F176 HydrophobicContact CD2-CD2 3.79Å; L74-F176 HydrophobicContact CD2-CE2 4.22Å; L74-F176 HydrophobicContact CD2-CG 3.82Å; F75-F176 AromaticContact CE2-CD1 3.68Å; F75-F176 HydrophobicContact CE2-CD1 3.68Å; F75-F176 HydrophobicContact CE2-CE1 4.21Å; F75-F176 HydrophobicContact CE2-CG 4.3Å; F75-F176 HydrophobicContact CZ-CB 4.43Å; F75-F176 HydrophobicContact CZ-CD1 4.4Å; S174-F176 VanDerWaalsContact C-N 3.26Å; S174-F176 PolarHBondContact O-N 2.95Å; S174-F176 WeakPolarHBondContact OG-CD2 3.35Å; S174-F176 VanDerWaalsContact OG-CG 3.27Å; S174-F176 WeakPolarHBondContact OG-CG 3.38Å; S174-F176 PolarHBondContact OG-N 3.41Å; F176-A178 VanDerWaalsContact C-N 3.31Å; F176-A178 PolarHBondContact O-N 3.34Å; F176-Y179 HydrophobicContact CD1-CD2 4Å; F176-Y179 HydrophobicContact CD1-CE2 4.27Å; F176-Y179 PolarHBondContact O-N 3.27Å; F176-Y179 VanDerWaalsContact O-N 3.15Å; F176-V180 WeakPolarHBondContact O-CG2 3.47Å; F176-V180 PolarHBondContact O-N 2.67Å; F176-L242 HydrophobicContact CB-CD1 4.35Å; F176-L242 HydrophobicContact CB-CD2 3.92Å; F176-L242 HydrophobicContact CB-CG 4.46Å; F176-L246 HydrophobicContact CD2-CD2 3.81Å; F176-L246 HydrophobicContact CE2-CD2 4.46Å; F176-F269 HydrophobicContact CE2-CE1 4.44Å; F176-F269 HydrophobicContact CZ-CE1 4.22Å; F176-F269 HydrophobicContact CZ-CZ 4.02Å
177	P	94.3	Very high	87.1	Confident	62 Å²	62	61.8 Å²	61.8	40%	0.403	38%	0.376	S	S	.	.	H	α-helix	trans	-59.7	-42.1	176.4	-20.7	29.9	0	0	0	112.2	S174 Y179 V180 A181 L242 L246	S174-P177 VanDerWaalsContact O-CD 3.3Å; S174-P177 WeakPolarHBondContact O-CD 3.23Å; P177-Y179 VanDerWaalsContact C-N 3.33Å; P177-Y179 PolarHBondContact O-N 3.45Å; P177-V180 PolarHBondContact O-N 3.24Å; P177-A181 WeakPolarHBondContact O-CB 3.45Å; P177-A181 PolarHBondContact O-N 3.45Å; P177-L242 HydrophobicContact CB-CD2 3.91Å; P177-L242 HydrophobicContact CG-CD2 3.66Å; P177-L242 VanDerWaalsContact N-CD2 3.27Å; P177-L246 HydrophobicContact CG-CD1 4.35Å
178	A	95.6	Very high	86.8	Confident	45 Å²	45	62.8 Å²	62.8	37%	0.372	38%	0.381	S	S	.	.	H	α-helix	trans	-65.7	-37.1	176.9	0	0	0	0	0	111.7	H175 F176 A181 A182 V208	H175-A178 WeakPolarHBondContact O-CB 3.33Å; H175-A178 PolarHBondContact O-N 3.09Å; H175-A178 VanDerWaalsContact O-N 3.14Å; F176-A178 VanDerWaalsContact C-N 3.31Å; F176-A178 PolarHBondContact O-N 3.34Å; A178-A181 PolarHBondContact O-N 3.31Å; A178-A182 VanDerWaalsContact O-CB 3.32Å; A178-A182 WeakPolarHBondContact O-CB 3.41Å; A178-A182 PolarHBondContact O-N 2.84Å; A178-V208 HydrophobicContact CB-CG1 3.88Å
179	Y	96.9	Very high	86.6	Confident	21 Å²	21	64.9 Å²	64.9	8%	0.082	40%	0.395	C	S	.	.	H	α-helix	trans	-66	-46.8	176.8	-61.1	-11.9	0	0	0	111.9	F75 H175 F176 P177 A181 A182 M183 V208 V209 V214 L218	F75-Y179 HydrophobicContact CE2-CD2 4.41Å; H175-Y179 HydrophobicContact CB-CD1 4.2Å; H175-Y179 HydrophobicContact CB-CD2 4.43Å; H175-Y179 HydrophobicContact CB-CE1 3.54Å; H175-Y179 HydrophobicContact CB-CE2 3.77Å; H175-Y179 WeakPolarHBondContact CB-OH 3.32Å; H175-Y179 VanDerWaalsContact O-CD1 3.31Å; H175-Y179 WeakPolarHBondContact O-CD1 3.16Å; H175-Y179 VanDerWaalsContact O-CG 3.29Å; H175-Y179 PolarHBondContact O-N 2.8Å; F176-Y179 HydrophobicContact CD1-CD2 4Å; F176-Y179 HydrophobicContact CD1-CE2 4.27Å; F176-Y179 PolarHBondContact O-N 3.27Å; F176-Y179 VanDerWaalsContact O-N 3.15Å; P177-Y179 VanDerWaalsContact C-N 3.33Å; P177-Y179 PolarHBondContact O-N 3.45Å; Y179-A181 VanDerWaalsContact C-N 3.33Å; Y179-A181 PolarHBondContact O-N 3.48Å; Y179-A182 PolarHBondContact O-N 3.38Å; Y179-M183 WeakPolarHBondContact O-CB 3.35Å; Y179-M183 VanDerWaalsContact O-CG 3.25Å; Y179-M183 WeakPolarHBondContact O-CG 3.45Å; Y179-M183 PolarHBondContact O-N 2.86Å; Y179-V208 HydrophobicContact CD1-CG1 4.44Å; Y179-V209 HydrophobicContact CD1-CB 4.37Å; Y179-V209 HydrophobicContact CD1-CG1 4.33Å; Y179-V209 HydrophobicContact CD1-CG2 3.6Å; Y179-V209 HydrophobicContact CE1-CB 4.22Å; Y179-V209 HydrophobicContact CE1-CG1 3.99Å; Y179-V209 HydrophobicContact CE1-CG2 3.95Å; Y179-V209 HydrophobicContact CG-CG2 4.21Å; Y179-V214 HydrophobicContact CD2-CG1 4.11Å; Y179-V214 HydrophobicContact CE2-CG1 3.55Å; Y179-L218 HydrophobicContact CD2-CD1 4.43Å; Y179-L218 HydrophobicContact CG-CD1 4.28Å
180	V	97.2	Very high	86.5	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.012	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-45.3	176.4	175.2	0	0	0	0	110.4	F75 F176 P177 A182 M183 R184 L238 A239 L242	F75-V180 HydrophobicContact CE1-CG2 3.78Å; F75-V180 HydrophobicContact CZ-CG2 3.83Å; F176-V180 WeakPolarHBondContact O-CG2 3.47Å; F176-V180 PolarHBondContact O-N 2.67Å; P177-V180 PolarHBondContact O-N 3.24Å; V180-A182 PolarHBondContact O-N 3.25Å; V180-M183 PolarHBondContact O-N 3.15Å; V180-R184 WeakPolarHBondContact O-CG 3.3Å; V180-R184 PolarHBondContact O-N 2.85Å; V180-L238 HydrophobicContact CG1-CB 4.48Å; V180-L238 HydrophobicContact CG2-CB 4.35Å; V180-A239 HydrophobicContact CG1-CB 3.83Å; V180-L242 HydrophobicContact CG2-CD2 4.31Å
181	A	97	Very high	87.2	Confident	53 Å²	53	65.8 Å²	65.8	44%	0.438	42%	0.416	S	S	.	.	H	α-helix	trans	-58.9	-48.3	176.2	0	0	0	0	0	111.7	P177 A178 Y179 M183 R184 T185	P177-A181 WeakPolarHBondContact O-CB 3.45Å; P177-A181 PolarHBondContact O-N 3.45Å; A178-A181 PolarHBondContact O-N 3.31Å; Y179-A181 VanDerWaalsContact C-N 3.33Å; Y179-A181 PolarHBondContact O-N 3.48Å; A181-M183 PolarHBondContact O-N 2.99Å; A181-R184 PolarHBondContact O-N 3.41Å; A181-T185 WeakPolarHBondContact O-CG2 3.46Å; A181-T185 PolarHBondContact O-N 3.19Å
182	A	97.6	Very high	88.6	Confident	10 Å²	10	62.6 Å²	62.6	8%	0.083	39%	0.394	C	S	.	.	H	α-helix	trans	-60.7	-44.5	178.1	0	0	0	0	0	112	A178 Y179 V180 R184 T185 V186 L205 V208	A178-A182 VanDerWaalsContact O-CB 3.32Å; A178-A182 WeakPolarHBondContact O-CB 3.41Å; A178-A182 PolarHBondContact O-N 2.84Å; Y179-A182 PolarHBondContact O-N 3.38Å; V180-A182 PolarHBondContact O-N 3.25Å; A182-R184 VanDerWaalsContact C-N 3.3Å; A182-R184 PolarHBondContact O-N 3.31Å; A182-T185 PolarHBondContact O-N 2.84Å; A182-T185 PolarHBondContact O-OG1 3.3Å; A182-V186 PolarHBondContact O-N 3.11Å; A182-L205 HydrophobicContact CB-CD2 3.84Å; A182-V208 HydrophobicContact CB-CB 3.93Å; A182-V208 HydrophobicContact CB-CG1 4.01Å; A182-V208 HydrophobicContact CB-CG2 4.05Å
183	M	97.6	Very high	90.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-60.2	-38.3	177.3	-71.1	175.2	76.8	0	0	112.5	Y179 V180 A181 T185 V186 L205 L218 W231 L233 L235	Y179-M183 WeakPolarHBondContact O-CB 3.35Å; Y179-M183 VanDerWaalsContact O-CG 3.25Å; Y179-M183 WeakPolarHBondContact O-CG 3.45Å; Y179-M183 PolarHBondContact O-N 2.86Å; V180-M183 PolarHBondContact O-N 3.15Å; A181-M183 PolarHBondContact O-N 2.99Å; M183-T185 PolarHBondContact O-N 3.11Å; M183-V186 WeakPolarHBondContact O-CB 3.34Å; M183-V186 PolarHBondContact O-N 3.43Å; M183-L205 HydrophobicContact CG-CD2 4.04Å; M183-L218 HydrophobicContact CE-CB 4.38Å; M183-L218 HydrophobicContact CG-CD1 4.42Å; M183-L218 HydrophobicContact SD-CB 4.2Å; M183-L218 HydrophobicContact SD-CD1 4.06Å; M183-L218 HydrophobicContact SD-CD2 3.9Å; M183-L218 HydrophobicContact SD-CG 4.27Å; M183-W231 HydrophobicContact CB-CZ2 4.17Å; M183-W231 HydrophobicContact CE-CD2 3.69Å; M183-W231 HydrophobicContact CE-CE3 3.38Å; M183-W231 HydrophobicContact CE-CG 4.4Å; M183-W231 HydrophobicContact CE-CH2 3.92Å; M183-W231 HydrophobicContact CE-CZ2 4.19Å; M183-W231 HydrophobicContact CE-CZ3 3.51Å; M183-W231 HydrophobicContact CG-CH2 4.41Å; M183-W231 HydrophobicContact CG-CZ2 4.21Å; M183-W231 PolarHBondContact O-NE1 3.47Å; M183-L233 HydrophobicContact CE-CD1 3.88Å; M183-L235 HydrophobicContact CB-CD1 3.69Å; M183-L235 HydrophobicContact CB-CD2 4.31Å; M183-L235 HydrophobicContact CE-CD2 4.01Å; M183-L235 HydrophobicContact SD-CD2 4.19Å
184	R	96.7	Very high	91.8	Very high	145 Å²	145	63.9 Å²	63.9	55%	0.547	37%	0.366	S	S	.	.	H	α-helix	trans	-66.4	-24.3	176	-69	174.3	80.4	-152.5	4.3	113.1	V180 A181 A182 L235 D236	V180-R184 WeakPolarHBondContact O-CG 3.3Å; V180-R184 PolarHBondContact O-N 2.85Å; A181-R184 PolarHBondContact O-N 3.41Å; A182-R184 VanDerWaalsContact C-N 3.3Å; A182-R184 PolarHBondContact O-N 3.31Å; R184-L235 HydrophobicContact CG-CB 3.78Å; R184-L235 HydrophobicContact CG-CD1 3.85Å; R184-L235 HydrophobicContact CG-CG 4.46Å; R184-D236 IonicContact CZ-OD1 2.77Å; R184-D236 VanDerWaalsContact CZ-OD1 3.22Å; R184-D236 IonicContact NE-OD1 3.18Å; R184-D236 PolarHBondContact NE-OD1 3.48Å; R184-D236 VanDerWaalsContact NE-OD1 3.09Å; R184-D236 IonicContact NH2-OD1 3.15Å; R184-D236 PolarHBondContact NH2-OD1 3.15Å
185	T	96.1	Very high	92.3	Very high	107 Å²	107	66.3 Å²	66.3	66%	0.656	38%	0.384	S	S	*	.	H	α-helix	trans	-87.5	-10.1	177	64.6	0	0	0	0	113.9	A181 A182 M183 N187	A181-T185 WeakPolarHBondContact O-CG2 3.46Å; A181-T185 PolarHBondContact O-N 3.19Å; A182-T185 PolarHBondContact O-N 2.84Å; A182-T185 PolarHBondContact O-OG1 3.3Å; M183-T185 PolarHBondContact O-N 3.11Å; T185-N187 PolarHBondContact O-N 3.09Å; T185-N187 VanDerWaalsContact O-N 3.15Å
186	V	95.3	Very high	92.5	Very high	22 Å²	22	68.6 Å²	68.6	13%	0.133	39%	0.387	C	S	.	.			trans	-63.5	118.9	179.8	169.8	0	0	0	0	109.6	A182 M183 I188 A201 Q204 L205 W231	A182-V186 PolarHBondContact O-N 3.11Å; M183-V186 WeakPolarHBondContact O-CB 3.34Å; M183-V186 PolarHBondContact O-N 3.43Å; V186-I188 HydrophobicContact CG1-CD1 3.85Å; V186-I188 HydrophobicContact CG1-CG1 3.87Å; V186-A201 HydrophobicContact CG1-CB 3.91Å; V186-Q204 HydrophobicContact CG2-CB 4.41Å; V186-L205 HydrophobicContact CG2-CD1 4.5Å; V186-L205 HydrophobicContact CG2-CD2 3.71Å; V186-L205 HydrophobicContact CG2-CG 3.82Å; V186-W231 HydrophobicContact CB-CZ2 3.96Å; V186-W231 HydrophobicContact CG1-CZ2 4.08Å; V186-W231 HydrophobicContact CG2-CZ2 3.99Å
187	N	92.5	Very high	92.4	Very high	117 Å²	117	66.7 Å²	66.7	63%	0.626	38%	0.379	S	S	*	.			trans	-116.4	117.7	179.8	-178	32.9	0	0	0	109.8	T185 Q204	T185-N187 PolarHBondContact O-N 3.09Å; T185-N187 VanDerWaalsContact O-N 3.15Å; N187-Q204 PolarHBondContact O-NE2 2.74Å
188	I	89.9	Confident	92.4	Very high	27 Å²	27	67.3 Å²	67.3	14%	0.138	37%	0.373	C	S	.	.			trans	-118	120.2	-178.9	-54.6	-60.2	0	0	0	109.1	V186 L192 A197 L200 A201 L229	V186-I188 HydrophobicContact CG1-CD1 3.85Å; V186-I188 HydrophobicContact CG1-CG1 3.87Å; I188-L192 HydrophobicContact CG2-CD1 4.16Å; I188-A197 HydrophobicContact CG2-CB 3.61Å; I188-L200 HydrophobicContact CD1-CB 4.06Å; I188-L200 HydrophobicContact CD1-CD2 3.88Å; I188-L200 HydrophobicContact CD1-CG 3.89Å; I188-A201 HydrophobicContact CD1-CB 3.92Å; I188-L229 HydrophobicContact CG2-CD1 3.85Å
189	P	88.1	Confident	92.4	Very high	73 Å²	73	71.5 Å²	71.5	47%	0.474	38%	0.383	S	S	.	.			trans	-57.6	140.6	174.8	-25.1	33.4	0	0	0	112.8	L192	P189-L192 HydrophobicContact CB-CD1 4.08Å; P189-L192 HydrophobicContact CB-CG 4.3Å; P189-L192 HydrophobicContact CG-CD1 4.11Å
190	D	84.8	Confident	92.4	Very high	107 Å²	107	72.8 Å²	72.8	57%	0.572	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	149.6	174.1	-74.2	-23.3	0	0	0	111.2	L192 R228	D190-L192 VanDerWaalsContact C-N 3.3Å; D190-L192 PolarHBondContact O-N 3.41Å; D190-R228 VanDerWaalsContact CG-NH1 3.34Å; D190-R228 IonicContact OD1-NH1 2.63Å; D190-R228 PolarHBondContact OD1-NH1 2.94Å; D190-R228 IonicContact OD2-CZ 3.65Å; D190-R228 IonicContact OD2-NH1 3.83Å; D190-R228 PolarHBondContact OD2-NH1 3.06Å; D190-R228 IonicContact OD2-NH2 2.68Å
191	G	83.6	Confident	92.3	Very high	79 Å²	79	72.7 Å²	72.7	81%	0.814	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	4.1	174	0	0	0	0	0	116
192	L	86.7	Confident	92.4	Very high	51 Å²	51	71.6 Å²	71.6	27%	0.267	38%	0.377	S	S	.	.			trans	-73.7	139.2	173.2	-70.7	-179.9	0	0	0	111.9	I188 P189 D190 R194 R196 A197 L200	I188-L192 HydrophobicContact CG2-CD1 4.16Å; P189-L192 HydrophobicContact CB-CD1 4.08Å; P189-L192 HydrophobicContact CB-CG 4.3Å; P189-L192 HydrophobicContact CG-CD1 4.11Å; D190-L192 VanDerWaalsContact C-N 3.3Å; D190-L192 PolarHBondContact O-N 3.41Å; L192-R194 PolarHBondContact O-N 3.47Å; L192-R196 HydrophobicContact CD2-CG 4.5Å; L192-A197 HydrophobicContact CB-CB 4.27Å; L192-L200 HydrophobicContact CD1-CD2 4.28Å
