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Isoform l of cAMP-dependent protein kinase catalytic subunit AlphaSync

Canonical isoform description: Essential for larval development¹. Controls the rhythmic contraction of enteric muscles probably by regulating G-protein coupled receptor aex-2-mediated calcium influx in GABAergic DVB neurons². Plays a role in the control of oocyte meiotic maturation by gonadal sheath cells³. Isoforms a and b: May play a role in the regulation of neuromuscular junctions.

AlphaFold DB , UniProt , Accession P21137-12 (canonical: P21137), Species CAEEL (Caenorhabditis elegans), Gene kin-1, Length 388 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.1	Very low	27.6	Very low	224 Å²	224	115.6 Å²	115.6	100%	1.103	62%	0.621	S	S	*	*				0	137.6	0	-63.2	-163.3	-169.6	0	0	107.1	T3	M1-T3 PolarHBondContact O-N 3.35Å
2	P	27.2	Very low	28.2	Very low	140 Å²	140	109.2 Å²	109.2	91%	0.909	58%	0.584	S	S	*	*			trans	-73.6	98.2	173.4	30	-27.4	0	0	0	107.5	R4	P2-R4 PolarHBondContact O-N 2.69Å
3	T	27.8	Very low	28.1	Very low	115 Å²	115	112.9 Å²	112.9	71%	0.706	59%	0.593	S	S	*	*			trans	-79.7	111.1	169.8	42.9	0	0	0	0	107.8	M1 L5	M1-T3 PolarHBondContact O-N 3.35Å; T3-L5 PolarHBondContact O-N 3.31Å
4	R	27.2	Very low	28.1	Very low	221 Å²	221	110.8 Å²	110.8	83%	0.834	59%	0.592	S	S	*	*			trans	-45.3	118.7	168.8	-156.1	176.4	-171.7	175	-0.2	109	P2 D6	P2-R4 PolarHBondContact O-N 2.69Å; R4-D6 VanDerWaalsContact C-N 3.34Å; R4-D6 PolarHBondContact O-N 3.37Å
5	L	25.9	Very low	28	Very low	75 Å²	75	110.9 Å²	110.9	39%	0.393	61%	0.605	S	S	.	*			trans	-70.1	94.3	169.4	-113.9	88.8	0	0	0	107.4	T3 F167	T3-L5 PolarHBondContact O-N 3.31Å; L5-F167 HydrophobicContact CD1-CE1 4.49Å
6	D	25	Very low	27.9	Very low	115 Å²	115	110.5 Å²	110.5	62%	0.615	61%	0.613	S	S	*	*			trans	-88.9	125.5	148.3	-68.9	-40.1	0	0	0	104.8	R4 V8	R4-D6 VanDerWaalsContact C-N 3.34Å; R4-D6 PolarHBondContact O-N 3.37Å; D6-V8 PolarHBondContact O-N 2.66Å
7	I	28.3	Very low	27.9	Very low	78 Å²	78	111.8 Å²	111.8	40%	0.4	63%	0.625	S	S	.	*			trans	-58	97.9	153.9	-74.3	168.4	0	0	0	103.7	G9 T89	I7-G9 PolarHBondContact O-N 3.22Å; I7-T89 WeakPolarHBondContact CB-O 3.45Å; I7-T89 WeakPolarHBondContact CD1-O 3.33Å
8	V	28.5	Very low	28.2	Very low	98 Å²	98	113.5 Å²	113.5	59%	0.594	63%	0.632	S	S	*	*			trans	-53.4	115.3	-169.1	176.1	0	0	0	0	106.5	D6 N10	D6-V8 PolarHBondContact O-N 2.66Å; V8-N10 PolarHBondContact O-N 3.14Å
9	G	27.4	Very low	28.3	Very low	39 Å²	39	116.3 Å²	116.3	40%	0.402	65%	0.646	S	S	.	*			trans	-48.8	115.1	169.3	0	0	0	0	0	107.8	I7 L11	I7-G9 PolarHBondContact O-N 3.22Å; G9-L11 PolarHBondContact O-N 3.31Å
10	N	34.2	Very low	28.5	Very low	46 Å²	46	113.9 Å²	113.9	25%	0.246	65%	0.648	C	S	.	*			trans	-50.5	99.4	172.5	-92.2	-13.9	0	0	0	109.2	V8 Q12 F225	V8-N10 PolarHBondContact O-N 3.14Å; N10-Q12 PolarHBondContact O-N 3.41Å; N10-F225 HydrophobicContact CB-CE1 4.04Å; N10-F225 HydrophobicContact CB-CE2 4.03Å; N10-F225 HydrophobicContact CB-CZ 3.34Å; N10-F225 WeakPolarHBondContact ND2-CE2 3.3Å; N10-F225 WeakPolarHBondContact ND2-CZ 3.28Å; N10-F225 WeakPolarHBondContact OD1-CE2 3.33Å; N10-F225 WeakPolarHBondContact OD1-CZ 3.49Å
11	L	27.6	Very low	28.8	Very low	121 Å²	121	116.5 Å²	116.5	63%	0.634	66%	0.661	S	S	*	*			trans	-68.5	99	174.4	-93.1	152.8	0	0	0	107.7	G9 F13	G9-L11 PolarHBondContact O-N 3.31Å; L11-F13 HydrophobicContact CD2-CE2 4.38Å
12	Q	34.2	Very low	29.1	Very low	38 Å²	38	114.1 Å²	114.1	18%	0.178	65%	0.647	C	S	.	*			trans	-110.2	118.5	164.5	-94.9	-179.8	-18.4	0	0	109.5	N10 H125 F225 C237	N10-Q12 PolarHBondContact O-N 3.41Å; Q12-H125 VanDerWaalsContact CD-CE1 3.43Å; Q12-H125 PolarHBondContact NE2-CE1 3.3Å; Q12-H125 PolarHBondContact OE1-CE1 3.11Å; Q12-H125 PolarHBondContact OE1-ND1 3Å; Q12-F225 HydrophobicContact CG-CE1 4.15Å; Q12-F225 HydrophobicContact CG-CZ 4.42Å; Q12-C237 HydrophobicContact CG-CB 4.08Å
13	F	27.4	Very low	29.4	Very low	158 Å²	158	115.6 Å²	115.6	69%	0.693	65%	0.647	S	S	*	*			trans	-84.9	106.8	157.5	-74.4	-82.8	0	0	0	107.5	L11 S15	L11-F13 HydrophobicContact CD2-CE2 4.38Å; F13-S15 PolarHBondContact O-N 2.95Å
14	S	28.3	Very low	29.3	Very low	83 Å²	83	119 Å²	119	58%	0.58	66%	0.655	S	S	*	*			trans	-74.8	105.7	169.9	62.3	0	0	0	0	109.2
15	S	26.4	Very low	29.3	Very low	112 Å²	112	117.6 Å²	117.6	78%	0.783	66%	0.658	S	S	*	*			trans	-94.2	110	156.8	58.1	0	0	0	0	108.4	F13 T17	F13-S15 PolarHBondContact O-N 2.95Å; S15-T17 PolarHBondContact O-N 3.08Å
16	S	25.8	Very low	29.4	Very low	105 Å²	105	118.5 Å²	118.5	73%	0.734	68%	0.676	S	S	*	*			trans	-78.6	108.1	177.8	-48	0	0	0	0	110
17	T	27.6	Very low	29.3	Very low	133 Å²	133	120 Å²	120	82%	0.816	68%	0.684	S	S	*	*			trans	-165	103.6	151.1	45.1	0	0	0	0	108.2	S15	S15-T17 PolarHBondContact O-N 3.08Å
18	D	33.1	Very low	29.2	Very low	142 Å²	142	122.9 Å²	122.9	76%	0.759	71%	0.705	S	S	*	*			trans	-148	109.9	146.3	-142.2	0.5	0	0	0	108.2
19	N	30.4	Very low	28.9	Very low	167 Å²	167	123.8 Å²	123.8	89%	0.893	71%	0.71	S	S	*	*			trans	-97.5	126.9	170.1	-82.3	-22.9	0	0	0	105.8
20	G	33	Very low	28.8	Very low	67 Å²	67	125.5 Å²	125.5	69%	0.691	72%	0.721	S	S	*	*			trans	168.1	100.3	171.4	0	0	0	0	0	114.8
21	D	35.4	Very low	28.3	Very low	170 Å²	170	129 Å²	129	91%	0.909	75%	0.748	S	S	*	*			trans	91.9	126.2	148.7	-55	-19.2	0	0	0	120.6
22	E	30.4	Very low	28.3	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.813	76%	0.756	S	S	*	*			trans	-75.9	150.4	-169.6	-58.9	169.2	141.9	0	0	111.4
23	D	32.8	Very low	27.9	Very low	170 Å²	170	137 Å²	137	91%	0.909	79%	0.789	S	S	*	*				-166.6	131.7	126.4	-93.1	-28.8	0	0	0	111
24	Q	26	Very low	27.9	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	80%	0.795	S	S	*	*			trans	-83.3	140.3	178.8	-67.2	166.9	-8.9	0	0	110.2
25	E	28.8	Very low	27.9	Very low	193 Å²	193	138.5 Å²	138.5	90%	0.902	80%	0.804	S	S	*	*				177.5	127.8	118.3	-102.8	-177.9	155	0	0	114.9
26	A	27.4	Very low	28	Very low	93 Å²	93	138 Å²	138	77%	0.769	80%	0.8	S	S	*	*			trans	34.8	120.2	141.1	0	0	0	0	0	123.6
27	D	22.3	Very low	28.6	Very low	147 Å²	147	139 Å²	139	79%	0.786	80%	0.804	S	S	*	*			trans	-54.5	134.1	160.6	-127.8	-25.3	0	0	0	114.2
28	V	26.5	Very low	28.7	Very low	138 Å²	138	137.7 Å²	137.7	84%	0.836	80%	0.8	S	S	*	*			trans	-142.9	109.2	149.1	-162.1	0	0	0	0	109.6
29	T	22.8	Very low	28.6	Very low	117 Å²	117	136.1 Å²	136.1	72%	0.718	80%	0.8	S	S	*	*			trans	-72.4	126.4	172.2	-50.5	0	0	0	0	110.7
30	A	24.8	Very low	28.8	Very low	76 Å²	76	137.9 Å²	137.9	63%	0.628	80%	0.801	S	S	*	*			trans	-134.4	112.2	163	0	0	0	0	0	110	F32	A30-F32 HydrophobicContact CB-CD2 4.46Å; A30-F32 HydrophobicContact CB-CE2 4.36Å; A30-F32 PolarHBondContact O-N 3.36Å
31	C	23.5	Very low	28.8	Very low	120 Å²	120	139.2 Å²	139.2	81%	0.811	80%	0.799	S	S	*	*			trans	-64.9	120	171.2	-66.6	0	0	0	0	110.2
32	F	27.7	Very low	28.9	Very low	181 Å²	181	140.1 Å²	140.1	79%	0.794	80%	0.795	S	S	*	*			trans	-126.2	122.7	161.9	-84.2	-82.4	0	0	0	110.5	A30 L34	A30-F32 HydrophobicContact CB-CD2 4.46Å; A30-F32 HydrophobicContact CB-CE2 4.36Å; A30-F32 PolarHBondContact O-N 3.36Å; F32-L34 PolarHBondContact O-N 3.41Å