193	P	88.6	Confident	92.4	Very high	85 Å²	85	75.7 Å²	75.7	55%	0.552	40%	0.395	S	S	*	.			trans	-56.7	140.6	167.9	-23.5	33.2	0	0	0	111	S195 R196 A197	P193-S195 PolarHBondContact O-N 3.3Å; P193-R196 PolarHBondContact O-N 3.02Å; P193-A197 PolarHBondContact O-N 3.1Å
194	R	87.7	Confident	92.4	Very high	134 Å²	134	78.9 Å²	78.9	51%	0.506	41%	0.41	S	S	.	.	H	α-helix	trans	-48.8	-40.5	-176.7	-175.7	177.8	179.1	137.2	3.6	114	L192 R198	L192-R194 PolarHBondContact O-N 3.47Å; R194-R198 WeakPolarHBondContact O-CB 3.21Å; R194-R198 PolarHBondContact O-N 3.2Å
195	S	90.3	Very high	92.4	Very high	94 Å²	94	72 Å²	72	66%	0.657	38%	0.384	S	S	*	.	H	α-helix	trans	-63.2	-42.9	178.4	54.4	0	0	0	0	112.6	P193 K199	P193-S195 PolarHBondContact O-N 3.3Å; S195-K199 PolarHBondContact O-N 2.97Å; S195-K199 VanDerWaalsContact O-N 3.1Å
196	R	92.6	Very high	92.5	Very high	167 Å²	167	69.4 Å²	69.4	63%	0.63	37%	0.37	S	S	*	.	H	α-helix	trans	-71.4	-41	179.4	-173.5	165.4	-178.1	168.5	1.5	111.7	L192 P193 K199 L200	L192-R196 HydrophobicContact CD2-CG 4.5Å; P193-R196 PolarHBondContact O-N 3.02Å; R196-K199 PolarHBondContact O-N 2.87Å; R196-L200 PolarHBondContact O-N 3.15Å
197	A	91.9	Very high	92.5	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-44.2	173.7	0	0	0	0	0	112.8	I188 L192 P193 K199 L200 A201 L229	I188-A197 HydrophobicContact CG2-CB 3.61Å; L192-A197 HydrophobicContact CB-CB 4.27Å; P193-A197 PolarHBondContact O-N 3.1Å; A197-K199 VanDerWaalsContact C-N 3.31Å; A197-K199 PolarHBondContact O-N 3.24Å; A197-L200 PolarHBondContact O-N 3.01Å; A197-A201 PolarHBondContact O-N 3.37Å; A197-L229 HydrophobicContact CB-CD1 3.08Å
198	R	93.8	Very high	92.7	Very high	74 Å²	74	70.1 Å²	70.1	28%	0.279	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-41.6	175.5	-173.2	-177.8	-178.5	90	4.9	111.6	R194 A201 D202 Q216 L219	R194-R198 WeakPolarHBondContact O-CB 3.21Å; R194-R198 PolarHBondContact O-N 3.2Å; R198-A201 PolarHBondContact O-N 3.13Å; R198-D202 WeakPolarHBondContact O-CB 3.49Å; R198-D202 PolarHBondContact O-N 2.8Å; R198-Q216 PolarHBondContact NH2-O 3.18Å; R198-L219 HydrophobicContact CG-CD1 4.49Å; R198-L219 PolarHBondContact NH1-O 3.02Å
199	K	95.7	Very high	93	Very high	134 Å²	134	68.8 Å²	68.8	58%	0.583	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-45.4	176.1	-172.3	-176.4	179.4	-166.6	0	111.7	S195 R196 A197 A201 D202 E203	S195-K199 PolarHBondContact O-N 2.97Å; S195-K199 VanDerWaalsContact O-N 3.1Å; R196-K199 PolarHBondContact O-N 2.87Å; A197-K199 VanDerWaalsContact C-N 3.31Å; A197-K199 PolarHBondContact O-N 3.24Å; K199-A201 PolarHBondContact O-N 2.92Å; K199-D202 WeakPolarHBondContact O-CB 3.43Å; K199-D202 PolarHBondContact O-N 3.05Å; K199-E203 WeakPolarHBondContact CE-OE1 3.3Å; K199-E203 IonicContact NZ-OE1 3.22Å; K199-E203 WeakPolarHBondContact O-CG 3.28Å; K199-E203 PolarHBondContact O-N 2.88Å
200	L	96.2	Very high	93.3	Very high	47 Å²	47	72.9 Å²	72.9	25%	0.246	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-42	177.9	179.3	62.1	0	0	0	112	I188 L192 R196 A197 D202 E203 Q204	I188-L200 HydrophobicContact CD1-CB 4.06Å; I188-L200 HydrophobicContact CD1-CD2 3.88Å; I188-L200 HydrophobicContact CD1-CG 3.89Å; L192-L200 HydrophobicContact CD1-CD2 4.28Å; R196-L200 PolarHBondContact O-N 3.15Å; A197-L200 PolarHBondContact O-N 3.01Å; L200-D202 VanDerWaalsContact C-N 3.33Å; L200-D202 PolarHBondContact O-N 3.44Å; L200-E203 PolarHBondContact O-N 3.27Å; L200-Q204 WeakPolarHBondContact O-CG 3.38Å; L200-Q204 PolarHBondContact O-N 2.87Å
201	A	96.6	Very high	93.8	Very high	0 Å²	0	72 Å²	72	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-40.6	174.1	0	0	0	0	0	111.8	V186 I188 A197 R198 K199 Q204 L205 L219 L222	V186-A201 HydrophobicContact CG1-CB 3.91Å; I188-A201 HydrophobicContact CD1-CB 3.92Å; A197-A201 PolarHBondContact O-N 3.37Å; R198-A201 PolarHBondContact O-N 3.13Å; K199-A201 PolarHBondContact O-N 2.92Å; A201-Q204 PolarHBondContact O-N 3.16Å; A201-L205 WeakPolarHBondContact O-CB 3.43Å; A201-L205 VanDerWaalsContact O-CG 3.27Å; A201-L205 WeakPolarHBondContact O-CG 3.41Å; A201-L205 PolarHBondContact O-N 3.27Å; A201-L219 HydrophobicContact CB-CD2 3.5Å; A201-L219 VanDerWaalsContact CB-CD2 3.5Å; A201-L222 HydrophobicContact CB-CD2 3.78Å
202	D	97.6	Very high	94.3	Very high	30 Å²	30	72.9 Å²	72.9	16%	0.16	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-46.5	174.6	-170.2	63.4	0	0	0	111.9	R198 K199 L200 L205 S206 R215 Q216 L219	R198-D202 WeakPolarHBondContact O-CB 3.49Å; R198-D202 PolarHBondContact O-N 2.8Å; K199-D202 WeakPolarHBondContact O-CB 3.43Å; K199-D202 PolarHBondContact O-N 3.05Å; L200-D202 VanDerWaalsContact C-N 3.33Å; L200-D202 PolarHBondContact O-N 3.44Å; D202-L205 PolarHBondContact O-N 3.37Å; D202-S206 WeakPolarHBondContact O-CB 3.5Å; D202-S206 PolarHBondContact O-N 2.83Å; D202-R215 WeakPolarHBondContact O-CD 3.44Å; D202-R215 WeakPolarHBondContact OD1-CD 3.47Å; D202-R215 WeakPolarHBondContact OD1-CG 3.44Å; D202-R215 IonicContact OD1-CZ 3.74Å; D202-R215 IonicContact OD1-NE 3.89Å; D202-R215 PolarHBondContact OD1-NE 2.87Å; D202-R215 IonicContact OD1-NH2 2.71Å; D202-R215 IonicContact OD2-NE 3.67Å; D202-R215 IonicContact OD2-NH2 3.72Å; D202-Q216 PolarHBondContact OD1-NE2 3.23Å; D202-L219 HydrophobicContact CB-CD1 3.68Å; D202-L219 WeakPolarHBondContact OD1-CD1 3.31Å
203	E	97.4	Very high	94.6	Very high	97 Å²	97	73 Å²	73	45%	0.453	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-47.4	177.3	-72.3	167.6	-177.6	0	0	111.3	K199 L200 L205 S206	K199-E203 WeakPolarHBondContact CE-OE1 3.3Å; K199-E203 IonicContact NZ-OE1 3.22Å; K199-E203 WeakPolarHBondContact O-CG 3.28Å; K199-E203 PolarHBondContact O-N 2.88Å; L200-E203 PolarHBondContact O-N 3.27Å; E203-L205 PolarHBondContact O-N 3.43Å; E203-S206 WeakPolarHBondContact O-CB 3.24Å; E203-S206 PolarHBondContact O-N 3.23Å; E203-S206 PolarHBondContact O-OG 3.03Å
204	Q	97.6	Very high	94.9	Very high	67 Å²	67	70.1 Å²	70.1	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-64.1	-38.2	178.6	-71	179.4	33.9	0	0	112.9	V186 N187 L200 A201 S206	V186-Q204 HydrophobicContact CG2-CB 4.41Å; N187-Q204 PolarHBondContact O-NE2 2.74Å; L200-Q204 WeakPolarHBondContact O-CG 3.38Å; L200-Q204 PolarHBondContact O-N 2.87Å; A201-Q204 PolarHBondContact O-N 3.16Å; Q204-S206 VanDerWaalsContact C-N 3.34Å
205	L	97.9	Very high	95.4	Very high	1 Å²	1	65 Å²	65	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-75.2	-22.1	178.5	-72	174.3	0	0	0	113.1	A182 M183 V186 A201 D202 E203 S207 V208 V209 R215 L219 W231	A182-L205 HydrophobicContact CB-CD2 3.84Å; M183-L205 HydrophobicContact CG-CD2 4.04Å; V186-L205 HydrophobicContact CG2-CD1 4.5Å; V186-L205 HydrophobicContact CG2-CD2 3.71Å; V186-L205 HydrophobicContact CG2-CG 3.82Å; A201-L205 WeakPolarHBondContact O-CB 3.43Å; A201-L205 VanDerWaalsContact O-CG 3.27Å; A201-L205 WeakPolarHBondContact O-CG 3.41Å; A201-L205 PolarHBondContact O-N 3.27Å; D202-L205 PolarHBondContact O-N 3.37Å; E203-L205 PolarHBondContact O-N 3.43Å; L205-S207 VanDerWaalsContact C-N 3.26Å; L205-S207 PolarHBondContact O-N 3.34Å; L205-V208 PolarHBondContact O-N 3.37Å; L205-V208 VanDerWaalsContact O-N 3.14Å; L205-V209 HydrophobicContact CB-CG2 4.33Å; L205-V209 HydrophobicContact CD2-CG2 4.41Å; L205-V209 PolarHBondContact O-N 2.82Å; L205-R215 HydrophobicContact CB-CG 3.87Å; L205-R215 HydrophobicContact CD1-CG 4.3Å; L205-L219 HydrophobicContact CD1-CD2 4.03Å; L205-L219 HydrophobicContact CD1-CG 4.25Å; L205-W231 HydrophobicContact CD1-CH2 4.2Å
206	S	97.3	Very high	95.7	Very high	51 Å²	51	63.6 Å²	63.6	36%	0.357	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28	-168.3	69.3	0	0	0	0	115	D202 E203 Q204 V208	D202-S206 WeakPolarHBondContact O-CB 3.5Å; D202-S206 PolarHBondContact O-N 2.83Å; E203-S206 WeakPolarHBondContact O-CB 3.24Å; E203-S206 PolarHBondContact O-N 3.23Å; E203-S206 PolarHBondContact O-OG 3.03Å; Q204-S206 VanDerWaalsContact C-N 3.34Å; S206-V208 VanDerWaalsContact C-N 3.34Å
207	S	94.8	Very high	95.8	Very high	90 Å²	90	57.1 Å²	57.1	63%	0.629	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-31.3	178.7	58.6	0	0	0	0	112.9	L205	L205-S207 VanDerWaalsContact C-N 3.26Å; L205-S207 PolarHBondContact O-N 3.34Å
208	V	97	Very high	96	Very high	64 Å²	64	57.1 Å²	57.1	39%	0.388	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-42.9	-178.7	-177.9	0	0	0	0	111.2	A178 Y179 A182 L205 S206 Q210	A178-V208 HydrophobicContact CB-CG1 3.88Å; Y179-V208 HydrophobicContact CD1-CG1 4.44Å; A182-V208 HydrophobicContact CB-CB 3.93Å; A182-V208 HydrophobicContact CB-CG1 4.01Å; A182-V208 HydrophobicContact CB-CG2 4.05Å; L205-V208 PolarHBondContact O-N 3.37Å; L205-V208 VanDerWaalsContact O-N 3.14Å; S206-V208 VanDerWaalsContact C-N 3.34Å; V208-Q210 PolarHBondContact O-N 3.06Å
209	V	96.6	Very high	96.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.285	C	S	.	.			trans	-100	76.9	-178.5	-163.5	0	0	0	0	109	Y179 L205 N211 V214 R215 L218	Y179-V209 HydrophobicContact CD1-CB 4.37Å; Y179-V209 HydrophobicContact CD1-CG1 4.33Å; Y179-V209 HydrophobicContact CD1-CG2 3.6Å; Y179-V209 HydrophobicContact CE1-CB 4.22Å; Y179-V209 HydrophobicContact CE1-CG1 3.99Å; Y179-V209 HydrophobicContact CE1-CG2 3.95Å; Y179-V209 HydrophobicContact CG-CG2 4.21Å; L205-V209 HydrophobicContact CB-CG2 4.33Å; L205-V209 HydrophobicContact CD2-CG2 4.41Å; L205-V209 PolarHBondContact O-N 2.82Å; V209-N211 VanDerWaalsContact C-N 3.35Å; V209-N211 PolarHBondContact O-N 2.83Å; V209-V214 HydrophobicContact CG1-CB 3.99Å; V209-V214 HydrophobicContact CG1-CG1 3.66Å; V209-R215 HydrophobicContact CB-CB 4.17Å; V209-R215 HydrophobicContact CB-CG 4.22Å; V209-R215 HydrophobicContact CG1-CB 3.8Å; V209-R215 HydrophobicContact CG1-CG 4.35Å; V209-R215 PolarHBondContact O-NH1 3.16Å; V209-L218 HydrophobicContact CG1-CD1 4.12Å; V209-L218 HydrophobicContact CG2-CD1 3.92Å
210	Q	95.1	Very high	96.2	Very high	158 Å²	158	49.7 Å²	49.7	74%	0.738	27%	0.273	S	S	*	.			trans	-66.3	-36.5	-174.2	-64.2	179.9	-2.5	0	0	112.7	V208 L212 R215	V208-Q210 PolarHBondContact O-N 3.06Å; Q210-L212 PolarHBondContact O-N 3.03Å; Q210-R215 PolarHBondContact O-NH1 2.93Å
211	N	94.4	Very high	96.2	Very high	88 Å²	88	47.4 Å²	47.4	47%	0.471	26%	0.261	S	S	.	.			trans	-68.7	115.2	177.6	-175.2	-54.2	0	0	0	110.4	V209 A213 V214 R215	V209-N211 VanDerWaalsContact C-N 3.35Å; V209-N211 PolarHBondContact O-N 2.83Å; N211-A213 VanDerWaalsContact C-N 3.34Å; N211-A213 PolarHBondContact O-N 3.38Å; N211-A213 WeakPolarHBondContact OD1-CB 3.27Å; N211-A213 PolarHBondContact OD1-N 3.04Å; N211-V214 HydrophobicContact CB-CB 4.14Å; N211-V214 HydrophobicContact CB-CG2 3.87Å; N211-V214 PolarHBondContact O-N 3.4Å; N211-V214 PolarHBondContact OD1-N 3.28Å; N211-V214 VanDerWaalsContact OD1-N 3.13Å; N211-R215 PolarHBondContact O-N 3.46Å
212	L	95.3	Very high	96.1	Very high	98 Å²	98	47.9 Å²	47.9	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-59.6	-41	-177.8	178.4	62.6	0	0	0	112.6	Q210 R215 Q216	Q210-L212 PolarHBondContact O-N 3.03Å; L212-R215 PolarHBondContact O-N 3.17Å; L212-Q216 HydrophobicContact CD1-CG 3.99Å; L212-Q216 HydrophobicContact CG-CG 4.34Å; L212-Q216 WeakPolarHBondContact O-CB 3.36Å; L212-Q216 WeakPolarHBondContact O-CG 3.46Å; L212-Q216 PolarHBondContact O-N 3.14Å
213	A	93	Very high	95.9	Very high	53 Å²	53	47.1 Å²	47.1	44%	0.438	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-43.3	-179.1	0	0	0	0	0	111.3	N211 Q216 H217 W296	N211-A213 VanDerWaalsContact C-N 3.34Å; N211-A213 PolarHBondContact O-N 3.38Å; N211-A213 WeakPolarHBondContact OD1-CB 3.27Å; N211-A213 PolarHBondContact OD1-N 3.04Å; A213-Q216 PolarHBondContact O-N 2.99Å; A213-H217 WeakPolarHBondContact O-CB 3.35Å; A213-H217 PolarHBondContact O-N 2.91Å; A213-W296 HydrophobicContact CB-CH2 4.47Å; A213-W296 HydrophobicContact CB-CZ3 3.85Å