33	V	25.1	Very low	29	Very low	146 Å²	146	139.1 Å²	139.1	89%	0.885	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.8	118.4	171.3	177.4	0	0	0	0	107.9
34	L	28.7	Very low	29.8	Very low	154 Å²	154	132.9 Å²	132.9	81%	0.806	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-92.7	134.2	174.7	-69.2	178.8	0	0	0	111	F32	F32-L34 PolarHBondContact O-N 3.41Å
35	P	27.1	Very low	31	Very low	118 Å²	118	124.7 Å²	124.7	77%	0.766	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-75.9	157.4	171.5	32.4	-31.2	0	0	0	111.2
36	S	28.3	Very low	32.1	Very low	100 Å²	100	118.9 Å²	118.9	70%	0.699	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-49.2	142.3	-179	53.9	0	0	0	0	114.4	S38	S36-S38 PolarHBondContact O-N 3.16Å
37	P	38.3	Very low	33.3	Very low	127 Å²	127	120.3 Å²	120.3	83%	0.825	70%	0.695	S	S	*	*			trans	-76.6	96.9	175.9	30.3	-30.4	0	0	0	110.5
38	S	30.6	Very low	34.6	Very low	105 Å²	105	118.1 Å²	118.1	73%	0.734	68%	0.684	S	S	*	*			trans	-79.1	115.3	160.5	53.9	0	0	0	0	109.5	S36	S36-S38 PolarHBondContact O-N 3.16Å
39	S	30.1	Very low	35.9	Very low	109 Å²	109	116.7 Å²	116.7	76%	0.762	68%	0.678	S	S	*	*			trans	50.4	74.5	157.4	-178.1	0	0	0	0	117.1	S41	S39-S41 PolarHBondContact O-N 3.22Å
40	F	35.6	Very low	37.5	Very low	205 Å²	205	112.1 Å²	112.1	90%	0.899	65%	0.649	S	S	*	*			trans	-76.6	100.3	149.8	-102.3	-91.8	0	0	0	108.1	K42	F40-K42 PolarHBondContact O-N 3.44Å
41	S	32.4	Very low	39.1	Very low	94 Å²	94	117.3 Å²	117.3	66%	0.657	66%	0.661	S	S	*	*			trans	-55.9	121.6	160.8	48.9	0	0	0	0	108.3	S39 L43	S39-S41 PolarHBondContact O-N 3.22Å; S41-L43 PolarHBondContact O-N 3.05Å
42	K	38.5	Very low	41.6	Very low	189 Å²	189	115.1 Å²	115.1	82%	0.822	64%	0.641	S	S	*	*			trans	-55	100.6	170.6	-82.9	179.3	172.8	-178.4	0	109	F40 S44	F40-K42 PolarHBondContact O-N 3.44Å; K42-S44 PolarHBondContact O-N 2.95Å
43	L	32.7	Very low	44.3	Very low	153 Å²	153	107.2 Å²	107.2	80%	0.801	61%	0.606	S	S	*	*			trans	-86.7	89.3	159.4	-152.2	81.1	0	0	0	105.6	S41	S41-L43 PolarHBondContact O-N 3.05Å
44	S	47.9	Very low	47.1	Very low	39 Å²	39	106.8 Å²	106.8	27%	0.273	59%	0.592	S	S	.	*			trans	-73.6	133.9	170.5	84	0	0	0	0	107.3	K42 L46 D47	K42-S44 PolarHBondContact O-N 2.95Å; S44-L46 PolarHBondContact O-N 3.29Å; S44-D47 PolarHBondContact O-N 2.92Å; S44-D47 VanDerWaalsContact OG-CG 3.24Å; S44-D47 PolarHBondContact OG-OD2 3.3Å
45	I	51.2	Low	49.8	Very low	14 Å²	14	105.8 Å²	105.8	7%	0.072	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-60.5	-14.9	177.7	-58.8	164.6	0	0	0	110.8	D47 F56 K59 D63	I45-D47 PolarHBondContact O-N 2.66Å; I45-F56 HydrophobicContact CB-CE2 4.4Å; I45-F56 HydrophobicContact CG2-CD2 3.85Å; I45-F56 HydrophobicContact CG2-CE2 3.63Å; I45-K59 HydrophobicContact CG2-CD 4.11Å; I45-D63 HydrophobicContact CD1-CB 4.22Å; I45-D63 WeakPolarHBondContact CD1-OD2 3.49Å
46	L	52.7	Low	52.8	Low	72 Å²	72	100.6 Å²	100.6	38%	0.377	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-80.9	-8.4	-173.7	-53.8	179.9	0	0	0	114.6	S44 F56 P139 Y344	S44-L46 PolarHBondContact O-N 3.29Å; L46-F56 HydrophobicContact CD2-CE2 4.47Å; L46-P139 HydrophobicContact CD1-CG 3.9Å; L46-P139 HydrophobicContact CD2-CG 3.59Å; L46-P139 HydrophobicContact CG-CG 4.41Å; L46-Y344 HydrophobicContact CD2-CE2 4.25Å; L46-Y344 WeakPolarHBondContact CD2-OH 3.41Å
47	D	52.2	Low	55.8	Low	122 Å²	122	96.7 Å²	96.7	65%	0.652	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-83.1	-11	-175.5	-67.8	-47.6	0	0	0	113.8	S44 I45	S44-D47 PolarHBondContact O-N 2.92Å; S44-D47 VanDerWaalsContact OG-CG 3.24Å; S44-D47 PolarHBondContact OG-OD2 3.3Å; I45-D47 PolarHBondContact O-N 2.66Å
48	D	50.1	Low	58.3	Low	102 Å²	102	94.1 Å²	94.1	55%	0.545	50%	0.5	S	S	.	.	S	Bend	trans	-91	133.7	172.3	-71.4	-38.2	0	0	0	110.6	V50 K59	D48-V50 PolarHBondContact O-N 3.28Å; D48-K59 IonicContact OD2-NZ 3.65Å
49	P	52.9	Low	61.2	Low	108 Å²	108	93.3 Å²	93.3	70%	0.701	48%	0.483	S	S	*	.			trans	-63.4	100.1	174.1	24.3	-30.1	0	0	0	109.9	E51	P49-E51 PolarHBondContact O-N 3.3Å
50	V	56.5	Low	64.3	Low	20 Å²	20	88.2 Å²	88.2	12%	0.121	45%	0.447	C	S	.	.			trans	-68.2	102.5	174.3	-179.3	0	0	0	0	108.5	D48 D52 F56 Y344	D48-V50 PolarHBondContact O-N 3.28Å; V50-D52 VanDerWaalsContact CG1-C 3.48Å; V50-D52 WeakPolarHBondContact CG1-O 3.48Å; V50-F56 HydrophobicContact CG1-CB 3.79Å; V50-F56 HydrophobicContact CG2-CB 4.19Å; V50-F56 HydrophobicContact CG2-CD2 4.33Å; V50-Y344 HydrophobicContact CB-CE1 4.03Å; V50-Y344 HydrophobicContact CG1-CE1 4.46Å; V50-Y344 HydrophobicContact CG2-CE1 3.81Å
51	E	59.2	Low	67.1	Low	186 Å²	186	83.8 Å²	83.8	87%	0.869	42%	0.424	S	S	*	.	S	Bend	trans	-79.1	-27.8	170.1	-67.6	-164.7	168.4	0	0	111.8	P49	P49-E51 PolarHBondContact O-N 3.3Å
52	D	76	Confident	70	Confident	73 Å²	73	83.8 Å²	83.8	39%	0.39	41%	0.414	S	S	.	.			trans	-129.1	115.2	176.9	-172.2	-4.5	0	0	0	111.7	V50 K54 E55 F56	V50-D52 VanDerWaalsContact CG1-C 3.48Å; V50-D52 WeakPolarHBondContact CG1-O 3.48Å; D52-K54 PolarHBondContact O-N 3.05Å; D52-K54 VanDerWaalsContact O-N 3.15Å; D52-K54 VanDerWaalsContact OD1-CB 3.25Å; D52-K54 WeakPolarHBondContact OD1-CB 3.47Å; D52-K54 PolarHBondContact OD1-N 3.32Å; D52-E55 HydrophobicContact CB-CB 4.43Å; D52-E55 HydrophobicContact CB-CG 4.05Å; D52-E55 PolarHBondContact O-N 3Å; D52-E55 VanDerWaalsContact O-N 3.16Å; D52-F56 PolarHBondContact O-N 3.41Å
53	F	83.9	Confident	72.7	Confident	15 Å²	15	76.7 Å²	76.7	7%	0.066	39%	0.385	C	S	.	.	H	α-helix	trans	-59	-26.5	177	-167.5	-103.8	0	0	0	112.4	F56 L57 F138 L190 E193 I341 Y344	F53-F56 HydrophobicContact CD2-CD1 4.29Å; F53-F56 AromaticContact CE2-CD1 3.98Å; F53-F56 HydrophobicContact CE2-CD1 3.98Å; F53-F56 HydrophobicContact CE2-CE1 4.38Å; F53-F56 HydrophobicContact CZ-CD1 4.32Å; F53-F56 WeakPolarHBondContact O-CB 3.5Å; F53-F56 PolarHBondContact O-N 2.88Å; F53-L57 HydrophobicContact CD1-CD1 3.93Å; F53-L57 HydrophobicContact CD1-CG 4.03Å; F53-L57 HydrophobicContact CE1-CD1 3.8Å; F53-L57 HydrophobicContact CE1-CD2 3.79Å; F53-L57 HydrophobicContact CE1-CG 3.8Å; F53-L57 HydrophobicContact CZ-CD2 4.11Å; F53-L57 HydrophobicContact CZ-CG 4.48Å; F53-L57 WeakPolarHBondContact O-CG 3.48Å; F53-L57 PolarHBondContact O-N 3.02Å; F53-L57 VanDerWaalsContact O-N 3.07Å; F53-F138 HydrophobicContact CE2-CE2 4.01Å; F53-F138 HydrophobicContact CE2-CZ 4.07Å; F53-F138 AromaticContact CZ-CE2 3.92Å; F53-F138 HydrophobicContact CZ-CE2 3.92Å; F53-F138 AromaticContact CZ-CZ 3.87Å; F53-F138 HydrophobicContact CZ-CZ 3.87Å; F53-L190 HydrophobicContact CE1-CD2 4.14Å; F53-L190 HydrophobicContact CE2-CD2 4.11Å; F53-L190 HydrophobicContact CZ-CD2 3.86Å; F53-E193 VanDerWaalsContact CE1-CD 3.43Å; F53-E193 HydrophobicContact CE1-CG 4.04Å; F53-E193 WeakPolarHBondContact CE1-OE2 3.13Å; F53-I341 HydrophobicContact CB-CD1 4.12Å; F53-Y344 HydrophobicContact CD2-CD2 4.32Å; F53-Y344 HydrophobicContact CD2-CG 4.29Å; F53-Y344 AromaticContact CE2-CD2 3.71Å; F53-Y344 HydrophobicContact CE2-CD2 3.71Å; F53-Y344 HydrophobicContact CE2-CE2 4.01Å; F53-Y344 HydrophobicContact CE2-CG 4.1Å