214	V	95.1	Very high	95.5	Very high	25 Å²	25	47.7 Å²	47.7	15%	0.152	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-47.8	173	179.6	0	0	0	0	110.7	Y179 V209 N211 Q216 H217 L218 W296	Y179-V214 HydrophobicContact CD2-CG1 4.11Å; Y179-V214 HydrophobicContact CE2-CG1 3.55Å; V209-V214 HydrophobicContact CG1-CB 3.99Å; V209-V214 HydrophobicContact CG1-CG1 3.66Å; N211-V214 HydrophobicContact CB-CB 4.14Å; N211-V214 HydrophobicContact CB-CG2 3.87Å; N211-V214 PolarHBondContact O-N 3.4Å; N211-V214 PolarHBondContact OD1-N 3.28Å; N211-V214 VanDerWaalsContact OD1-N 3.13Å; V214-Q216 PolarHBondContact O-N 3.13Å; V214-H217 WeakPolarHBondContact O-CB 3.19Å; V214-H217 PolarHBondContact O-N 3.04Å; V214-H217 VanDerWaalsContact O-N 3.13Å; V214-L218 HydrophobicContact CG1-CD1 4.48Å; V214-L218 HydrophobicContact CG1-CG 4.47Å; V214-L218 WeakPolarHBondContact O-CG 3.41Å; V214-L218 PolarHBondContact O-N 3.16Å; V214-W296 HydrophobicContact CB-CH2 4.24Å; V214-W296 HydrophobicContact CG2-CH2 3.67Å; V214-W296 HydrophobicContact CG2-CZ2 4.44Å; V214-W296 HydrophobicContact CG2-CZ3 4.5Å
215	R	96.9	Very high	95	Very high	28 Å²	28	48 Å²	48	11%	0.106	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-43.6	-179.6	-164.8	166.3	63.6	-128	9.2	112.2	D202 L205 V209 Q210 N211 L212 H217 L218 L219	D202-R215 WeakPolarHBondContact O-CD 3.44Å; D202-R215 WeakPolarHBondContact OD1-CD 3.47Å; D202-R215 WeakPolarHBondContact OD1-CG 3.44Å; D202-R215 IonicContact OD1-CZ 3.74Å; D202-R215 IonicContact OD1-NE 3.89Å; D202-R215 PolarHBondContact OD1-NE 2.87Å; D202-R215 IonicContact OD1-NH2 2.71Å; D202-R215 IonicContact OD2-NE 3.67Å; D202-R215 IonicContact OD2-NH2 3.72Å; L205-R215 HydrophobicContact CB-CG 3.87Å; L205-R215 HydrophobicContact CD1-CG 4.3Å; V209-R215 HydrophobicContact CB-CB 4.17Å; V209-R215 HydrophobicContact CB-CG 4.22Å; V209-R215 HydrophobicContact CG1-CB 3.8Å; V209-R215 HydrophobicContact CG1-CG 4.35Å; V209-R215 PolarHBondContact O-NH1 3.16Å; Q210-R215 PolarHBondContact O-NH1 2.93Å; N211-R215 PolarHBondContact O-N 3.46Å; L212-R215 PolarHBondContact O-N 3.17Å; R215-H217 VanDerWaalsContact C-N 3.31Å; R215-H217 PolarHBondContact O-N 3.48Å; R215-L218 PolarHBondContact O-N 3.29Å; R215-L219 HydrophobicContact CG-CD1 4.43Å; R215-L219 VanDerWaalsContact O-CG 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.25Å; R215-L219 PolarHBondContact O-N 2.79Å
216	Q	95.9	Very high	94.4	Very high	64 Å²	64	55.8 Å²	55.8	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-35.8	175.3	-70	-51.7	-42.9	0	0	112.6	R198 D202 L212 A213 V214 L219 T220	R198-Q216 PolarHBondContact NH2-O 3.18Å; D202-Q216 PolarHBondContact OD1-NE2 3.23Å; L212-Q216 HydrophobicContact CD1-CG 3.99Å; L212-Q216 HydrophobicContact CG-CG 4.34Å; L212-Q216 WeakPolarHBondContact O-CB 3.36Å; L212-Q216 WeakPolarHBondContact O-CG 3.46Å; L212-Q216 PolarHBondContact O-N 3.14Å; A213-Q216 PolarHBondContact O-N 2.99Å; V214-Q216 PolarHBondContact O-N 3.13Å; Q216-L219 PolarHBondContact O-N 3.18Å; Q216-T220 WeakPolarHBondContact O-CG2 3.19Å; Q216-T220 PolarHBondContact O-N 3.28Å
217	H	95.4	Very high	93.7	Very high	30 Å²	30	56 Å²	56	14%	0.139	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-50	172.9	-177.8	72.1	0	0	0	111.6	F75 A213 V214 R215 L219 T220 W296	F75-H217 PolarHBondContact O-NE2 2.91Å; A213-H217 WeakPolarHBondContact O-CB 3.35Å; A213-H217 PolarHBondContact O-N 2.91Å; V214-H217 WeakPolarHBondContact O-CB 3.19Å; V214-H217 PolarHBondContact O-N 3.04Å; V214-H217 VanDerWaalsContact O-N 3.13Å; R215-H217 VanDerWaalsContact C-N 3.31Å; R215-H217 PolarHBondContact O-N 3.48Å; H217-L219 VanDerWaalsContact C-N 3.3Å; H217-L219 PolarHBondContact O-N 2.73Å; H217-T220 WeakPolarHBondContact O-CB 3.4Å; H217-T220 WeakPolarHBondContact O-CG2 3.34Å; H217-T220 PolarHBondContact O-N 2.84Å; H217-T220 PolarHBondContact O-OG1 3.5Å; H217-W296 HydrophobicContact CB-CH2 4.37Å; H217-W296 HydrophobicContact CB-CZ2 4.14Å
218	L	97.3	Very high	93.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-56.8	-44.8	176.3	-62.7	-180	0	0	0	111.6	F75 Y179 M183 V209 V214 R215 T220 N221	F75-L218 HydrophobicContact CB-CD2 3.78Å; F75-L218 HydrophobicContact CD1-CD2 4.06Å; F75-L218 HydrophobicContact CD2-CD2 3.39Å; F75-L218 HydrophobicContact CE2-CD2 3.91Å; F75-L218 HydrophobicContact CG-CD2 3.46Å; F75-L218 VanDerWaalsContact CG-CD2 3.46Å; F75-L218 HydrophobicContact CZ-CD2 4.44Å; Y179-L218 HydrophobicContact CD2-CD1 4.43Å; Y179-L218 HydrophobicContact CG-CD1 4.28Å; M183-L218 HydrophobicContact CE-CB 4.38Å; M183-L218 HydrophobicContact CG-CD1 4.42Å; M183-L218 HydrophobicContact SD-CB 4.2Å; M183-L218 HydrophobicContact SD-CD1 4.06Å; M183-L218 HydrophobicContact SD-CD2 3.9Å; M183-L218 HydrophobicContact SD-CG 4.27Å; V209-L218 HydrophobicContact CG1-CD1 4.12Å; V209-L218 HydrophobicContact CG2-CD1 3.92Å; V214-L218 HydrophobicContact CG1-CD1 4.48Å; V214-L218 HydrophobicContact CG1-CG 4.47Å; V214-L218 WeakPolarHBondContact O-CG 3.41Å; V214-L218 PolarHBondContact O-N 3.16Å; R215-L218 PolarHBondContact O-N 3.29Å; L218-T220 PolarHBondContact O-N 2.77Å; L218-T220 VanDerWaalsContact O-N 3.1Å; L218-N221 WeakPolarHBondContact O-CB 3.13Å; L218-N221 PolarHBondContact O-N 3Å; L218-N221 PolarHBondContact O-ND2 3.08Å
219	L	96.8	Very high	92.8	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14.3	178.3	-71.3	168.6	0	0	0	113.8	R198 A201 D202 L205 R215 Q216 H217 N221 L222 W231	R198-L219 HydrophobicContact CG-CD1 4.49Å; R198-L219 PolarHBondContact NH1-O 3.02Å; A201-L219 HydrophobicContact CB-CD2 3.5Å; A201-L219 VanDerWaalsContact CB-CD2 3.5Å; D202-L219 HydrophobicContact CB-CD1 3.68Å; D202-L219 WeakPolarHBondContact OD1-CD1 3.31Å; L205-L219 HydrophobicContact CD1-CD2 4.03Å; L205-L219 HydrophobicContact CD1-CG 4.25Å; R215-L219 HydrophobicContact CG-CD1 4.43Å; R215-L219 VanDerWaalsContact O-CG 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.25Å; R215-L219 PolarHBondContact O-N 2.79Å; Q216-L219 PolarHBondContact O-N 3.18Å; H217-L219 VanDerWaalsContact C-N 3.3Å; H217-L219 PolarHBondContact O-N 2.73Å; L219-N221 PolarHBondContact O-N 2.87Å; L219-L222 HydrophobicContact CD2-CD2 4.44Å; L219-L222 PolarHBondContact O-N 3.12Å; L219-W231 HydrophobicContact CD2-CH2 4.18Å
220	T	95.4	Very high	92.6	Very high	52 Å²	52	59.8 Å²	59.8	32%	0.319	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-64.6	-20.4	170.5	69.6	0	0	0	0	112.6	Q216 H217 L218	Q216-T220 WeakPolarHBondContact O-CG2 3.19Å; Q216-T220 PolarHBondContact O-N 3.28Å; H217-T220 WeakPolarHBondContact O-CB 3.4Å; H217-T220 WeakPolarHBondContact O-CG2 3.34Å; H217-T220 PolarHBondContact O-N 2.84Å; H217-T220 PolarHBondContact O-OG1 3.5Å; L218-T220 PolarHBondContact O-N 2.77Å; L218-T220 VanDerWaalsContact O-N 3.1Å
221	N	96.8	Very high	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-86.4	-8.3	176	-65.4	-76.9	0	0	0	113.6	F75 L218 L219 V223 W231 R232 L233	F75-N221 PolarHBondContact O-ND2 3.38Å; L218-N221 WeakPolarHBondContact O-CB 3.13Å; L218-N221 PolarHBondContact O-N 3Å; L218-N221 PolarHBondContact O-ND2 3.08Å; L219-N221 PolarHBondContact O-N 2.87Å; N221-V223 PolarHBondContact O-N 2.89Å; N221-W231 HydrophobicContact CB-CE3 4.08Å; N221-W231 HydrophobicContact CB-CZ3 4.48Å; N221-R232 HydrophobicContact CB-CB 4.26Å; N221-R232 WeakPolarHBondContact O-CB 3.36Å; N221-R232 PolarHBondContact O-N 3.49Å; N221-L233 HydrophobicContact CB-CD1 3.76Å; N221-L233 HydrophobicContact CB-CG 4.01Å; N221-L233 VanDerWaalsContact CG-CD1 3.44Å
222	L	94.9	Very high	92.7	Very high	9 Å²	9	53.1 Å²	53.1	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	106.3	174.1	-169.3	65.2	0	0	0	108.8	A201 L219 L229 W231	A201-L222 HydrophobicContact CB-CD2 3.78Å; L219-L222 HydrophobicContact CD2-CD2 4.44Å; L219-L222 PolarHBondContact O-N 3.12Å; L222-L229 HydrophobicContact CD1-CB 4.22Å; L222-L229 HydrophobicContact CG-CD2 4.46Å; L222-W231 HydrophobicContact CB-CE3 4.1Å; L222-W231 HydrophobicContact CB-CH2 4.24Å; L222-W231 HydrophobicContact CB-CZ3 3.7Å; L222-W231 HydrophobicContact CD1-CD2 4.28Å; L222-W231 HydrophobicContact CD1-CE3 4.21Å; L222-W231 HydrophobicContact CD1-CH2 4.35Å; L222-W231 HydrophobicContact CD1-CZ2 4.4Å; L222-W231 HydrophobicContact CD1-CZ3 4.25Å
223	V	92.5	Very high	92.8	Very high	15 Å²	15	48.7 Å²	48.7	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	163.2	-174.6	-65.2	0	0	0	0	110.9	N221 V225 L229 A230 R232	N221-V223 PolarHBondContact O-N 2.89Å; V223-V225 HydrophobicContact CG2-CG2 4.06Å; V223-L229 CarbonylContact O-C 3.11Å; V223-L229 VanDerWaalsContact O-CA 3.29Å; V223-L229 WeakPolarHBondContact O-CA 3.36Å; V223-L229 WeakPolarHBondContact O-CD2 3.29Å; V223-A230 WeakPolarHBondContact CG2-O 3.28Å; V223-A230 PolarHBondContact N-O 3.35Å; V223-A230 PolarHBondContact O-N 3.49Å; V223-R232 HydrophobicContact CG1-CB 4.3Å; V223-R232 VanDerWaalsContact CG1-NH2 3.27Å; V223-R232 HydrophobicContact CG2-CB 3.99Å
224	E	89.8	Confident	93	Very high	109 Å²	109	47.3 Å²	47.3	51%	0.509	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.9	173.4	-166.5	178.7	144.5	0	0	108.9	R228 L229	E224-R228 CarbonylContact C-O 3.29Å; E224-R228 WeakPolarHBondContact CA-O 3.45Å; E224-L229 HydrophobicContact CB-CD2 4.15Å
225	V	87	Confident	93.1	Very high	74 Å²	74	46.8 Å²	46.8	45%	0.448	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	119	177.4	-177.2	0	0	0	0	106.7	V223 G227 R228 A230	V223-V225 HydrophobicContact CG2-CG2 4.06Å; V225-G227 PolarHBondContact O-N 3.15Å; V225-R228 PolarHBondContact N-O 3.49Å; V225-R228 PolarHBondContact O-N 3.48Å; V225-R228 VanDerWaalsContact O-O 3.1Å; V225-A230 HydrophobicContact CG2-CB 4.36Å
226	D	85.2	Confident	93.1	Very high	164 Å²	164	49.3 Å²	49.3	88%	0.877	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	41.4	-178.9	-58.5	-37.1	0	0	0	113.9	R228	D226-R228 PolarHBondContact O-N 3.14Å
227	G	82.3	Confident	93.2	Very high	55 Å²	55	46.4 Å²	46.4	57%	0.567	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.8	3.9	-179.9	0	0	0	0	0	115.1	V225	V225-G227 PolarHBondContact O-N 3.15Å
228	R	84.7	Confident	93.2	Very high	147 Å²	147	45 Å²	45	56%	0.555	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.6	176.3	-65.8	178.8	178.9	-87.1	-2.1	110.7	D190 E224 V225 D226	D190-R228 VanDerWaalsContact CG-NH1 3.34Å; D190-R228 IonicContact OD1-NH1 2.63Å; D190-R228 PolarHBondContact OD1-NH1 2.94Å; D190-R228 IonicContact OD2-CZ 3.65Å; D190-R228 IonicContact OD2-NH1 3.83Å; D190-R228 PolarHBondContact OD2-NH1 3.06Å; D190-R228 IonicContact OD2-NH2 2.68Å; E224-R228 CarbonylContact C-O 3.29Å; E224-R228 WeakPolarHBondContact CA-O 3.45Å; V225-R228 PolarHBondContact N-O 3.49Å; V225-R228 PolarHBondContact O-N 3.48Å; V225-R228 VanDerWaalsContact O-O 3.1Å; D226-R228 PolarHBondContact O-N 3.14Å
229	L	89.1	Confident	93.2	Very high	48 Å²	48	47 Å²	47	25%	0.251	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.1	173.7	-70.7	170.1	0	0	0	110.6	I188 A197 L222 V223 E224	I188-L229 HydrophobicContact CG2-CD1 3.85Å; A197-L229 HydrophobicContact CB-CD1 3.08Å; L222-L229 HydrophobicContact CD1-CB 4.22Å; L222-L229 HydrophobicContact CG-CD2 4.46Å; V223-L229 CarbonylContact O-C 3.11Å; V223-L229 VanDerWaalsContact O-CA 3.29Å; V223-L229 WeakPolarHBondContact O-CA 3.36Å; V223-L229 WeakPolarHBondContact O-CD2 3.29Å; E224-L229 HydrophobicContact CB-CD2 4.15Å
230	A	91.3	Very high	93.1	Very high	38 Å²	38	52.9 Å²	52.9	31%	0.314	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	155.7	-179.8	0	0	0	0	0	110.2	V223 V225	V223-A230 WeakPolarHBondContact CG2-O 3.28Å; V223-A230 PolarHBondContact N-O 3.35Å; V223-A230 PolarHBondContact O-N 3.49Å; V225-A230 HydrophobicContact CG2-CB 4.36Å
231	W	95.6	Very high	93.1	Very high	41 Å²	41	51.5 Å²	51.5	16%	0.155	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.5	166.4	-64.7	114.2	0	0	0	109.1	M183 V186 L205 L219 N221 L222 L233 L235	M183-W231 HydrophobicContact CB-CZ2 4.17Å; M183-W231 HydrophobicContact CE-CD2 3.69Å; M183-W231 HydrophobicContact CE-CE3 3.38Å; M183-W231 HydrophobicContact CE-CG 4.4Å; M183-W231 HydrophobicContact CE-CH2 3.92Å; M183-W231 HydrophobicContact CE-CZ2 4.19Å; M183-W231 HydrophobicContact CE-CZ3 3.51Å; M183-W231 HydrophobicContact CG-CH2 4.41Å; M183-W231 HydrophobicContact CG-CZ2 4.21Å; M183-W231 PolarHBondContact O-NE1 3.47Å; V186-W231 HydrophobicContact CB-CZ2 3.96Å; V186-W231 HydrophobicContact CG1-CZ2 4.08Å; V186-W231 HydrophobicContact CG2-CZ2 3.99Å; L205-W231 HydrophobicContact CD1-CH2 4.2Å; L219-W231 HydrophobicContact CD2-CH2 4.18Å; N221-W231 HydrophobicContact CB-CE3 4.08Å; N221-W231 HydrophobicContact CB-CZ3 4.48Å; L222-W231 HydrophobicContact CB-CE3 4.1Å; L222-W231 HydrophobicContact CB-CH2 4.24Å; L222-W231 HydrophobicContact CB-CZ3 3.7Å; L222-W231 HydrophobicContact CD1-CD2 4.28Å; L222-W231 HydrophobicContact CD1-CE3 4.21Å; L222-W231 HydrophobicContact CD1-CH2 4.35Å; L222-W231 HydrophobicContact CD1-CZ2 4.4Å; L222-W231 HydrophobicContact CD1-CZ3 4.25Å; W231-L233 PolarHBondContact O-N 2.96Å; W231-L235 HydrophobicContact CB-CD1 4Å; W231-L235 HydrophobicContact CB-CG 4.21Å; W231-L235 HydrophobicContact CD2-CD1 4.42Å; W231-L235 HydrophobicContact CG-CD1 3.66Å; W231-L235 HydrophobicContact CG-CG 4.37Å