54	K	83.6	Confident	75.8	Confident	137 Å²	137	69.5 Å²	69.5	60%	0.596	35%	0.347	S	S	*	.	H	α-helix	trans	-67.2	-43.4	177.3	-172.4	-176.9	174.4	-169.9	0	112.1	D52 F56 L57 D58	D52-K54 PolarHBondContact O-N 3.05Å; D52-K54 VanDerWaalsContact O-N 3.15Å; D52-K54 VanDerWaalsContact OD1-CB 3.25Å; D52-K54 WeakPolarHBondContact OD1-CB 3.47Å; D52-K54 PolarHBondContact OD1-N 3.32Å; K54-F56 VanDerWaalsContact C-N 3.27Å; K54-F56 PolarHBondContact O-N 2.77Å; K54-L57 PolarHBondContact O-N 3.41Å; K54-L57 VanDerWaalsContact O-N 3.15Å; K54-D58 PolarHBondContact O-N 3.31Å
55	E	86.1	Confident	78	Confident	134 Å²	134	72 Å²	72	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-62	-39.4	176.1	-67.4	-175.8	165.5	0	0	111.1	D52 L57 D58 K59	D52-E55 HydrophobicContact CB-CB 4.43Å; D52-E55 HydrophobicContact CB-CG 4.05Å; D52-E55 PolarHBondContact O-N 3Å; D52-E55 VanDerWaalsContact O-N 3.16Å; E55-L57 PolarHBondContact O-N 2.94Å; E55-D58 PolarHBondContact O-N 2.83Å; E55-K59 PolarHBondContact O-N 3.1Å
56	F	89.1	Confident	80.1	Confident	8 Å²	8	76 Å²	76	4%	0.035	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-47.7	171.9	167.6	-93.1	0	0	0	111.9	I45 L46 V50 D52 F53 K54 D58 K59 A60 F138 Y194 Y344	I45-F56 HydrophobicContact CB-CE2 4.4Å; I45-F56 HydrophobicContact CG2-CD2 3.85Å; I45-F56 HydrophobicContact CG2-CE2 3.63Å; L46-F56 HydrophobicContact CD2-CE2 4.47Å; V50-F56 HydrophobicContact CG1-CB 3.79Å; V50-F56 HydrophobicContact CG2-CB 4.19Å; V50-F56 HydrophobicContact CG2-CD2 4.33Å; D52-F56 PolarHBondContact O-N 3.41Å; F53-F56 HydrophobicContact CD2-CD1 4.29Å; F53-F56 AromaticContact CE2-CD1 3.98Å; F53-F56 HydrophobicContact CE2-CD1 3.98Å; F53-F56 HydrophobicContact CE2-CE1 4.38Å; F53-F56 HydrophobicContact CZ-CD1 4.32Å; F53-F56 WeakPolarHBondContact O-CB 3.5Å; F53-F56 PolarHBondContact O-N 2.88Å; K54-F56 VanDerWaalsContact C-N 3.27Å; K54-F56 PolarHBondContact O-N 2.77Å; F56-D58 VanDerWaalsContact C-N 3.31Å; F56-D58 PolarHBondContact O-N 2.9Å; F56-K59 PolarHBondContact O-N 3.24Å; F56-A60 HydrophobicContact CE1-CB 4.28Å; F56-A60 HydrophobicContact CE2-CB 4.5Å; F56-A60 HydrophobicContact CZ-CB 4.14Å; F56-A60 VanDerWaalsContact O-CB 3.26Å; F56-A60 WeakPolarHBondContact O-CB 3.31Å; F56-A60 PolarHBondContact O-N 3.24Å; F56-F138 HydrophobicContact CD1-CE2 4.4Å; F56-F138 AromaticContact CE1-CD2 3.64Å; F56-F138 HydrophobicContact CE1-CD2 3.64Å; F56-F138 AromaticContact CE1-CE2 3.45Å; F56-F138 HydrophobicContact CE1-CE2 3.45Å; F56-F138 VanDerWaalsContact CE1-CE2 3.45Å; F56-F138 AromaticContact CZ-CD2 3.66Å; F56-F138 HydrophobicContact CZ-CD2 3.66Å; F56-F138 AromaticContact CZ-CE2 3.87Å; F56-F138 HydrophobicContact CZ-CE2 3.87Å; F56-Y194 HydrophobicContact CE1-CD2 4.03Å; F56-Y194 HydrophobicContact CE1-CE2 4.49Å; F56-Y194 HydrophobicContact CZ-CD2 4.44Å; F56-Y344 WeakPolarHBondContact CD2-OH 3.18Å; F56-Y344 HydrophobicContact CE1-CE2 4.31Å; F56-Y344 HydrophobicContact CE2-CE2 4.44Å; F56-Y344 WeakPolarHBondContact CE2-OH 3.45Å; F56-Y344 HydrophobicContact CZ-CE2 4.26Å
57	L	92.1	Very high	82.2	Confident	18 Å²	18	76.7 Å²	76.7	9%	0.094	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-36.9	179.8	-68.5	177.6	0	0	0	112.6	F53 K54 E55 R61 E193 Y194	F53-L57 HydrophobicContact CD1-CD1 3.93Å; F53-L57 HydrophobicContact CD1-CG 4.03Å; F53-L57 HydrophobicContact CE1-CD1 3.8Å; F53-L57 HydrophobicContact CE1-CD2 3.79Å; F53-L57 HydrophobicContact CE1-CG 3.8Å; F53-L57 HydrophobicContact CZ-CD2 4.11Å; F53-L57 HydrophobicContact CZ-CG 4.48Å; F53-L57 WeakPolarHBondContact O-CG 3.48Å; F53-L57 PolarHBondContact O-N 3.02Å; F53-L57 VanDerWaalsContact O-N 3.07Å; K54-L57 PolarHBondContact O-N 3.41Å; K54-L57 VanDerWaalsContact O-N 3.15Å; E55-L57 PolarHBondContact O-N 2.94Å; L57-R61 WeakPolarHBondContact O-CB 3.38Å; L57-R61 PolarHBondContact O-N 3.47Å; L57-E193 HydrophobicContact CD1-CG 3.99Å; L57-Y194 HydrophobicContact CD2-CD2 4.24Å
58	D	91.5	Very high	84.3	Confident	74 Å²	74	72.5 Å²	72.5	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-69.5	-43.2	178.5	-75	-30.4	0	0	0	111.8	K54 E55 F56 R61 E62	K54-D58 PolarHBondContact O-N 3.31Å; E55-D58 PolarHBondContact O-N 2.83Å; F56-D58 VanDerWaalsContact C-N 3.31Å; F56-D58 PolarHBondContact O-N 2.9Å; D58-R61 PolarHBondContact O-N 3.09Å; D58-R61 IonicContact OD1-CZ 2.85Å; D58-R61 IonicContact OD1-NH1 3.84Å; D58-R61 PolarHBondContact OD1-NH1 2.83Å; D58-R61 IonicContact OD1-NH2 2.67Å; D58-E62 PolarHBondContact O-N 2.77Å
59	K	91.9	Very high	86.4	Confident	88 Å²	88	72.9 Å²	72.9	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-46.8	172.1	-177.7	176.4	178.2	-178.5	0	111.2	I45 D48 E55 F56 R61 E62 D63	I45-K59 HydrophobicContact CG2-CD 4.11Å; D48-K59 IonicContact OD2-NZ 3.65Å; E55-K59 PolarHBondContact O-N 3.1Å; F56-K59 PolarHBondContact O-N 3.24Å; K59-R61 VanDerWaalsContact C-N 3.26Å; K59-R61 PolarHBondContact O-N 3.39Å; K59-E62 PolarHBondContact O-N 3.41Å; K59-E62 VanDerWaalsContact O-N 3.12Å; K59-D63 PolarHBondContact O-N 2.92Å
60	A	93.4	Very high	88.3	Confident	2 Å²	2	73.4 Å²	73.4	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-66.7	-27.2	-177.8	0	0	0	0	0	113.1	F56 F64 Y194	F56-A60 HydrophobicContact CE1-CB 4.28Å; F56-A60 HydrophobicContact CE2-CB 4.5Å; F56-A60 HydrophobicContact CZ-CB 4.14Å; F56-A60 VanDerWaalsContact O-CB 3.26Å; F56-A60 WeakPolarHBondContact O-CB 3.31Å; F56-A60 PolarHBondContact O-N 3.24Å; A60-F64 WeakPolarHBondContact O-CB 3.46Å; A60-F64 PolarHBondContact O-N 3.25Å; A60-Y194 HydrophobicContact CB-CD2 4.43Å; A60-Y194 HydrophobicContact CB-CE2 3.8Å
61	R	94.6	Very high	90	Very high	111 Å²	111	74.6 Å²	74.6	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-41.2	172.2	-170.5	-173.7	-62.7	122.1	9.9	112.2	L57 D58 K59 K65 S197 L198	L57-R61 WeakPolarHBondContact O-CB 3.38Å; L57-R61 PolarHBondContact O-N 3.47Å; D58-R61 PolarHBondContact O-N 3.09Å; D58-R61 IonicContact OD1-CZ 2.85Å; D58-R61 IonicContact OD1-NH1 3.84Å; D58-R61 PolarHBondContact OD1-NH1 2.83Å; D58-R61 IonicContact OD1-NH2 2.67Å; K59-R61 VanDerWaalsContact C-N 3.26Å; K59-R61 PolarHBondContact O-N 3.39Å; R61-K65 WeakPolarHBondContact O-CB 3.34Å; R61-K65 PolarHBondContact O-N 2.82Å; R61-S197 PolarHBondContact NE-O 3.5Å; R61-L198 HydrophobicContact CB-CD2 4.04Å; R61-L198 HydrophobicContact CG-CD2 4.14Å
62	E	94.7	Very high	91.6	Very high	94 Å²	94	68.3 Å²	68.3	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-47.4	176.9	-177.6	54.4	-150.1	0	0	110.9	D58 K59 F64 K65 Q66	D58-E62 PolarHBondContact O-N 2.77Å; K59-E62 PolarHBondContact O-N 3.41Å; K59-E62 VanDerWaalsContact O-N 3.12Å; E62-F64 VanDerWaalsContact C-N 3.33Å; E62-F64 PolarHBondContact O-N 3.31Å; E62-K65 WeakPolarHBondContact O-CB 3.36Å; E62-K65 PolarHBondContact O-N 3.46Å; E62-K65 VanDerWaalsContact O-N 3.11Å; E62-Q66 WeakPolarHBondContact O-CG 3.34Å; E62-Q66 PolarHBondContact O-N 2.92Å; E62-Q66 PolarHBondContact OE1-NE2 3.49Å