232	R	96.3	Very high	92.9	Very high	66 Å²	66	51.9 Å²	51.9	25%	0.249	28%	0.277	C	S	.	.	S	Bend	trans	-61.1	-27.7	172.9	-173.3	-177	-66.1	166.4	-7.2	112.3	G105 H109 N221 V223	G105-R232 VanDerWaalsContact CA-CD 3.49Å; G105-R232 WeakPolarHBondContact O-CD 3.45Å; G105-R232 WeakPolarHBondContact O-CG 3.46Å; H109-R232 PolarHBondContact CE1-O 2.98Å; H109-R232 PolarHBondContact NE2-O 3.46Å; N221-R232 HydrophobicContact CB-CB 4.26Å; N221-R232 WeakPolarHBondContact O-CB 3.36Å; N221-R232 PolarHBondContact O-N 3.49Å; V223-R232 HydrophobicContact CG1-CB 4.3Å; V223-R232 VanDerWaalsContact CG1-NH2 3.27Å; V223-R232 HydrophobicContact CG2-CB 3.99Å
233	L	97.6	Very high	92.7	Very high	5 Å²	5	56 Å²	56	3%	0.026	30%	0.3	C	S	.	.	S	Bend	trans	-79.1	145.1	-178.8	-63.3	158.8	0	0	0	111.1	F75 N103 H104 M183 N221 W231 L235 L238	F75-L233 HydrophobicContact CB-CD1 4.26Å; F75-L233 HydrophobicContact CD1-CD1 3.77Å; F75-L233 HydrophobicContact CG-CD1 4.49Å; N103-L233 WeakPolarHBondContact O-CA 3.4Å; H104-L233 HydrophobicContact CB-CD2 4.3Å; H104-L233 WeakPolarHBondContact CD2-CD2 3.47Å; M183-L233 HydrophobicContact CE-CD1 3.88Å; N221-L233 HydrophobicContact CB-CD1 3.76Å; N221-L233 HydrophobicContact CB-CG 4.01Å; N221-L233 VanDerWaalsContact CG-CD1 3.44Å; W231-L233 PolarHBondContact O-N 2.96Å; L233-L235 VanDerWaalsContact C-N 3.32Å; L233-L235 HydrophobicContact CB-CD2 3.97Å; L233-L235 HydrophobicContact CB-CG 4.49Å; L233-L235 HydrophobicContact CD1-CD2 4.34Å; L233-L235 PolarHBondContact O-N 3.44Å; L233-L238 HydrophobicContact CB-CD1 4.04Å; L233-L238 HydrophobicContact CD2-CD1 4.3Å
234	N	97.6	Very high	92.7	Very high	24 Å²	24	59.6 Å²	59.6	13%	0.128	31%	0.314	C	S	.	.			trans	-77.5	84.9	165.7	-172.8	-11.2	0	0	0	109.7	N103 H109 S110 D236 A237 L238	N103-N234 HydrophobicContact CB-CB 3.77Å; N103-N234 PolarHBondContact O-N 2.71Å; N103-N234 VanDerWaalsContact O-N 3.15Å; N103-N234 VanDerWaalsContact OD1-CB 3.3Å; N103-N234 WeakPolarHBondContact OD1-CB 3.27Å; N103-N234 PolarHBondContact OD1-ND2 2.51Å; H109-N234 HydrophobicContact CB-CB 4.21Å; S110-N234 PolarHBondContact O-ND2 2.93Å; S110-N234 VanDerWaalsContact O-ND2 3.12Å; N234-D236 PolarHBondContact O-N 2.81Å; N234-D236 PolarHBondContact OD1-N 3.39Å; N234-A237 HydrophobicContact CB-CB 4.2Å; N234-A237 VanDerWaalsContact CG-CB 3.5Å; N234-A237 VanDerWaalsContact ND2-CB 3.29Å; N234-A237 WeakPolarHBondContact ND2-CB 3.2Å; N234-A237 PolarHBondContact O-N 3.23Å; N234-A237 PolarHBondContact OD1-N 3.47Å; N234-A237 VanDerWaalsContact OD1-N 3.11Å; N234-L238 WeakPolarHBondContact O-CB 3.49Å; N234-L238 VanDerWaalsContact O-CG 3.3Å; N234-L238 WeakPolarHBondContact O-CG 3.15Å; N234-L238 PolarHBondContact O-N 3.36Å
235	L	97.4	Very high	92.7	Very high	13 Å²	13	54.9 Å²	54.9	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-26.7	-176.8	-64.6	-176.6	0	0	0	113.3	M183 R184 W231 L233 L238 A239	M183-L235 HydrophobicContact CB-CD1 3.69Å; M183-L235 HydrophobicContact CB-CD2 4.31Å; M183-L235 HydrophobicContact CE-CD2 4.01Å; M183-L235 HydrophobicContact SD-CD2 4.19Å; R184-L235 HydrophobicContact CG-CB 3.78Å; R184-L235 HydrophobicContact CG-CD1 3.85Å; R184-L235 HydrophobicContact CG-CG 4.46Å; W231-L235 HydrophobicContact CB-CD1 4Å; W231-L235 HydrophobicContact CB-CG 4.21Å; W231-L235 HydrophobicContact CD2-CD1 4.42Å; W231-L235 HydrophobicContact CG-CD1 3.66Å; W231-L235 HydrophobicContact CG-CG 4.37Å; L233-L235 VanDerWaalsContact C-N 3.32Å; L233-L235 HydrophobicContact CB-CD2 3.97Å; L233-L235 HydrophobicContact CB-CG 4.49Å; L233-L235 HydrophobicContact CD1-CD2 4.34Å; L233-L235 PolarHBondContact O-N 3.44Å; L235-L238 HydrophobicContact CD2-CD1 4.32Å; L235-A239 VanDerWaalsContact O-CB 3.28Å; L235-A239 WeakPolarHBondContact O-CB 3.35Å; L235-A239 PolarHBondContact O-N 2.82Å
236	D	97	Very high	92.9	Very high	82 Å²	82	53.2 Å²	53.2	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-72.9	-46.9	178.5	-68.8	-35.1	0	0	0	111.2	R184 N234 L238 A239 Q240	R184-D236 IonicContact CZ-OD1 2.77Å; R184-D236 VanDerWaalsContact CZ-OD1 3.22Å; R184-D236 IonicContact NE-OD1 3.18Å; R184-D236 PolarHBondContact NE-OD1 3.48Å; R184-D236 VanDerWaalsContact NE-OD1 3.09Å; R184-D236 IonicContact NH2-OD1 3.15Å; R184-D236 PolarHBondContact NH2-OD1 3.15Å; N234-D236 PolarHBondContact O-N 2.81Å; N234-D236 PolarHBondContact OD1-N 3.39Å; D236-L238 VanDerWaalsContact C-N 3.32Å; D236-L238 PolarHBondContact O-N 2.68Å; D236-A239 PolarHBondContact O-N 3.14Å; D236-Q240 VanDerWaalsContact O-CG 3.27Å; D236-Q240 WeakPolarHBondContact O-CG 3.43Å; D236-Q240 PolarHBondContact O-N 2.93Å
237	A	96.7	Very high	93.2	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-39.9	173.9	0	0	0	0	0	111.6	S110 N234 A239 Q240 H241	S110-A237 WeakPolarHBondContact O-CB 3.49Å; N234-A237 HydrophobicContact CB-CB 4.2Å; N234-A237 VanDerWaalsContact CG-CB 3.5Å; N234-A237 VanDerWaalsContact ND2-CB 3.29Å; N234-A237 WeakPolarHBondContact ND2-CB 3.2Å; N234-A237 PolarHBondContact O-N 3.23Å; N234-A237 PolarHBondContact OD1-N 3.47Å; N234-A237 VanDerWaalsContact OD1-N 3.11Å; A237-A239 PolarHBondContact O-N 3.48Å; A237-Q240 PolarHBondContact O-N 3.33Å; A237-H241 PolarHBondContact O-CD2 2.94Å; A237-H241 VanDerWaalsContact O-CD2 3.25Å; A237-H241 PolarHBondContact O-N 2.79Å
238	L	96.5	Very high	93.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-43.6	174.7	-74.6	174.9	0	0	0	111.9	L74 F75 M113 V180 L233 N234 L235 D236 Q240 L242 L245	L74-L238 HydrophobicContact CD1-CD2 3.68Å; F75-L238 HydrophobicContact CD1-CD1 4.38Å; F75-L238 HydrophobicContact CE1-CD1 4.19Å; M113-L238 HydrophobicContact CE-CD2 4Å; M113-L238 HydrophobicContact SD-CD2 3.67Å; V180-L238 HydrophobicContact CG1-CB 4.48Å; V180-L238 HydrophobicContact CG2-CB 4.35Å; L233-L238 HydrophobicContact CB-CD1 4.04Å; L233-L238 HydrophobicContact CD2-CD1 4.3Å; N234-L238 WeakPolarHBondContact O-CB 3.49Å; N234-L238 VanDerWaalsContact O-CG 3.3Å; N234-L238 WeakPolarHBondContact O-CG 3.15Å; N234-L238 PolarHBondContact O-N 3.36Å; L235-L238 HydrophobicContact CD2-CD1 4.32Å; D236-L238 VanDerWaalsContact C-N 3.32Å; D236-L238 PolarHBondContact O-N 2.68Å; L238-Q240 VanDerWaalsContact C-N 3.29Å; L238-Q240 PolarHBondContact O-N 3.18Å; L238-L242 VanDerWaalsContact O-CB 3.3Å; L238-L242 WeakPolarHBondContact O-CB 3.34Å; L238-L242 PolarHBondContact O-N 3.32Å; L238-L242 VanDerWaalsContact O-N 3.16Å; L238-L245 HydrophobicContact CD2-CD1 4.11Å
239	A	95.9	Very high	94.2	Very high	43 Å²	43	39.9 Å²	39.9	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-64.1	-35.4	177.1	0	0	0	0	0	112.4	V180 L235 D236 A237	V180-A239 HydrophobicContact CG1-CB 3.83Å; L235-A239 VanDerWaalsContact O-CB 3.28Å; L235-A239 WeakPolarHBondContact O-CB 3.35Å; L235-A239 PolarHBondContact O-N 2.82Å; D236-A239 PolarHBondContact O-N 3.14Å; A237-A239 PolarHBondContact O-N 3.48Å
240	Q	96.5	Very high	94.4	Very high	124 Å²	124	46.2 Å²	46.2	58%	0.579	24%	0.238	S	C	*	.	H	α-helix	trans	-75.4	-31.4	-177.9	-73.9	172.9	9.6	0	0	114.1	D236 A237 L238	D236-Q240 VanDerWaalsContact O-CG 3.27Å; D236-Q240 WeakPolarHBondContact O-CG 3.43Å; D236-Q240 PolarHBondContact O-N 2.93Å; A237-Q240 PolarHBondContact O-N 3.33Å; L238-Q240 VanDerWaalsContact C-N 3.29Å; L238-Q240 PolarHBondContact O-N 3.18Å
241	H	95.1	Very high	94.6	Very high	22 Å²	22	47 Å²	47	10%	0.102	23%	0.232	C	C	.	.	H	α-helix	trans	-119.5	15.7	-172	-58.4	-74	0	0	0	113.9	P111 M113 A237 D243 K244 L245	P111-H241 PolarHBondContact O-CD2 3.5Å; P111-H241 VanDerWaalsContact O-CD2 3.3Å; P111-H241 PolarHBondContact O-NE2 3.09Å; M113-H241 HydrophobicContact CB-CB 4.1Å; M113-H241 VanDerWaalsContact O-CB 3.31Å; M113-H241 WeakPolarHBondContact O-CB 3.35Å; A237-H241 PolarHBondContact O-CD2 2.94Å; A237-H241 VanDerWaalsContact O-CD2 3.25Å; A237-H241 PolarHBondContact O-N 2.79Å; H241-D243 WeakPolarHBondContact CA-OD1 3.4Å; H241-D243 PolarHBondContact O-N 2.77Å; H241-K244 HydrophobicContact CB-CD 4.32Å; H241-K244 PolarHBondContact ND1-NZ 3.33Å; H241-K244 WeakPolarHBondContact O-CB 3.35Å; H241-K244 PolarHBondContact O-N 3.18Å; H241-K244 VanDerWaalsContact O-N 3.13Å; H241-L245 PolarHBondContact O-N 2.85Å
242	L	91.6	Very high	94.4	Very high	9 Å²	9	53.8 Å²	53.8	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-33.1	-175.8	-154.6	58.2	0	0	0	112.4	L74 F176 P177 V180 L238 K244 L245 L246	L74-L242 HydrophobicContact CD2-CD1 4.03Å; F176-L242 HydrophobicContact CB-CD1 4.35Å; F176-L242 HydrophobicContact CB-CD2 3.92Å; F176-L242 HydrophobicContact CB-CG 4.46Å; P177-L242 HydrophobicContact CB-CD2 3.91Å; P177-L242 HydrophobicContact CG-CD2 3.66Å; P177-L242 VanDerWaalsContact N-CD2 3.27Å; V180-L242 HydrophobicContact CG2-CD2 4.31Å; L238-L242 VanDerWaalsContact O-CB 3.3Å; L238-L242 WeakPolarHBondContact O-CB 3.34Å; L238-L242 PolarHBondContact O-N 3.32Å; L238-L242 VanDerWaalsContact O-N 3.16Å; L242-K244 VanDerWaalsContact C-N 3.31Å; L242-K244 PolarHBondContact O-N 3.06Å; L242-L245 HydrophobicContact CD1-CD1 4.32Å; L242-L245 CarbonylContact O-C 3.58Å; L242-L245 WeakPolarHBondContact O-CA 3.39Å; L242-L245 PolarHBondContact O-N 2.98Å; L242-L246 HydrophobicContact CG-CD1 4.47Å; L242-L246 VanDerWaalsContact O-CG 3.24Å; L242-L246 WeakPolarHBondContact O-CG 3.3Å; L242-L246 PolarHBondContact O-N 3.1Å
243	D	90.9	Very high	94.3	Very high	96 Å²	96	54 Å²	54	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-53.9	-45.2	171.7	62.8	-38.5	0	0	0	112.2	H241 L245 L246 T247	H241-D243 WeakPolarHBondContact CA-OD1 3.4Å; H241-D243 PolarHBondContact O-N 2.77Å; D243-L245 VanDerWaalsContact C-N 3.26Å; D243-L245 PolarHBondContact O-N 3.29Å; D243-L246 PolarHBondContact O-N 3.01Å; D243-T247 PolarHBondContact O-N 3.21Å; D243-T247 VanDerWaalsContact O-N 3.13Å; D243-T247 PolarHBondContact O-OG1 2.87Å
244	K	91.6	Very high	94.3	Very high	90 Å²	90	56.2 Å²	56.2	39%	0.391	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-29.1	175.5	-60.9	178.8	-176.4	166.5	0	112.7	Y115 H241 L242 T247	Y115-K244 WeakPolarHBondContact CE2-O 3.26Å; H241-K244 HydrophobicContact CB-CD 4.32Å; H241-K244 PolarHBondContact ND1-NZ 3.33Å; H241-K244 WeakPolarHBondContact O-CB 3.35Å; H241-K244 PolarHBondContact O-N 3.18Å; H241-K244 VanDerWaalsContact O-N 3.13Å; L242-K244 VanDerWaalsContact C-N 3.31Å; L242-K244 PolarHBondContact O-N 3.06Å; K244-T247 PolarHBondContact O-OG1 3.2Å
245	L	91.8	Very high	94.4	Very high	9 Å²	9	55.4 Å²	55.4	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-85.2	-19.9	177.5	-59.3	-178.9	0	0	0	113	L74 M113 Y115 M118 R144 L238 H241 L242 D243	L74-L245 HydrophobicContact CD1-CD1 4.1Å; M113-L245 HydrophobicContact CE-CD1 3.47Å; M113-L245 VanDerWaalsContact CE-CD1 3.47Å; M113-L245 HydrophobicContact CE-CD2 4.07Å; M113-L245 HydrophobicContact CE-CG 4.4Å; M113-L245 HydrophobicContact CG-CD1 4.38Å; M113-L245 HydrophobicContact CG-CD2 4.34Å; M113-L245 HydrophobicContact SD-CD1 3.89Å; Y115-L245 HydrophobicContact CE1-CD2 4.23Å; Y115-L245 HydrophobicContact CE2-CD2 4.31Å; Y115-L245 PolarHBondContact OH-O 3.46Å; M118-L245 HydrophobicContact CE-CD2 3.73Å; R144-L245 PolarHBondContact NH1-O 2.64Å; L238-L245 HydrophobicContact CD2-CD1 4.11Å; H241-L245 PolarHBondContact O-N 2.85Å; L242-L245 HydrophobicContact CD1-CD1 4.32Å; L242-L245 CarbonylContact O-C 3.58Å; L242-L245 WeakPolarHBondContact O-CA 3.39Å; L242-L245 PolarHBondContact O-N 2.98Å; D243-L245 VanDerWaalsContact C-N 3.26Å; D243-L245 PolarHBondContact O-N 3.29Å
246	L	90.9	Very high	94.4	Very high	40 Å²	40	59.9 Å²	59.9	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-82.6	-27.6	174.4	-69.5	173.8	0	0	0	111.6	R144 G170 S174 F176 P177 L242 D243	R144-L246 VanDerWaalsContact NH1-C 3.29Å; R144-L246 PolarHBondContact NH1-O 3.3Å; R144-L246 PolarHBondContact NH2-O 3.34Å; G170-L246 PolarHBondContact N-O 3.25Å; S174-L246 VanDerWaalsContact CB-CD2 3.44Å; S174-L246 WeakPolarHBondContact OG-CD2 3.27Å; F176-L246 HydrophobicContact CD2-CD2 3.81Å; F176-L246 HydrophobicContact CE2-CD2 4.46Å; P177-L246 HydrophobicContact CG-CD1 4.35Å; L242-L246 HydrophobicContact CG-CD1 4.47Å; L242-L246 VanDerWaalsContact O-CG 3.24Å; L242-L246 WeakPolarHBondContact O-CG 3.3Å; L242-L246 PolarHBondContact O-N 3.1Å; D243-L246 PolarHBondContact O-N 3.01Å