63	D	95	Very high	92.4	Very high	40 Å²	40	69.1 Å²	69.1	21%	0.214	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-43.2	177.1	-68.6	-24.4	0	0	0	111.6	I45 K59 K65 Q66 R67	I45-D63 HydrophobicContact CD1-CB 4.22Å; I45-D63 WeakPolarHBondContact CD1-OD2 3.49Å; K59-D63 PolarHBondContact O-N 2.92Å; D63-K65 PolarHBondContact O-N 3.28Å; D63-Q66 PolarHBondContact O-N 3.03Å; D63-R67 WeakPolarHBondContact O-CG 2.92Å; D63-R67 PolarHBondContact O-N 3.39Å; D63-R67 VanDerWaalsContact O-N 3.1Å
64	F	96.6	Very high	92.8	Very high	2 Å²	2	72.5 Å²	72.5	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-44.9	174.1	172.6	-96.8	0	0	0	111.6	A60 E62 Q66 R67 W68 A135 I136 L198 L200	A60-F64 WeakPolarHBondContact O-CB 3.46Å; A60-F64 PolarHBondContact O-N 3.25Å; E62-F64 VanDerWaalsContact C-N 3.33Å; E62-F64 PolarHBondContact O-N 3.31Å; F64-Q66 PolarHBondContact O-N 3.36Å; F64-R67 PolarHBondContact O-N 3.4Å; F64-W68 HydrophobicContact CE1-CB 4.24Å; F64-W68 HydrophobicContact CE1-CD2 4.39Å; F64-W68 HydrophobicContact CE1-CE3 4.34Å; F64-W68 HydrophobicContact CE1-CG 4.36Å; F64-W68 HydrophobicContact CE2-CE3 4.03Å; F64-W68 HydrophobicContact CZ-CB 4.36Å; F64-W68 HydrophobicContact CZ-CD2 4.03Å; F64-W68 AromaticContact CZ-CE3 3.55Å; F64-W68 HydrophobicContact CZ-CE3 3.55Å; F64-W68 HydrophobicContact CZ-CG 4.38Å; F64-W68 HydrophobicContact CZ-CZ3 4.2Å; F64-W68 WeakPolarHBondContact O-CB 3.28Å; F64-W68 PolarHBondContact O-N 3.37Å; F64-A135 HydrophobicContact CD2-CB 3.59Å; F64-A135 WeakPolarHBondContact CD2-O 3.24Å; F64-A135 HydrophobicContact CE2-CB 3.55Å; F64-A135 HydrophobicContact CZ-CB 4.48Å; F64-I136 HydrophobicContact CD2-CG2 4.11Å; F64-I136 HydrophobicContact CE2-CG2 4.02Å; F64-L198 HydrophobicContact CB-CD1 4.06Å; F64-L198 HydrophobicContact CB-CD2 3.72Å; F64-L198 HydrophobicContact CB-CG 4.46Å; F64-L198 HydrophobicContact CD1-CB 4.1Å; F64-L198 HydrophobicContact CD1-CD1 4.35Å; F64-L198 HydrophobicContact CD1-CD2 3.92Å; F64-L198 HydrophobicContact CD1-CG 4.34Å; F64-L198 HydrophobicContact CD2-CD1 3.67Å; F64-L198 HydrophobicContact CE1-CB 4.1Å; F64-L198 HydrophobicContact CE2-CD1 4.2Å; F64-L198 HydrophobicContact CG-CB 4.35Å; F64-L198 HydrophobicContact CG-CD1 3.76Å; F64-L198 HydrophobicContact CG-CD2 3.83Å; F64-L198 HydrophobicContact CG-CG 4.18Å; F64-L198 HydrophobicContact CZ-CB 4.38Å; F64-L200 HydrophobicContact CE2-CD1 3.82Å; F64-L200 HydrophobicContact CZ-CD1 4.01Å; F64-L200 HydrophobicContact CZ-CD2 4.3Å; F64-L200 HydrophobicContact CZ-CG 4.29Å
65	K	95.4	Very high	93.5	Very high	91 Å²	91	69 Å²	69	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-46.3	179.9	-175.4	-174.7	172.9	-166.1	0	111	R61 E62 D63 R67 W68 E69	R61-K65 WeakPolarHBondContact O-CB 3.34Å; R61-K65 PolarHBondContact O-N 2.82Å; E62-K65 WeakPolarHBondContact O-CB 3.36Å; E62-K65 PolarHBondContact O-N 3.46Å; E62-K65 VanDerWaalsContact O-N 3.11Å; D63-K65 PolarHBondContact O-N 3.28Å; K65-R67 PolarHBondContact O-N 3.25Å; K65-W68 PolarHBondContact O-N 3.05Å; K65-E69 WeakPolarHBondContact CE-OE1 3.4Å; K65-E69 HydrophobicContact CG-CG 4.5Å; K65-E69 WeakPolarHBondContact CG-OE1 3.48Å; K65-E69 WeakPolarHBondContact O-CB 3.35Å; K65-E69 WeakPolarHBondContact O-CG 3.41Å; K65-E69 PolarHBondContact O-N 3.38Å
66	Q	95.6	Very high	94	Very high	100 Å²	100	63.5 Å²	63.5	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-46.6	178.6	-68.6	-179.9	11.9	0	0	112.1	E62 D63 F64 N70	E62-Q66 WeakPolarHBondContact O-CG 3.34Å; E62-Q66 PolarHBondContact O-N 2.92Å; E62-Q66 PolarHBondContact OE1-NE2 3.49Å; D63-Q66 PolarHBondContact O-N 3.03Å; F64-Q66 PolarHBondContact O-N 3.36Å; Q66-N70 WeakPolarHBondContact O-CB 3.42Å; Q66-N70 PolarHBondContact O-N 3.2Å; Q66-N70 PolarHBondContact O-ND2 3.36Å