247	T	91.3	Very high	94.5	Very high	47 Å²	47	56.7 Å²	56.7	29%	0.288	29%	0.29	S	S	.	.	S	Bend	trans	-91.1	169.1	175.7	53.5	0	0	0	0	112.2	Y115 R144 E169 D243 K244	Y115-T247 WeakPolarHBondContact CE2-O 3.38Å; R144-T247 PolarHBondContact NH1-O 2.84Å; R144-T247 VanDerWaalsContact NH1-O 3.12Å; E169-T247 HydrophobicContact CG-CG2 3.84Å; D243-T247 PolarHBondContact O-N 3.21Å; D243-T247 VanDerWaalsContact O-N 3.13Å; D243-T247 PolarHBondContact O-OG1 2.87Å; K244-T247 PolarHBondContact O-OG1 3.2Å
248	F	94.6	Very high	94.6	Very high	17 Å²	17	58.8 Å²	58.8	8%	0.075	30%	0.304	C	S	.	.			trans	-121.6	137.4	165.6	-172.9	-101.9	0	0	0	108.1	R144 M147 L148 L151 P167 Q250 R251 L281	R144-F248 HydrophobicContact CB-CD2 3.97Å; R144-F248 HydrophobicContact CB-CE2 4.1Å; R144-F248 HydrophobicContact CG-CD2 3.76Å; R144-F248 HydrophobicContact CG-CE2 4.21Å; M147-F248 HydrophobicContact CB-CE2 4.06Å; M147-F248 HydrophobicContact CB-CZ 4.03Å; M147-F248 HydrophobicContact SD-CE2 4.49Å; L148-F248 HydrophobicContact CB-CE2 4.44Å; L148-F248 HydrophobicContact CB-CZ 4.44Å; L151-F248 HydrophobicContact CD1-CE1 4.26Å; L151-F248 HydrophobicContact CD1-CZ 4.12Å; P167-F248 HydrophobicContact CB-CD1 3.55Å; P167-F248 HydrophobicContact CB-CD2 4.35Å; P167-F248 HydrophobicContact CB-CE1 3.63Å; P167-F248 HydrophobicContact CB-CE2 4.41Å; P167-F248 HydrophobicContact CB-CG 3.93Å; P167-F248 HydrophobicContact CB-CZ 4.07Å; P167-F248 WeakPolarHBondContact O-CD1 3.01Å; F248-Q250 PolarHBondContact O-N 3.27Å; F248-R251 HydrophobicContact CE1-CG 4.08Å; F248-L281 HydrophobicContact CE1-CD1 4.08Å
249	P	93.3	Very high	94.7	Very high	22 Å²	22	58.8 Å²	58.8	14%	0.143	30%	0.304	C	S	.	.			trans	-58.7	139.8	-179.7	-24.2	35.1	0	0	0	111.4	E116 L148 R251	E116-P249 WeakPolarHBondContact OE1-CB 3.33Å; E116-P249 WeakPolarHBondContact OE1-CG 3.33Å; L148-P249 HydrophobicContact CD2-CG 4.31Å; P249-R251 WeakPolarHBondContact O-CG 3.34Å; P249-R251 PolarHBondContact O-N 3.33Å
250	Q	93	Very high	94.8	Very high	180 Å²	180	56.8 Å²	56.8	84%	0.841	29%	0.287	S	S	*	.			trans	-64.8	125.6	175.2	-73.4	-76.1	-38.2	0	0	109.9	F248	F248-Q250 PolarHBondContact O-N 3.27Å
251	R	94.4	Very high	95	Very high	55 Å²	55	50.9 Å²	50.9	21%	0.208	26%	0.26	C	S	.	.			trans	-128.1	139	-179.7	-54.1	-58.2	-68	-178.1	4.5	110.8	L148 L151 F248 P249 E253 R280 L281	L148-R251 HydrophobicContact CD1-CG 4.28Å; L151-R251 HydrophobicContact CD1-CB 4.23Å; L151-R251 HydrophobicContact CD1-CG 3.94Å; F248-R251 HydrophobicContact CE1-CG 4.08Å; P249-R251 WeakPolarHBondContact O-CG 3.34Å; P249-R251 PolarHBondContact O-N 3.33Å; R251-E253 IonicContact CZ-OE1 3.92Å; R251-E253 IonicContact NE-OE1 2.74Å; R251-E253 PolarHBondContact NE-OE1 2.84Å; R251-E253 IonicContact NE-OE2 3.09Å; R251-E253 IonicContact NH2-OE1 2.61Å; R251-E253 PolarHBondContact NH2-OE1 3.29Å; R251-E253 IonicContact NH2-OE2 3.85Å; R251-R280 PolarHBondContact O-NH1 3.15Å; R251-R280 VanDerWaalsContact O-NH1 3.09Å; R251-R280 PolarHBondContact O-NH2 2.97Å; R251-L281 HydrophobicContact CB-CD2 3.88Å
252	Q	92.2	Very high	95.1	Very high	183 Å²	183	49.9 Å²	49.9	86%	0.855	26%	0.255	S	S	*	.			trans	-99.6	-33.4	178.9	-68.5	-173.6	-4.8	0	0	111.9
253	E	94.2	Very high	95.5	Very high	71 Å²	71	50 Å²	50	33%	0.332	26%	0.256	S	S	.	.	S	Bend	trans	-75.1	160.2	177.6	72.5	-68.5	164.6	0	0	113	L151 R251 L281	L151-E253 WeakPolarHBondContact CD2-O 3.37Å; R251-E253 IonicContact CZ-OE1 3.92Å; R251-E253 IonicContact NE-OE1 2.74Å; R251-E253 PolarHBondContact NE-OE1 2.84Å; R251-E253 IonicContact NE-OE2 3.09Å; R251-E253 IonicContact NH2-OE1 2.61Å; R251-E253 PolarHBondContact NH2-OE1 3.29Å; R251-E253 IonicContact NH2-OE2 3.85Å; E253-L281 VanDerWaalsContact O-CD2 3.29Å; E253-L281 WeakPolarHBondContact O-CD2 3.32Å
254	S	98.3	Very high	95.8	Very high	51 Å²	51	45.7 Å²	45.7	36%	0.357	23%	0.234	S	C	.	.			trans	-120.5	143.2	178.9	-53.7	0	0	0	0	110.2	R280 L281	S254-R280 PolarHBondContact OG-O 3.23Å; S254-L281 CarbonylContact C-O 3.41Å; S254-L281 VanDerWaalsContact CA-O 3.24Å; S254-L281 WeakPolarHBondContact CA-O 3.47Å; S254-L281 WeakPolarHBondContact CB-O 3.47Å
255	Y	98.7	Very high	96.1	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.027	23%	0.234	C	C	.	.			trans	-88.4	113.9	170.1	174.8	-109.2	0	0	0	109.6	A150 P154 V157 E158 L160 G257 T259 L281 F282	A150-Y255 HydrophobicContact CB-CD1 4.08Å; A150-Y255 HydrophobicContact CB-CD2 3.83Å; A150-Y255 HydrophobicContact CB-CE1 4.25Å; A150-Y255 HydrophobicContact CB-CE2 4.04Å; A150-Y255 HydrophobicContact CB-CG 3.84Å; A150-Y255 WeakPolarHBondContact O-CD2 3.22Å; P154-Y255 HydrophobicContact CB-CD2 3.87Å; P154-Y255 HydrophobicContact CB-CE2 4Å; V157-Y255 HydrophobicContact CB-CE2 4.37Å; V157-Y255 PolarHBondContact O-OH 3.03Å; E158-Y255 PolarHBondContact O-OH 3.35Å; L160-Y255 HydrophobicContact CB-CE1 4.08Å; Y255-G257 VanDerWaalsContact C-N 3.32Å; Y255-G257 VanDerWaalsContact CE1-CA 3.44Å; Y255-G257 WeakPolarHBondContact CE1-O 3.33Å; Y255-G257 VanDerWaalsContact CZ-CA 3.46Å; Y255-T259 WeakPolarHBondContact CD1-OG1 3.39Å; Y255-L281 PolarHBondContact N-O 3.28Å; Y255-F282 AromaticContact CD1-CD1 3.98Å; Y255-F282 HydrophobicContact CD1-CD1 3.98Å; Y255-F282 HydrophobicContact CD1-CE1 4.34Å; Y255-F282 HydrophobicContact CG-CD1 4.38Å; Y255-F282 HydrophobicContact CG-CE1 4.49Å
256	L	98.6	Very high	96.2	Very high	108 Å²	108	48 Å²	48	57%	0.565	26%	0.26	S	S	*	.			trans	-87.4	1.3	-176.8	-56.4	-176.3	0	0	0	113.6	P283 R284	L256-P283 HydrophobicContact CD2-CG 3.54Å; L256-R284 WeakPolarHBondContact O-CD 3.37Å; L256-R284 PolarHBondContact O-NE 3.32Å; L256-R284 PolarHBondContact O-NH1 2.92Å
257	G	98.4	Very high	96.4	Very high	14 Å²	14	47.2 Å²	47.2	14%	0.144	26%	0.257	C	S	.	.	S	Bend	trans	-76.7	161.6	177	0	0	0	0	0	112.5	Y255 T259	Y255-G257 VanDerWaalsContact C-N 3.32Å; Y255-G257 VanDerWaalsContact CE1-CA 3.44Å; Y255-G257 WeakPolarHBondContact CE1-O 3.33Å; Y255-G257 VanDerWaalsContact CZ-CA 3.46Å; G257-T259 PolarHBondContact O-N 3.4Å; G257-T259 PolarHBondContact O-OG1 2.89Å
258	P	98.7	Very high	96.4	Very high	47 Å²	47	53.7 Å²	53.7	31%	0.305	28%	0.284	S	S	.	.			trans	-56.6	130.2	176.1	-19.7	30.4	0	0	0	110.7	R159 L160 F312	R159-P258 WeakPolarHBondContact CA-O 3.32Å; R159-P258 HydrophobicContact CG-CB 4.08Å; R159-P258 HydrophobicContact CG-CG 4.25Å; L160-P258 PolarHBondContact N-O 3.34Å; L160-P258 VanDerWaalsContact N-O 3.09Å; P258-F312 HydrophobicContact CB-CE2 4.32Å; P258-F312 HydrophobicContact CB-CZ 3.81Å
259	T	98.9	Very high	96.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.1	-179.8	-58.1	0	0	0	0	110.7	L160 Y255 G257 F261 F282 A285 Q286 F312	L160-T259 HydrophobicContact CB-CG2 4.09Å; L160-T259 HydrophobicContact CD2-CG2 3.8Å; L160-T259 HydrophobicContact CG-CG2 3.95Å; L160-T259 CarbonylContact O-C 3.4Å; L160-T259 VanDerWaalsContact O-CA 3.27Å; L160-T259 WeakPolarHBondContact O-CA 3.41Å; Y255-T259 WeakPolarHBondContact CD1-OG1 3.39Å; G257-T259 PolarHBondContact O-N 3.4Å; G257-T259 PolarHBondContact O-OG1 2.89Å; T259-F261 HydrophobicContact CG2-CD2 3.85Å; T259-F261 HydrophobicContact CG2-CE2 3.49Å; T259-F261 VanDerWaalsContact CG2-CE2 3.49Å; T259-F261 HydrophobicContact CG2-CZ 4.49Å; T259-F282 HydrophobicContact CG2-CB 4.12Å; T259-F282 HydrophobicContact CG2-CD1 4.18Å; T259-F282 HydrophobicContact CG2-CG 4.21Å; T259-A285 HydrophobicContact CG2-CB 4.38Å; T259-A285 CarbonylContact O-C 3.49Å; T259-A285 VanDerWaalsContact O-CA 3.29Å; T259-A285 WeakPolarHBondContact O-CA 3.29Å; T259-Q286 PolarHBondContact O-N 3.13Å; T259-F312 VanDerWaalsContact C-CZ 3.47Å
260	L	98.9	Very high	96.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.5	170.5	174.5	63.9	0	0	0	109.4	L160 I161 A162 L262 Q286 Q288 F312	L160-L260 PolarHBondContact O-N 3.13Å; I161-L260 CarbonylContact C-O 3.59Å; I161-L260 VanDerWaalsContact CA-O 3.31Å; I161-L260 WeakPolarHBondContact CA-O 3.27Å; I161-L260 HydrophobicContact CG1-CB 4.08Å; I161-L260 HydrophobicContact CG1-CD2 4.4Å; I161-L260 HydrophobicContact CG2-CB 4.37Å; I161-L260 HydrophobicContact CG2-CD2 4.12Å; I161-L260 HydrophobicContact CG2-CG 4.36Å; A162-L260 PolarHBondContact N-O 3.49Å; L260-L262 HydrophobicContact CD2-CB 4.47Å; L260-L262 HydrophobicContact CG-CB 4.41Å; L260-Q286 CarbonylContact C-O 3.59Å; L260-Q286 WeakPolarHBondContact CA-O 3.31Å; L260-Q286 HydrophobicContact CD1-CB 4.15Å; L260-Q288 HydrophobicContact CD1-CB 3.95Å; L260-Q288 HydrophobicContact CD1-CG 3.6Å; L260-F312 HydrophobicContact CB-CD1 3.86Å; L260-F312 HydrophobicContact CB-CD2 3.99Å; L260-F312 HydrophobicContact CB-CE1 3.81Å; L260-F312 HydrophobicContact CB-CE2 3.97Å; L260-F312 HydrophobicContact CB-CG 3.94Å; L260-F312 HydrophobicContact CB-CZ 3.88Å; L260-F312 HydrophobicContact CD2-CB 3.94Å; L260-F312 HydrophobicContact CD2-CD1 4.31Å; L260-F312 HydrophobicContact CD2-CG 4.02Å
261	F	98.9	Very high	96.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	110.2	163.5	-76.3	-103.7	0	0	0	107.9	M147 A162 T259 L263 I278 F282 A285 Q286 I287 Q288	M147-F261 HydrophobicContact CE-CD1 4.23Å; M147-F261 HydrophobicContact CE-CE1 3.33Å; M147-F261 HydrophobicContact CE-CZ 3.77Å; M147-F261 HydrophobicContact SD-CE1 4.41Å; M147-F261 HydrophobicContact SD-CZ 4.46Å; A162-F261 HydrophobicContact CB-CD1 3.89Å; A162-F261 HydrophobicContact CB-CE1 3.9Å; A162-F261 HydrophobicContact CB-CG 4.3Å; A162-F261 HydrophobicContact CB-CZ 4.29Å; A162-F261 CarbonylContact O-C 3.53Å; A162-F261 WeakPolarHBondContact O-CA 3.4Å; T259-F261 HydrophobicContact CG2-CD2 3.85Å; T259-F261 HydrophobicContact CG2-CE2 3.49Å; T259-F261 VanDerWaalsContact CG2-CE2 3.49Å; T259-F261 HydrophobicContact CG2-CZ 4.49Å; F261-L263 HydrophobicContact CB-CD2 4.35Å; F261-I278 HydrophobicContact CD1-CD1 3.82Å; F261-I278 HydrophobicContact CD1-CG1 4.22Å; F261-I278 HydrophobicContact CD1-CG2 4.29Å; F261-I278 HydrophobicContact CD2-CG2 3.66Å; F261-I278 HydrophobicContact CE1-CB 4.48Å; F261-I278 HydrophobicContact CE1-CD1 3.83Å; F261-I278 HydrophobicContact CE1-CG1 3.73Å; F261-I278 HydrophobicContact CE1-CG2 4.02Å; F261-I278 HydrophobicContact CE2-CG2 3.38Å; F261-I278 HydrophobicContact CG-CD1 4.4Å; F261-I278 HydrophobicContact CG-CG2 4.12Å; F261-I278 HydrophobicContact CZ-CB 4.27Å; F261-I278 HydrophobicContact CZ-CD1 4.46Å; F261-I278 HydrophobicContact CZ-CG1 3.96Å; F261-I278 HydrophobicContact CZ-CG2 3.58Å; F261-F282 HydrophobicContact CE2-CB 4.14Å; F261-F282 AromaticContact CE2-CD2 3.93Å; F261-F282 HydrophobicContact CE2-CD2 3.93Å; F261-F282 HydrophobicContact CE2-CG 4.1Å; F261-F282 AromaticContact CZ-CD2 3.66Å; F261-F282 HydrophobicContact CZ-CD2 3.66Å; F261-F282 HydrophobicContact CZ-CE2 4.09Å; F261-F282 HydrophobicContact CZ-CG 4.27Å; F261-A285 HydrophobicContact CD2-CB 3.86Å; F261-A285 HydrophobicContact CE2-CB 3.97Å; F261-Q286 PolarHBondContact N-O 2.94Å; F261-I287 HydrophobicContact CB-CG1 4.2Å; F261-I287 HydrophobicContact CB-CG2 4.47Å; F261-I287 WeakPolarHBondContact O-CA 3.36Å; F261-Q288 PolarHBondContact O-N 3.11Å
262	L	98.8	Very high	96.4	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	109.8	-179.6	-171.7	65.7	0	0	0	109.4	A162 V163 D164 L260 Q288 V290 I297 F305 A308	A162-L262 PolarHBondContact O-N 2.83Å; V163-L262 WeakPolarHBondContact CA-O 3.36Å; D164-L262 PolarHBondContact N-O 3.04Å; L260-L262 HydrophobicContact CD2-CB 4.47Å; L260-L262 HydrophobicContact CG-CB 4.41Å; L262-Q288 CarbonylContact C-O 3.56Å; L262-Q288 WeakPolarHBondContact CA-O 3.32Å; L262-Q288 HydrophobicContact CD1-CB 4.08Å; L262-V290 HydrophobicContact CD1-CG2 3.64Å; L262-V290 HydrophobicContact CD2-CG2 4.4Å; L262-V290 HydrophobicContact CG-CG2 4.04Å; L262-I297 HydrophobicContact CG-CD1 4.27Å; L262-I297 WeakPolarHBondContact O-CD1 3.34Å; L262-F305 HydrophobicContact CD2-CD2 3.63Å; L262-F305 HydrophobicContact CD2-CE2 3.96Å; L262-A308 HydrophobicContact CD1-CB 3.76Å; L262-A308 HydrophobicContact CD2-CB 4Å
263	L	98.5	Very high	96.6	Very high	13 Å²	13	48.8 Å²	48.8	7%	0.068	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.1	-170.4	-50.4	-172.3	0	0	0	111.8	F261 V270 I287 Q288 T289 V290	F261-L263 HydrophobicContact CB-CD2 4.35Å; L263-V270 HydrophobicContact CD1-CB 4.08Å; L263-V270 HydrophobicContact CD1-CG1 3.91Å; L263-V270 HydrophobicContact CD2-CB 3.72Å; L263-V270 HydrophobicContact CD2-CG1 3.94Å; L263-V270 HydrophobicContact CD2-CG2 3.64Å; L263-I287 HydrophobicContact CD1-CG2 3.58Å; L263-I287 HydrophobicContact CG-CG2 4.05Å; L263-Q288 PolarHBondContact N-O 3.09Å; L263-T289 CarbonylContact O-C 3.58Å; L263-T289 WeakPolarHBondContact O-CA 3.4Å; L263-V290 PolarHBondContact O-N 2.95Å
264	G	98.1	Very high	96.7	Very high	5 Å²	5	46.5 Å²	46.5	5%	0.052	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.3	170.5	0	0	0	0	0	110.1	D164 N266 S267 A293	D164-G264 PolarHBondContact OD1-N 2.74Å; G264-N266 PolarHBondContact O-N 2.77Å; G264-N266 VanDerWaalsContact O-N 3.16Å; G264-S267 VanDerWaalsContact O-CB 3.29Å; G264-S267 WeakPolarHBondContact O-CB 3.4Å; G264-S267 PolarHBondContact O-N 2.7Å; G264-A293 CarbonylContact C-O 3.59Å; G264-A293 VanDerWaalsContact CA-O 3.22Å; G264-A293 WeakPolarHBondContact CA-O 3.27Å
265	G	97	Very high	96.6	Very high	38 Å²	38	46.8 Å²	46.8	39%	0.392	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.1	-178.3	0	0	0	0	0	115.2	T289 V290 A293	G265-T289 VanDerWaalsContact CA-CG2 3.46Å; G265-V290 PolarHBondContact N-O 3.3Å; G265-A293 PolarHBondContact N-O 3.14Å
266	N	95.6	Very high	96.6	Very high	110 Å²	110	51 Å²	51	59%	0.588	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	4.3	174.7	-63.3	-14	0	0	0	112.4	G264 A293	G264-N266 PolarHBondContact O-N 2.77Å; G264-N266 VanDerWaalsContact O-N 3.16Å; N266-A293 WeakPolarHBondContact CB-O 3.39Å; N266-A293 PolarHBondContact N-O 3.46Å
267	S	93.8	Very high	96.5	Very high	23 Å²	23	48.2 Å²	48.2	16%	0.161	28%	0.275	C	S	.	.			trans	-87.6	152.2	-179.9	-171.2	0	0	0	0	112	D164 G264 F269	D164-S267 VanDerWaalsContact CG-OG 3.3Å; D164-S267 WeakPolarHBondContact OD1-CB 3.47Å; D164-S267 PolarHBondContact OD1-OG 3.05Å; D164-S267 WeakPolarHBondContact OD2-CB 3.47Å; D164-S267 PolarHBondContact OD2-OG 3.26Å; G264-S267 VanDerWaalsContact O-CB 3.29Å; G264-S267 WeakPolarHBondContact O-CB 3.4Å; G264-S267 PolarHBondContact O-N 2.7Å; S267-F269 PolarHBondContact OG-N 3.28Å
268	Q	91.4	Very high	96.5	Very high	183 Å²	183	47.6 Å²	47.6	86%	0.855	27%	0.268	S	S	*	.			trans	-114.5	7.8	176.8	-61.7	-176.2	-3.1	0	0	112.6	V270	Q268-V270 VanDerWaalsContact C-N 3.33Å; Q268-V270 PolarHBondContact O-N 3.35Å
269	F	92.6	Very high	96.5	Very high	72 Å²	72	49.1 Å²	49.1	32%	0.316	27%	0.272	S	S	.	.	S	Bend	trans	-72.6	-24.4	-177.8	-85.7	-92.7	0	0	0	113.9	D164 I165 F176 S267 H295	D164-F269 WeakPolarHBondContact O-CB 3.45Å; I165-F269 HydrophobicContact CD1-CD1 4.05Å; F176-F269 HydrophobicContact CE2-CE1 4.44Å; F176-F269 HydrophobicContact CZ-CE1 4.22Å; F176-F269 HydrophobicContact CZ-CZ 4.02Å; S267-F269 PolarHBondContact OG-N 3.28Å; F269-H295 AromaticContact CD1-CE1 3.79Å; F269-H295 HydrophobicContact CD2-CB 4.18Å; F269-H295 AromaticContact CD2-CE1 3.57Å; F269-H295 AromaticContact CD2-CG 3.66Å; F269-H295 AromaticContact CD2-ND1 3.2Å; F269-H295 WeakPolarHBondContact CD2-ND1 3.3Å; F269-H295 AromaticContact CE1-CE1 3.88Å; F269-H295 HydrophobicContact CE2-CB 4.08Å; F269-H295 AromaticContact CE2-CD2 3.72Å; F269-H295 AromaticContact CE2-CE1 3.66Å; F269-H295 AromaticContact CE2-CG 3.52Å; F269-H295 AromaticContact CE2-ND1 3.49Å; F269-H295 WeakPolarHBondContact CE2-ND1 3.41Å; F269-H295 AromaticContact CE2-NE2 3.82Å; F269-H295 AromaticContact CG-CE1 3.63Å; F269-H295 AromaticContact CG-ND1 3.62Å; F269-H295 AromaticContact CZ-CD2 3.99Å; F269-H295 AromaticContact CZ-CE1 3.82Å; F269-H295 AromaticContact CZ-NE2 3.73Å
270	V	94.6	Very high	96.5	Very high	15 Å²	15	53.5 Å²	53.5	9%	0.091	29%	0.289	C	S	.	.	S	Bend	trans	-127.4	112.3	177.1	-174.9	0	0	0	0	109.1	I165 L263 Q268 H274 I278	I165-V270 VanDerWaalsContact C-CG2 3.43Å; L263-V270 HydrophobicContact CD1-CB 4.08Å; L263-V270 HydrophobicContact CD1-CG1 3.91Å; L263-V270 HydrophobicContact CD2-CB 3.72Å; L263-V270 HydrophobicContact CD2-CG1 3.94Å; L263-V270 HydrophobicContact CD2-CG2 3.64Å; Q268-V270 VanDerWaalsContact C-N 3.33Å; Q268-V270 PolarHBondContact O-N 3.35Å; V270-H274 HydrophobicContact CG1-CB 4.48Å; V270-I278 HydrophobicContact CG1-CD1 4.03Å
271	H	93.8	Very high	96.5	Very high	105 Å²	105	53.5 Å²	53.5	49%	0.486	29%	0.289	S	S	.	.			trans	-98.7	152	177.3	-173.9	-98.3	0	0	0	110	S273 H274	H271-S273 WeakPolarHBondContact ND1-CB 3.48Å; H271-S273 PolarHBondContact ND1-N 2.89Å; H271-S273 VanDerWaalsContact ND1-N 3.16Å; H271-S273 PolarHBondContact ND1-OG 3.3Å; H271-S273 PolarHBondContact O-N 3.23Å; H271-H274 PolarHBondContact N-ND1 2.71Å; H271-H274 VanDerWaalsContact O-CB 3.27Å; H271-H274 WeakPolarHBondContact O-CB 3.25Å; H271-H274 PolarHBondContact O-N 3.45Å
272	P	94.7	Very high	96.5	Very high	84 Å²	84	53.5 Å²	53.5	55%	0.545	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-51.4	-28.8	175	-32.2	37.8	0	0	0	115.2	H274 H275	P272-H274 PolarHBondContact O-N 2.89Å; P272-H275 VanDerWaalsContact O-CB 3.32Å; P272-H275 WeakPolarHBondContact O-CB 3.48Å; P272-H275 PolarHBondContact O-N 2.82Å; P272-H275 VanDerWaalsContact O-N 3.13Å
273	S	95.3	Very high	96.5	Very high	78 Å²	78	56.1 Å²	56.1	55%	0.545	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-65.9	-15.5	174.5	60.5	0	0	0	0	114	H271 P276	H271-S273 WeakPolarHBondContact ND1-CB 3.48Å; H271-S273 PolarHBondContact ND1-N 2.89Å; H271-S273 VanDerWaalsContact ND1-N 3.16Å; H271-S273 PolarHBondContact ND1-OG 3.3Å; H271-S273 PolarHBondContact O-N 3.23Å; S273-P276 WeakPolarHBondContact O-CD 3.48Å
274	H	96.4	Very high	96.5	Very high	23 Å²	23	63.2 Å²	63.2	11%	0.106	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-84.3	-18.1	176.4	-52.2	179.7	0	0	0	111.4	S166 V168 V270 H271 P272 P276 E277 I278	S166-H274 PolarHBondContact OG-ND1 2.88Å; V168-H274 HydrophobicContact CG1-CB 4.2Å; V168-H274 HydrophobicContact CG2-CB 4.08Å; V168-H274 VanDerWaalsContact CG2-CG 3.47Å; V168-H274 WeakPolarHBondContact CG2-ND1 3.03Å; V270-H274 HydrophobicContact CG1-CB 4.48Å; H271-H274 PolarHBondContact N-ND1 2.71Å; H271-H274 VanDerWaalsContact O-CB 3.27Å; H271-H274 WeakPolarHBondContact O-CB 3.25Å; H271-H274 PolarHBondContact O-N 3.45Å; P272-H274 PolarHBondContact O-N 2.89Å; H274-P276 VanDerWaalsContact C-CD 3.49Å; H274-E277 PolarHBondContact O-N 3.42Å; H274-E277 VanDerWaalsContact O-N 3.15Å; H274-I278 HydrophobicContact CB-CD1 4.42Å; H274-I278 WeakPolarHBondContact O-CG1 3.35Å; H274-I278 PolarHBondContact O-N 3.46Å
275	H	97.4	Very high	96.5	Very high	57 Å²	57	63.6 Å²	63.6	26%	0.264	34%	0.335	S	S	.	.	H	α-helix	trans	-59	-40.1	-174.9	-63.6	-172.8	0	0	0	113.5	P272 E277 I278 M279 I287	P272-H275 VanDerWaalsContact O-CB 3.32Å; P272-H275 WeakPolarHBondContact O-CB 3.48Å; P272-H275 PolarHBondContact O-N 2.82Å; P272-H275 VanDerWaalsContact O-N 3.13Å; H275-E277 VanDerWaalsContact C-N 3.29Å; H275-E277 PolarHBondContact O-N 3.04Å; H275-I278 WeakPolarHBondContact O-CB 3.4Å; H275-I278 PolarHBondContact O-N 2.99Å; H275-M279 VanDerWaalsContact O-CG 3.31Å; H275-M279 WeakPolarHBondContact O-CG 3.41Å; H275-M279 PolarHBondContact O-N 3.16Å; H275-I287 HydrophobicContact CB-CD1 4.35Å
276	P	97.6	Very high	96.6	Very high	94 Å²	94	66.5 Å²	66.5	61%	0.61	34%	0.338	S	S	*	.	H	α-helix	trans	-56.9	-42.2	175.8	-26.9	36.7	0	0	0	112.9	S273 H274 M279 R280	S273-P276 WeakPolarHBondContact O-CD 3.48Å; H274-P276 VanDerWaalsContact C-CD 3.49Å; P276-M279 PolarHBondContact O-N 2.79Å; P276-R280 WeakPolarHBondContact O-CB 3.41Å; P276-R280 PolarHBondContact O-N 3.37Å
277	E	97.7	Very high	96.7	Very high	51 Å²	51	64 Å²	64	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-72.1	-38.6	179.1	-176.7	62.7	-177.1	0	0	112	P167 V168 H274 H275 M279 R280 L281	P167-E277 HydrophobicContact CG-CG 4.24Å; V168-E277 HydrophobicContact CG1-CB 3.78Å; V168-E277 HydrophobicContact CG1-CG 3.85Å; H274-E277 PolarHBondContact O-N 3.42Å; H274-E277 VanDerWaalsContact O-N 3.15Å; H275-E277 VanDerWaalsContact C-N 3.29Å; H275-E277 PolarHBondContact O-N 3.04Å; E277-M279 VanDerWaalsContact C-N 3.34Å; E277-M279 PolarHBondContact O-N 3.44Å; E277-R280 PolarHBondContact O-N 2.9Å; E277-R280 IonicContact OE1-CZ 2.62Å; E277-R280 IonicContact OE1-NE 2.66Å; E277-R280 PolarHBondContact OE1-NE 3.46Å; E277-R280 IonicContact OE1-NH2 3.45Å; E277-R280 PolarHBondContact OE1-NH2 3.43Å; E277-R280 IonicContact OE2-CZ 2.98Å; E277-R280 IonicContact OE2-NE 3.55Å; E277-R280 PolarHBondContact OE2-NE 2.85Å; E277-R280 IonicContact OE2-NH2 3.59Å; E277-L281 HydrophobicContact CG-CD1 4.37Å; E277-L281 PolarHBondContact O-N 3.02Å
278	I	98.4	Very high	96.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-55.1	-50.7	170.6	-71.2	169.1	0	0	0	110.3	P167 F261 V270 H274 H275 R280 L281 F282 A285 I287	P167-I278 HydrophobicContact CG-CG1 4.24Å; F261-I278 HydrophobicContact CD1-CD1 3.82Å; F261-I278 HydrophobicContact CD1-CG1 4.22Å; F261-I278 HydrophobicContact CD1-CG2 4.29Å; F261-I278 HydrophobicContact CD2-CG2 3.66Å; F261-I278 HydrophobicContact CE1-CB 4.48Å; F261-I278 HydrophobicContact CE1-CD1 3.83Å; F261-I278 HydrophobicContact CE1-CG1 3.73Å; F261-I278 HydrophobicContact CE1-CG2 4.02Å; F261-I278 HydrophobicContact CE2-CG2 3.38Å; F261-I278 HydrophobicContact CG-CD1 4.4Å; F261-I278 HydrophobicContact CG-CG2 4.12Å; F261-I278 HydrophobicContact CZ-CB 4.27Å; F261-I278 HydrophobicContact CZ-CD1 4.46Å; F261-I278 HydrophobicContact CZ-CG1 3.96Å; F261-I278 HydrophobicContact CZ-CG2 3.58Å; V270-I278 HydrophobicContact CG1-CD1 4.03Å; H274-I278 HydrophobicContact CB-CD1 4.42Å; H274-I278 WeakPolarHBondContact O-CG1 3.35Å; H274-I278 PolarHBondContact O-N 3.46Å; H275-I278 WeakPolarHBondContact O-CB 3.4Å; H275-I278 PolarHBondContact O-N 2.99Å; I278-R280 VanDerWaalsContact C-N 3.31Å; I278-R280 PolarHBondContact O-N 2.92Å; I278-L281 PolarHBondContact O-N 3.41Å; I278-F282 WeakPolarHBondContact O-CA 3.39Å; I278-F282 WeakPolarHBondContact O-CB 3.22Å; I278-F282 PolarHBondContact O-N 3.43Å; I278-A285 HydrophobicContact CG2-CB 4.03Å; I278-I287 HydrophobicContact CG2-CD1 4.45Å
279	M	98.4	Very high	97.3	Very high	79 Å²	79	61.5 Å²	61.5	39%	0.389	32%	0.316	S	S	.	.	H	α-helix	trans	-70.7	-27.7	-177.9	-63.6	-54	-66.3	0	0	112.6	H275 P276 E277 P283 A285	H275-M279 VanDerWaalsContact O-CG 3.31Å; H275-M279 WeakPolarHBondContact O-CG 3.41Å; H275-M279 PolarHBondContact O-N 3.16Å; P276-M279 PolarHBondContact O-N 2.79Å; E277-M279 VanDerWaalsContact C-N 3.34Å; E277-M279 PolarHBondContact O-N 3.44Å; M279-P283 WeakPolarHBondContact O-CA 3.48Å; M279-A285 HydrophobicContact SD-CB 4.02Å
280	R	98.3	Very high	97.5	Very high	93 Å²	93	58.5 Å²	58.5	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-66.9	-47.5	174.2	-169.4	-170.9	68.5	79.2	-7.6	111.4	R251 S254 P276 E277 I278	R251-R280 PolarHBondContact O-NH1 3.15Å; R251-R280 VanDerWaalsContact O-NH1 3.09Å; R251-R280 PolarHBondContact O-NH2 2.97Å; S254-R280 PolarHBondContact OG-O 3.23Å; P276-R280 WeakPolarHBondContact O-CB 3.41Å; P276-R280 PolarHBondContact O-N 3.37Å; E277-R280 PolarHBondContact O-N 2.9Å; E277-R280 IonicContact OE1-CZ 2.62Å; E277-R280 IonicContact OE1-NE 2.66Å; E277-R280 PolarHBondContact OE1-NE 3.46Å; E277-R280 IonicContact OE1-NH2 3.45Å; E277-R280 PolarHBondContact OE1-NH2 3.43Å; E277-R280 IonicContact OE2-CZ 2.98Å; E277-R280 IonicContact OE2-NE 3.55Å; E277-R280 PolarHBondContact OE2-NE 2.85Å; E277-R280 IonicContact OE2-NH2 3.59Å; I278-R280 VanDerWaalsContact C-N 3.31Å; I278-R280 PolarHBondContact O-N 2.92Å
281	L	98.6	Very high	97.7	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-81	-30.6	-179.1	-68.7	177.5	0	0	0	112.9	L151 P167 F248 R251 E253 S254 Y255 E277 I278	L151-L281 HydrophobicContact CD1-CD1 4.46Å; L151-L281 HydrophobicContact CD1-CD2 4.41Å; L151-L281 HydrophobicContact CD2-CD2 4.4Å; P167-L281 HydrophobicContact CB-CD1 3.67Å; P167-L281 HydrophobicContact CG-CD1 3.83Å; F248-L281 HydrophobicContact CE1-CD1 4.08Å; R251-L281 HydrophobicContact CB-CD2 3.88Å; E253-L281 VanDerWaalsContact O-CD2 3.29Å; E253-L281 WeakPolarHBondContact O-CD2 3.32Å; S254-L281 CarbonylContact C-O 3.41Å; S254-L281 VanDerWaalsContact CA-O 3.24Å; S254-L281 WeakPolarHBondContact CA-O 3.47Å; S254-L281 WeakPolarHBondContact CB-O 3.47Å; Y255-L281 PolarHBondContact N-O 3.28Å; E277-L281 HydrophobicContact CG-CD1 4.37Å; E277-L281 PolarHBondContact O-N 3.02Å; I278-L281 PolarHBondContact O-N 3.41Å
282	F	98.8	Very high	97.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.331	C	S	.	.			trans	-131.4	70.9	-175.4	-52.8	-79.3	0	0	0	110	M147 L151 L160 P167 Y255 T259 F261 I278 R284 A285	M147-F282 HydrophobicContact CB-CE1 4.47Å; M147-F282 HydrophobicContact CB-CE2 4.31Å; M147-F282 HydrophobicContact CB-CZ 3.64Å; M147-F282 HydrophobicContact CG-CE1 4.43Å; M147-F282 HydrophobicContact CG-CE2 3.95Å; M147-F282 HydrophobicContact CG-CZ 3.64Å; M147-F282 HydrophobicContact SD-CE2 4.22Å; M147-F282 HydrophobicContact SD-CZ 4.45Å; L151-F282 HydrophobicContact CD1-CE1 4.47Å; L151-F282 HydrophobicContact CD1-CZ 3.86Å; L151-F282 HydrophobicContact CD2-CE1 4.25Å; L151-F282 HydrophobicContact CD2-CZ 4.33Å; L151-F282 HydrophobicContact CG-CE1 4.1Å; L151-F282 HydrophobicContact CG-CZ 4Å; L160-F282 HydrophobicContact CD2-CD1 3.83Å; L160-F282 HydrophobicContact CD2-CE1 3.47Å; L160-F282 VanDerWaalsContact CD2-CE1 3.47Å; L160-F282 HydrophobicContact CD2-CZ 4.12Å; P167-F282 HydrophobicContact CB-CE2 4.45Å; P167-F282 HydrophobicContact CG-CE2 4.18Å; Y255-F282 AromaticContact CD1-CD1 3.98Å; Y255-F282 HydrophobicContact CD1-CD1 3.98Å; Y255-F282 HydrophobicContact CD1-CE1 4.34Å; Y255-F282 HydrophobicContact CG-CD1 4.38Å; Y255-F282 HydrophobicContact CG-CE1 4.49Å; T259-F282 HydrophobicContact CG2-CB 4.12Å; T259-F282 HydrophobicContact CG2-CD1 4.18Å; T259-F282 HydrophobicContact CG2-CG 4.21Å; F261-F282 HydrophobicContact CE2-CB 4.14Å; F261-F282 AromaticContact CE2-CD2 3.93Å; F261-F282 HydrophobicContact CE2-CD2 3.93Å; F261-F282 HydrophobicContact CE2-CG 4.1Å; F261-F282 AromaticContact CZ-CD2 3.66Å; F261-F282 HydrophobicContact CZ-CD2 3.66Å; F261-F282 HydrophobicContact CZ-CE2 4.09Å; F261-F282 HydrophobicContact CZ-CG 4.27Å; I278-F282 WeakPolarHBondContact O-CA 3.39Å; I278-F282 WeakPolarHBondContact O-CB 3.22Å; I278-F282 PolarHBondContact O-N 3.43Å; F282-R284 PolarHBondContact O-N 2.87Å; F282-A285 HydrophobicContact CB-CB 4Å; F282-A285 WeakPolarHBondContact O-CB 3.49Å; F282-A285 PolarHBondContact O-N 3.44Å
283	P	98.6	Very high	97.9	Very high	56 Å²	56	58.4 Å²	58.4	36%	0.364	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15	-172.8	24.1	-35.5	0	0	0	114.8	L256 M279	L256-P283 HydrophobicContact CD2-CG 3.54Å; M279-P283 WeakPolarHBondContact O-CA 3.48Å
284	R	98.5	Very high	97.9	Very high	161 Å²	161	55.1 Å²	55.1	61%	0.608	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	18.7	172.1	-61.2	-160	179.7	152.9	-14.3	113.3	L256 F282	L256-R284 WeakPolarHBondContact O-CD 3.37Å; L256-R284 PolarHBondContact O-NE 3.32Å; L256-R284 PolarHBondContact O-NH1 2.92Å; F282-R284 PolarHBondContact O-N 2.87Å
285	A	98.7	Very high	97.8	Very high	14 Å²	14	55.4 Å²	55.4	12%	0.116	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.8	178.4	0	0	0	0	0	111.7	T259 F261 I278 M279 F282	T259-A285 HydrophobicContact CG2-CB 4.38Å; T259-A285 CarbonylContact O-C 3.49Å; T259-A285 VanDerWaalsContact O-CA 3.29Å; T259-A285 WeakPolarHBondContact O-CA 3.29Å; F261-A285 HydrophobicContact CD2-CB 3.86Å; F261-A285 HydrophobicContact CE2-CB 3.97Å; I278-A285 HydrophobicContact CG2-CB 4.03Å; M279-A285 HydrophobicContact SD-CB 4.02Å; F282-A285 HydrophobicContact CB-CB 4Å; F282-A285 WeakPolarHBondContact O-CB 3.49Å; F282-A285 PolarHBondContact O-N 3.44Å
286	Q	98.6	Very high	97.8	Very high	99 Å²	99	55 Å²	55	46%	0.463	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	137.2	158.4	-59.5	179.4	20.9	0	0	107.8	T259 L260 F261	T259-Q286 PolarHBondContact O-N 3.13Å; L260-Q286 CarbonylContact C-O 3.59Å; L260-Q286 WeakPolarHBondContact CA-O 3.31Å; L260-Q286 HydrophobicContact CD1-CB 4.15Å; F261-Q286 PolarHBondContact N-O 2.94Å
287	I	98.6	Very high	97.8	Very high	58 Å²	58	50.6 Å²	50.6	30%	0.297	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.5	173.6	-54.9	179.2	0	0	0	107.2	F261 L263 H275 I278	F261-I287 HydrophobicContact CB-CG1 4.2Å; F261-I287 HydrophobicContact CB-CG2 4.47Å; F261-I287 WeakPolarHBondContact O-CA 3.36Å; L263-I287 HydrophobicContact CD1-CG2 3.58Å; L263-I287 HydrophobicContact CG-CG2 4.05Å; H275-I287 HydrophobicContact CB-CD1 4.35Å; I278-I287 HydrophobicContact CG2-CD1 4.45Å
288	Q	98.4	Very high	97.8	Very high	69 Å²	69	48.8 Å²	48.8	32%	0.322	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.8	178	-62.7	-176.8	14.2	0	0	109.6	L260 F261 L262 L263	L260-Q288 HydrophobicContact CD1-CB 3.95Å; L260-Q288 HydrophobicContact CD1-CG 3.6Å; F261-Q288 PolarHBondContact O-N 3.11Å; L262-Q288 CarbonylContact C-O 3.56Å; L262-Q288 WeakPolarHBondContact CA-O 3.32Å; L262-Q288 HydrophobicContact CD1-CB 4.08Å; L263-Q288 PolarHBondContact N-O 3.09Å
289	T	98.5	Very high	97.6	Very high	84 Å²	84	52 Å²	52	52%	0.515	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.6	179.8	-58.3	0	0	0	0	109.7	L263 G265 P291	L263-T289 CarbonylContact O-C 3.58Å; L263-T289 WeakPolarHBondContact O-CA 3.4Å; G265-T289 VanDerWaalsContact CA-CG2 3.46Å; T289-P291 WeakPolarHBondContact O-CD 3.29Å
290	V	98.4	Very high	97.5	Very high	8 Å²	8	52.3 Å²	52.3	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	111.7	171.2	-177.5	0	0	0	0	108.6	L262 L263 G265 A293 I297 R301 D304	L262-V290 HydrophobicContact CD1-CG2 3.64Å; L262-V290 HydrophobicContact CD2-CG2 4.4Å; L262-V290 HydrophobicContact CG-CG2 4.04Å; L263-V290 PolarHBondContact O-N 2.95Å; G265-V290 PolarHBondContact N-O 3.3Å; V290-A293 HydrophobicContact CB-CB 4.06Å; V290-A293 HydrophobicContact CG1-CB 3.92Å; V290-A293 PolarHBondContact O-N 3.18Å; V290-I297 HydrophobicContact CB-CG2 4.02Å; V290-I297 HydrophobicContact CG1-CG2 4.18Å; V290-I297 HydrophobicContact CG2-CG2 3.83Å; V290-R301 HydrophobicContact CG1-CB 3.94Å; V290-R301 HydrophobicContact CG1-CG 4.07Å; V290-D304 HydrophobicContact CG1-CB 3.73Å
291	P	97.1	Very high	97.5	Very high	85 Å²	85	52.8 Å²	52.8	55%	0.552	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	144.2	-178.8	-21.6	33.7	0	0	0	111.5	T289 A293	T289-P291 WeakPolarHBondContact O-CD 3.29Å; P291-A293 PolarHBondContact O-N 2.8Å; P291-A293 VanDerWaalsContact O-N 3.1Å
292	N	96	Very high	97.4	Very high	117 Å²	117	55.6 Å²	55.6	63%	0.626	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	14.1	176.9	-47.6	-59.3	0	0	0	115.6
293	A	97.3	Very high	97.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.313	C	S	.	.			trans	-94.9	134.5	169.5	0	0	0	0	0	110.7	G264 G265 N266 V290 P291 I297 R301	G264-A293 CarbonylContact C-O 3.59Å; G264-A293 VanDerWaalsContact CA-O 3.22Å; G264-A293 WeakPolarHBondContact CA-O 3.27Å; G265-A293 PolarHBondContact N-O 3.14Å; N266-A293 WeakPolarHBondContact CB-O 3.39Å; N266-A293 PolarHBondContact N-O 3.46Å; V290-A293 HydrophobicContact CB-CB 4.06Å; V290-A293 HydrophobicContact CG1-CB 3.92Å; V290-A293 PolarHBondContact O-N 3.18Å; P291-A293 PolarHBondContact O-N 2.8Å; P291-A293 VanDerWaalsContact O-N 3.1Å; A293-I297 HydrophobicContact CB-CB 4.38Å; A293-I297 HydrophobicContact CB-CG1 4.12Å; A293-I297 HydrophobicContact CB-CG2 4.12Å; A293-R301 HydrophobicContact CB-CB 4.4Å; A293-R301 HydrophobicContact CB-CG 3.7Å
294	G	95.6	Very high	97.2	Very high	10 Å²	10	60.1 Å²	60.1	10%	0.103	31%	0.31	C	S	.	.			trans	-80.2	-154.4	162.7	0	0	0	0	0	111.9	W296 I297 E300	G294-W296 VanDerWaalsContact C-N 3.34Å; G294-W296 PolarHBondContact O-N 3.13Å; G294-I297 WeakPolarHBondContact O-CG1 3.39Å; G294-E300 WeakPolarHBondContact CA-OE2 3.44Å; G294-E300 PolarHBondContact N-OE2 2.97Å
295	H	95.3	Very high	97.2	Very high	28 Å²	28	52.4 Å²	52.4	13%	0.13	28%	0.281	C	S	.	.	S	Bend	trans	-64.4	-36.8	-175.2	-172.3	51.8	0	0	0	112.9	H139 S140 D164 F269 I297	H139-H295 AromaticContact CE1-CD2 3.96Å; H139-H295 AromaticContact CE1-NE2 3.73Å; H139-H295 AromaticContact NE2-CD2 3.65Å; H139-H295 AromaticContact NE2-CE1 3.66Å; H139-H295 AromaticContact NE2-CG 3.94Å; H139-H295 AromaticContact NE2-ND1 3.93Å; H139-H295 AromaticContact NE2-NE2 3.48Å; H139-H295 PolarHBondContact NE2-NE2 2.86Å; H139-H295 PolarHBondContact NE2-O 3.06Å; H139-H295 VanDerWaalsContact NE2-O 3.14Å; S140-H295 WeakPolarHBondContact CB-NE2 3.38Å; S140-H295 PolarHBondContact OG-NE2 3.26Å; D164-H295 PolarHBondContact O-CE1 3.46Å; D164-H295 WeakPolarHBondContact OD2-CA 3.41Å; D164-H295 IonicContact OD2-CE1 3.32Å; D164-H295 IonicContact OD2-CG 2.71Å; D164-H295 IonicContact OD2-ND1 3.1Å; D164-H295 PolarHBondContact OD2-ND1 2.79Å; F269-H295 AromaticContact CD1-CE1 3.79Å; F269-H295 HydrophobicContact CD2-CB 4.18Å; F269-H295 AromaticContact CD2-CE1 3.57Å; F269-H295 AromaticContact CD2-CG 3.66Å; F269-H295 AromaticContact CD2-ND1 3.2Å; F269-H295 WeakPolarHBondContact CD2-ND1 3.3Å; F269-H295 AromaticContact CE1-CE1 3.88Å; F269-H295 HydrophobicContact CE2-CB 4.08Å; F269-H295 AromaticContact CE2-CD2 3.72Å; F269-H295 AromaticContact CE2-CE1 3.66Å; F269-H295 AromaticContact CE2-CG 3.52Å; F269-H295 AromaticContact CE2-ND1 3.49Å; F269-H295 WeakPolarHBondContact CE2-ND1 3.41Å; F269-H295 AromaticContact CE2-NE2 3.82Å; F269-H295 AromaticContact CG-CE1 3.63Å; F269-H295 AromaticContact CG-ND1 3.62Å; F269-H295 AromaticContact CZ-CD2 3.99Å; F269-H295 AromaticContact CZ-CE1 3.82Å; F269-H295 AromaticContact CZ-NE2 3.73Å; H295-I297 VanDerWaalsContact C-N 3.3Å; H295-I297 PolarHBondContact O-N 2.93Å; H295-I297 VanDerWaalsContact O-N 3.09Å
296	W	96.3	Very high	97.1	Very high	50 Å²	50	52 Å²	52	19%	0.189	28%	0.277	C	S	.	.			trans	-91.1	60.3	-178.4	-59.4	-60.9	0	0	0	111.9	H139 A213 V214 H217 G294 H298 A299 E300	H139-W296 AromaticContact CE1-CD1 3.53Å; H139-W296 AromaticContact CE1-NE1 3.97Å; H139-W296 AromaticContact NE2-CD1 3.88Å; A213-W296 HydrophobicContact CB-CH2 4.47Å; A213-W296 HydrophobicContact CB-CZ3 3.85Å; V214-W296 HydrophobicContact CB-CH2 4.24Å; V214-W296 HydrophobicContact CG2-CH2 3.67Å; V214-W296 HydrophobicContact CG2-CZ2 4.44Å; V214-W296 HydrophobicContact CG2-CZ3 4.5Å; H217-W296 HydrophobicContact CB-CH2 4.37Å; H217-W296 HydrophobicContact CB-CZ2 4.14Å; G294-W296 VanDerWaalsContact C-N 3.34Å; G294-W296 PolarHBondContact O-N 3.13Å; W296-H298 PolarHBondContact O-N 3.1Å; W296-H298 VanDerWaalsContact O-N 3.11Å; W296-A299 HydrophobicContact CB-CB 4.03Å; W296-A299 WeakPolarHBondContact O-CA 3.5Å; W296-A299 PolarHBondContact O-N 3.41Å; W296-E300 HydrophobicContact CB-CG 4.5Å; W296-E300 PolarHBondContact N-OE1 3.31Å; W296-E300 WeakPolarHBondContact O-CG 3.47Å; W296-E300 PolarHBondContact O-N 3.35Å
297	I	97.9	Very high	97	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-48.1	-45	-178.3	-50	178.8	0	0	0	111.9	V163 D164 L262 V290 A293 G294 H295 A299 E300 R301 F305	V163-I297 HydrophobicContact CG1-CB 4.45Å; V163-I297 HydrophobicContact CG1-CD1 3.93Å; V163-I297 HydrophobicContact CG1-CG1 4.41Å; D164-I297 HydrophobicContact CB-CD1 4.17Å; L262-I297 HydrophobicContact CG-CD1 4.27Å; L262-I297 WeakPolarHBondContact O-CD1 3.34Å; V290-I297 HydrophobicContact CB-CG2 4.02Å; V290-I297 HydrophobicContact CG1-CG2 4.18Å; V290-I297 HydrophobicContact CG2-CG2 3.83Å; A293-I297 HydrophobicContact CB-CB 4.38Å; A293-I297 HydrophobicContact CB-CG1 4.12Å; A293-I297 HydrophobicContact CB-CG2 4.12Å; G294-I297 WeakPolarHBondContact O-CG1 3.39Å; H295-I297 VanDerWaalsContact C-N 3.3Å; H295-I297 PolarHBondContact O-N 2.93Å; H295-I297 VanDerWaalsContact O-N 3.09Å; I297-A299 PolarHBondContact O-N 3.48Å; I297-E300 PolarHBondContact O-N 3.01Å; I297-R301 CarbonylContact O-C 3.55Å; I297-R301 VanDerWaalsContact O-C 3.29Å; I297-R301 WeakPolarHBondContact O-CA 3.34Å; I297-R301 PolarHBondContact O-N 3.38Å; I297-F305 HydrophobicContact CB-CD2 4.29Å; I297-F305 HydrophobicContact CG2-CB 4.25Å; I297-F305 HydrophobicContact CG2-CD2 4.01Å
298	H	96.9	Very high	97	Very high	13 Å²	13	48.4 Å²	48.4	6%	0.06	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-25	179.6	59.8	-81.3	0	0	0	114.3	F81 H139 W296 F305	F81-H298 HydrophobicContact CD1-CB 4.39Å; F81-H298 HydrophobicContact CE1-CB 3.92Å; F81-H298 AromaticContact CE1-CD2 3.89Å; F81-H298 AromaticContact CE1-CG 3.74Å; H139-H298 AromaticContact CE1-CE1 3.94Å; H139-H298 AromaticContact CG-CE1 3.85Å; H139-H298 AromaticContact ND1-CE1 3.76Å; W296-H298 PolarHBondContact O-N 3.1Å; W296-H298 VanDerWaalsContact O-N 3.11Å; H298-F305 HydrophobicContact CB-CD1 3.91Å; H298-F305 HydrophobicContact CB-CD2 4.21Å; H298-F305 HydrophobicContact CB-CE1 3.89Å; H298-F305 HydrophobicContact CB-CE2 4.21Å; H298-F305 HydrophobicContact CB-CG 4.06Å; H298-F305 HydrophobicContact CB-CZ 4.04Å
299	A	95.6	Very high	97	Very high	69 Å²	69	45.1 Å²	45.1	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-95.4	-37.4	177.3	0	0	0	0	0	112.2	W296 I297	W296-A299 HydrophobicContact CB-CB 4.03Å; W296-A299 WeakPolarHBondContact O-CA 3.5Å; W296-A299 PolarHBondContact O-N 3.41Å; I297-A299 PolarHBondContact O-N 3.48Å
300	E	96.4	Very high	96.9	Very high	85 Å²	85	45.6 Å²	45.6	40%	0.397	24%	0.24	S	C	.	.	H	α-helix	trans	-83.8	-37.9	-174.6	-64.9	177.1	-143.5	0	0	112.7	G294 W296 I297	G294-E300 WeakPolarHBondContact CA-OE2 3.44Å; G294-E300 PolarHBondContact N-OE2 2.97Å; W296-E300 HydrophobicContact CB-CG 4.5Å; W296-E300 PolarHBondContact N-OE1 3.31Å; W296-E300 WeakPolarHBondContact O-CG 3.47Å; W296-E300 PolarHBondContact O-N 3.35Å; I297-E300 PolarHBondContact O-N 3.01Å
301	R	97.4	Very high	96.8	Very high	103 Å²	103	47.7 Å²	47.7	39%	0.389	26%	0.263	S	S	.	.	S	Bend	trans	-133.1	60.5	-177.1	-57.3	-61.6	-67.2	174.9	-0.9	110.6	V290 A293 I297 Q303 D304 F305	V290-R301 HydrophobicContact CG1-CB 3.94Å; V290-R301 HydrophobicContact CG1-CG 4.07Å; A293-R301 HydrophobicContact CB-CB 4.4Å; A293-R301 HydrophobicContact CB-CG 3.7Å; I297-R301 CarbonylContact O-C 3.55Å; I297-R301 VanDerWaalsContact O-C 3.29Å; I297-R301 WeakPolarHBondContact O-CA 3.34Å; I297-R301 PolarHBondContact O-N 3.38Å; R301-Q303 VanDerWaalsContact C-N 3.32Å; R301-Q303 PolarHBondContact O-N 2.92Å; R301-D304 HydrophobicContact CB-CB 4.15Å; R301-D304 IonicContact CZ-OD2 2.74Å; R301-D304 IonicContact NE-OD2 3.89Å; R301-D304 PolarHBondContact NE-OD2 2.97Å; R301-D304 IonicContact NH2-OD1 3.58Å; R301-D304 IonicContact NH2-OD2 2.77Å; R301-D304 PolarHBondContact NH2-OD2 2.92Å; R301-D304 PolarHBondContact O-N 3.26Å; R301-F305 WeakPolarHBondContact O-CB 3.38Å; R301-F305 PolarHBondContact O-N 3.42Å
302	P	96.6	Very high	96.8	Very high	59 Å²	59	44.2 Å²	44.2	38%	0.383	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-35.5	-170.5	23.8	-34.9	0	0	0	113.9	I84 I306	I84-P302 HydrophobicContact CD1-CB 3.67Å; P302-I306 VanDerWaalsContact O-CG1 3.31Å; P302-I306 WeakPolarHBondContact O-CG1 3.43Å; P302-I306 PolarHBondContact O-N 3.31Å; P302-I306 VanDerWaalsContact O-N 3.08Å
303	Q	96.4	Very high	96.7	Very high	95 Å²	95	39.3 Å²	39.3	44%	0.444	21%	0.213	S	C	.	.	H	α-helix	trans	-71.5	-49	179.2	-172	57.6	49.7	0	0	111.2	R301 F305 I306 D307	R301-Q303 VanDerWaalsContact C-N 3.32Å; R301-Q303 PolarHBondContact O-N 2.92Å; Q303-F305 PolarHBondContact O-N 3.06Å; Q303-I306 PolarHBondContact O-N 2.97Å; Q303-I306 VanDerWaalsContact O-N 3.12Å; Q303-D307 PolarHBondContact NE2-OD1 3.1Å; Q303-D307 PolarHBondContact NE2-OD2 2.94Å; Q303-D307 PolarHBondContact O-N 3.45Å
304	D	97.7	Very high	96.2	Very high	55 Å²	55	47.6 Å²	47.6	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-58.6	-38.3	176.1	-57.6	-26.4	0	0	0	111.2	V290 R301 D307 A308	V290-D304 HydrophobicContact CG1-CB 3.73Å; R301-D304 HydrophobicContact CB-CB 4.15Å; R301-D304 IonicContact CZ-OD2 2.74Å; R301-D304 IonicContact NE-OD2 3.89Å; R301-D304 PolarHBondContact NE-OD2 2.97Å; R301-D304 IonicContact NH2-OD1 3.58Å; R301-D304 IonicContact NH2-OD2 2.77Å; R301-D304 PolarHBondContact NH2-OD2 2.92Å; R301-D304 PolarHBondContact O-N 3.26Å; D304-D307 PolarHBondContact O-N 2.99Å; D304-A308 VanDerWaalsContact O-CB 3.28Å; D304-A308 WeakPolarHBondContact O-CB 3.43Å; D304-A308 PolarHBondContact O-N 3.49Å
305	F	98.1	Very high	96.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-48.8	174.6	-178.5	-102	0	0	0	112.4	F70 F81 I84 V137 V163 L262 I297 H298 R301 Q303 I309	F70-F305 AromaticContact CE1-CE1 3.89Å; F70-F305 HydrophobicContact CE1-CE1 3.89Å; F70-F305 HydrophobicContact CE1-CZ 4.22Å; F81-F305 HydrophobicContact CE1-CE1 4.39Å; F81-F305 HydrophobicContact CE1-CZ 4.26Å; I84-F305 HydrophobicContact CD1-CD1 4.26Å; I84-F305 HydrophobicContact CG2-CD1 4.12Å; I84-F305 HydrophobicContact CG2-CE1 3.94Å; V137-F305 HydrophobicContact CG1-CZ 4.05Å; V163-F305 HydrophobicContact CB-CE2 4.35Å; V163-F305 HydrophobicContact CG1-CD2 4.46Å; V163-F305 HydrophobicContact CG1-CE2 3.74Å; V163-F305 HydrophobicContact CG2-CE2 3.67Å; V163-F305 HydrophobicContact CG2-CZ 4.1Å; L262-F305 HydrophobicContact CD2-CD2 3.63Å; L262-F305 HydrophobicContact CD2-CE2 3.96Å; I297-F305 HydrophobicContact CB-CD2 4.29Å; I297-F305 HydrophobicContact CG2-CB 4.25Å; I297-F305 HydrophobicContact CG2-CD2 4.01Å; H298-F305 HydrophobicContact CB-CD1 3.91Å; H298-F305 HydrophobicContact CB-CD2 4.21Å; H298-F305 HydrophobicContact CB-CE1 3.89Å; H298-F305 HydrophobicContact CB-CE2 4.21Å; H298-F305 HydrophobicContact CB-CG 4.06Å; H298-F305 HydrophobicContact CB-CZ 4.04Å; R301-F305 WeakPolarHBondContact O-CB 3.38Å; R301-F305 PolarHBondContact O-N 3.42Å; Q303-F305 PolarHBondContact O-N 3.06Å; F305-I309 HydrophobicContact CD1-CD1 3.96Å; F305-I309 HydrophobicContact CE1-CD1 3.42Å; F305-I309 VanDerWaalsContact CE1-CD1 3.42Å; F305-I309 HydrophobicContact CE2-CD1 4.03Å; F305-I309 HydrophobicContact CG-CD1 4.49Å; F305-I309 HydrophobicContact CZ-CD1 3.47Å; F305-I309 VanDerWaalsContact CZ-CD1 3.47Å; F305-I309 WeakPolarHBondContact O-CG1 3.37Å; F305-I309 PolarHBondContact O-N 3.5Å
306	I	96.7	Very high	96.2	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-45.3	178.2	-73.2	166.8	0	0	0	110.7	I84 A87 F88 Q91 P302 Q303 I309 R310	I84-I306 HydrophobicContact CD1-CD1 3.79Å; I84-I306 HydrophobicContact CD1-CG1 3.98Å; I84-I306 HydrophobicContact CG2-CG1 4.17Å; A87-I306 HydrophobicContact CB-CD1 3.88Å; F88-I306 HydrophobicContact CD2-CG2 4.16Å; Q91-I306 VanDerWaalsContact OE1-CG2 3.25Å; P302-I306 VanDerWaalsContact O-CG1 3.31Å; P302-I306 WeakPolarHBondContact O-CG1 3.43Å; P302-I306 PolarHBondContact O-N 3.31Å; P302-I306 VanDerWaalsContact O-N 3.08Å; Q303-I306 PolarHBondContact O-N 2.97Å; Q303-I306 VanDerWaalsContact O-N 3.12Å; I306-I309 PolarHBondContact O-N 2.97Å; I306-R310 HydrophobicContact CG2-CG 4.21Å; I306-R310 WeakPolarHBondContact O-CB 3.41Å; I306-R310 WeakPolarHBondContact O-CG 3.35Å; I306-R310 PolarHBondContact O-N 3.21Å
307	D	96.8	Very high	96.2	Very high	66 Å²	66	50.7 Å²	50.7	35%	0.353	28%	0.284	S	S	.	.	H	α-helix	trans	-67.2	-38.9	-176.8	-69.7	-29.2	0	0	0	111.9	Q303 D304 R310 G311	Q303-D307 PolarHBondContact NE2-OD1 3.1Å; Q303-D307 PolarHBondContact NE2-OD2 2.94Å; Q303-D307 PolarHBondContact O-N 3.45Å; D304-D307 PolarHBondContact O-N 2.99Å; D307-R310 PolarHBondContact O-N 2.99Å; D307-R310 IonicContact OD1-NH1 3.44Å; D307-G311 PolarHBondContact O-N 2.69Å
308	A	97.9	Very high	96.1	Very high	15 Å²	15	53.6 Å²	53.6	12%	0.124	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-45.7	173.5	0	0	0	0	0	111.8	L262 D304 F312	L262-A308 HydrophobicContact CD1-CB 3.76Å; L262-A308 HydrophobicContact CD2-CB 4Å; D304-A308 VanDerWaalsContact O-CB 3.28Å; D304-A308 WeakPolarHBondContact O-CB 3.43Å; D304-A308 PolarHBondContact O-N 3.49Å; A308-F312 WeakPolarHBondContact O-CB 3.47Å; A308-F312 PolarHBondContact O-N 3.34Å; A308-F312 VanDerWaalsContact O-N 3.15Å
309	I	97.4	Very high	96.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-49.6	176.5	-66.4	174.8	0	0	0	110.1	F70 F88 V137 I161 F305 I306 G311 F312 L313	F70-I309 HydrophobicContact CE1-CD1 4Å; F70-I309 HydrophobicContact CZ-CD1 4.35Å; F88-I309 HydrophobicContact CD2-CG2 4.44Å; F88-I309 HydrophobicContact CE2-CB 3.9Å; F88-I309 HydrophobicContact CE2-CG2 3.36Å; F88-I309 HydrophobicContact CZ-CG2 3.53Å; V137-I309 HydrophobicContact CG1-CD1 3.91Å; V137-I309 HydrophobicContact CG2-CD1 4.28Å; I161-I309 HydrophobicContact CD1-CB 4.36Å; I161-I309 HydrophobicContact CD1-CG1 4.13Å; I161-I309 HydrophobicContact CD1-CG2 3.74Å; I161-I309 HydrophobicContact CG2-CG1 4.44Å; F305-I309 HydrophobicContact CD1-CD1 3.96Å; F305-I309 HydrophobicContact CE1-CD1 3.42Å; F305-I309 VanDerWaalsContact CE1-CD1 3.42Å; F305-I309 HydrophobicContact CE2-CD1 4.03Å; F305-I309 HydrophobicContact CG-CD1 4.49Å; F305-I309 HydrophobicContact CZ-CD1 3.47Å; F305-I309 VanDerWaalsContact CZ-CD1 3.47Å; F305-I309 WeakPolarHBondContact O-CG1 3.37Å; F305-I309 PolarHBondContact O-N 3.5Å; I306-I309 PolarHBondContact O-N 2.97Å; I309-G311 VanDerWaalsContact C-N 3.34Å; I309-G311 PolarHBondContact O-N 3.02Å; I309-F312 PolarHBondContact O-N 3.36Å; I309-F312 VanDerWaalsContact O-N 3.11Å; I309-L313 HydrophobicContact CG2-CD1 4.38Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CG 3.2Å; I309-L313 PolarHBondContact O-N 3.27Å; I309-L313 VanDerWaalsContact O-N 3.13Å
310	R	96.1	Very high	96.1	Very high	94 Å²	94	55.3 Å²	55.3	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-59.1	-45.5	-179.3	-74.6	177.6	65.4	-137.8	0.7	111.7	F88 T92 I306 D307 F312 L313 V314	F88-R310 HydrophobicContact CD2-CG 4.3Å; F88-R310 HydrophobicContact CE2-CG 3.63Å; F88-R310 HydrophobicContact CZ-CG 4.13Å; T92-R310 HydrophobicContact CG2-CG 3.82Å; I306-R310 HydrophobicContact CG2-CG 4.21Å; I306-R310 WeakPolarHBondContact O-CB 3.41Å; I306-R310 WeakPolarHBondContact O-CG 3.35Å; I306-R310 PolarHBondContact O-N 3.21Å; D307-R310 PolarHBondContact O-N 2.99Å; D307-R310 IonicContact OD1-NH1 3.44Å; R310-F312 PolarHBondContact O-N 2.71Å; R310-L313 PolarHBondContact O-N 3.49Å; R310-L313 VanDerWaalsContact O-N 3.08Å; R310-V314 PolarHBondContact O-N 3.21Å
311	G	96.6	Very high	96.1	Very high	52 Å²	52	53.2 Å²	53.2	54%	0.536	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-32.1	177.5	0	0	0	0	0	113	D307 I309	D307-G311 PolarHBondContact O-N 2.69Å; I309-G311 VanDerWaalsContact C-N 3.34Å; I309-G311 PolarHBondContact O-N 3.02Å
312	F	97.8	Very high	96	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.057	29%	0.285	C	S	.	.	H	α-helix	trans	-79.7	-18.5	176.3	-178.6	-111.9	0	0	0	114.3	R159 I161 P258 T259 L260 A308 I309 R310	R159-F312 HydrophobicContact CB-CE1 3.96Å; R159-F312 HydrophobicContact CG-CE1 4.36Å; I161-F312 HydrophobicContact CD1-CD1 3.92Å; I161-F312 HydrophobicContact CD1-CE1 4.42Å; I161-F312 HydrophobicContact CG1-CD1 3.67Å; I161-F312 HydrophobicContact CG1-CE1 3.81Å; P258-F312 HydrophobicContact CB-CE2 4.32Å; P258-F312 HydrophobicContact CB-CZ 3.81Å; T259-F312 VanDerWaalsContact C-CZ 3.47Å; L260-F312 HydrophobicContact CB-CD1 3.86Å; L260-F312 HydrophobicContact CB-CD2 3.99Å; L260-F312 HydrophobicContact CB-CE1 3.81Å; L260-F312 HydrophobicContact CB-CE2 3.97Å; L260-F312 HydrophobicContact CB-CG 3.94Å; L260-F312 HydrophobicContact CB-CZ 3.88Å; L260-F312 HydrophobicContact CD2-CB 3.94Å; L260-F312 HydrophobicContact CD2-CD1 4.31Å; L260-F312 HydrophobicContact CD2-CG 4.02Å; A308-F312 WeakPolarHBondContact O-CB 3.47Å; A308-F312 PolarHBondContact O-N 3.34Å; A308-F312 VanDerWaalsContact O-N 3.15Å; I309-F312 PolarHBondContact O-N 3.36Å; I309-F312 VanDerWaalsContact O-N 3.11Å; R310-F312 PolarHBondContact O-N 2.71Å
313	L	94.8	Very high	96	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-86.8	-10.7	178.2	-64.6	-165.6	0	0	0	114.3	V68 F88 V135 I309 R310	V68-L313 HydrophobicContact CG2-CD1 4.16Å; F88-L313 HydrophobicContact CE1-CD1 4.12Å; F88-L313 HydrophobicContact CZ-CD1 3.65Å; V135-L313 HydrophobicContact CB-CD2 4.42Å; V135-L313 HydrophobicContact CG1-CD2 3.84Å; V135-L313 HydrophobicContact CG2-CD2 3.73Å; I309-L313 HydrophobicContact CG2-CD1 4.38Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CG 3.2Å; I309-L313 PolarHBondContact O-N 3.27Å; I309-L313 VanDerWaalsContact O-N 3.13Å; R310-L313 PolarHBondContact O-N 3.49Å; R310-L313 VanDerWaalsContact O-N 3.08Å
314	V	85.3	Confident	95.9	Very high	175 Å²	175	44.4 Å²	44.4	100%	1.061	26%	0.261	S	S	*	.			trans	-93.6	0	177	-178.9	0	0	0	0	109.3	R310	R310-V314 PolarHBondContact O-N 3.21Å

Retrieved 314 of 314 residues in 101.9 ms (Link to these results)

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