67	R	96.1	Very high	94.4	Very high	86 Å²	86	65.7 Å²	65.7	33%	0.325	33%	0.332	S	S	.	.	H	α-helix	trans	-69.7	-31	177.7	-63.7	177.5	-168.5	-177	7.6	112.9	D63 F64 K65 N70 A135 D137	D63-R67 WeakPolarHBondContact O-CG 2.92Å; D63-R67 PolarHBondContact O-N 3.39Å; D63-R67 VanDerWaalsContact O-N 3.1Å; F64-R67 PolarHBondContact O-N 3.4Å; K65-R67 PolarHBondContact O-N 3.25Å; R67-N70 CarbonylContact O-C 3.46Å; R67-A135 HydrophobicContact CB-CB 3.97Å; R67-D137 IonicContact CZ-OD2 3.99Å; R67-D137 IonicContact NH1-OD2 3.54Å; R67-D137 IonicContact NH2-OD2 3.44Å; R67-D137 PolarHBondContact NH2-OD2 3.37Å
68	W	95.3	Very high	94.6	Very high	34 Å²	34	65.8 Å²	65.8	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-71.9	-39.3	178.2	179.3	-88.1	0	0	0	112.8	F64 K65 R131 I132 A135 R228	F64-W68 HydrophobicContact CE1-CB 4.24Å; F64-W68 HydrophobicContact CE1-CD2 4.39Å; F64-W68 HydrophobicContact CE1-CE3 4.34Å; F64-W68 HydrophobicContact CE1-CG 4.36Å; F64-W68 HydrophobicContact CE2-CE3 4.03Å; F64-W68 HydrophobicContact CZ-CB 4.36Å; F64-W68 HydrophobicContact CZ-CD2 4.03Å; F64-W68 AromaticContact CZ-CE3 3.55Å; F64-W68 HydrophobicContact CZ-CE3 3.55Å; F64-W68 HydrophobicContact CZ-CG 4.38Å; F64-W68 HydrophobicContact CZ-CZ3 4.2Å; F64-W68 WeakPolarHBondContact O-CB 3.28Å; F64-W68 PolarHBondContact O-N 3.37Å; K65-W68 PolarHBondContact O-N 3.05Å; W68-R131 HydrophobicContact CD2-CG 4.31Å; W68-R131 HydrophobicContact CE3-CG 3.88Å; W68-R131 HydrophobicContact CH2-CG 4Å; W68-R131 HydrophobicContact CZ2-CG 4.42Å; W68-R131 HydrophobicContact CZ3-CB 4.23Å; W68-R131 HydrophobicContact CZ3-CG 3.7Å; W68-R131 PolarHBondContact O-NE 2.64Å; W68-R131 PolarHBondContact O-NH2 2.81Å; W68-I132 HydrophobicContact CH2-CG1 4.25Å; W68-I132 HydrophobicContact CZ3-CG1 3.7Å; W68-A135 HydrophobicContact CB-CB 4.35Å; W68-A135 HydrophobicContact CE3-CB 4.33Å; W68-R228 HydrophobicContact CH2-CB 4.22Å; W68-R228 HydrophobicContact CZ2-CB 4.4Å
69	E	94.5	Very high	94.9	Very high	110 Å²	110	68 Å²	68	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-78.8	-29.5	178.3	-70.9	173.2	-177.7	0	0	111.8	K65 P71	K65-E69 WeakPolarHBondContact CE-OE1 3.4Å; K65-E69 HydrophobicContact CG-CG 4.5Å; K65-E69 WeakPolarHBondContact CG-OE1 3.48Å; K65-E69 WeakPolarHBondContact O-CB 3.35Å; K65-E69 WeakPolarHBondContact O-CG 3.41Å; K65-E69 PolarHBondContact O-N 3.38Å; E69-P71 VanDerWaalsContact C-CD 3.47Å; E69-P71 VanDerWaalsContact O-CD 3.25Å; E69-P71 WeakPolarHBondContact O-CD 3.44Å
70	N	94.1	Very high	95.1	Very high	119 Å²	119	66.8 Å²	66.8	64%	0.636	34%	0.341	S	S	*	.	S	Bend	trans	-120	72.1	-179.8	-55.8	-79.5	0	0	0	111.2	Q66 R67 A72	Q66-N70 WeakPolarHBondContact O-CB 3.42Å; Q66-N70 PolarHBondContact O-N 3.2Å; Q66-N70 PolarHBondContact O-ND2 3.36Å; R67-N70 CarbonylContact O-C 3.46Å; N70-A72 PolarHBondContact O-N 3.3Å
71	P	92.1	Very high	95.4	Very high	45 Å²	45	66.8 Å²	66.8	29%	0.292	34%	0.341	S	S	.	.			trans	-64.8	124.4	-176.6	29.1	-37.2	0	0	0	111.6	E69	E69-P71 VanDerWaalsContact C-CD 3.47Å; E69-P71 VanDerWaalsContact O-CD 3.25Å; E69-P71 WeakPolarHBondContact O-CD 3.44Å
72	A	93	Very high	95.5	Very high	54 Å²	54	65.3 Å²	65.3	45%	0.446	34%	0.341	S	S	.	.			trans	-66.6	136.5	173.2	0	0	0	0	0	110.5	N70 T75 K130 Q134	N70-A72 PolarHBondContact O-N 3.3Å; A72-T75 HydrophobicContact CB-CG2 3.91Å; A72-K130 PolarHBondContact O-NZ 3.01Å; A72-Q134 PolarHBondContact O-OE1 2.94Å
73	Q	91.2	Very high	95.6	Very high	90 Å²	90	66.4 Å²	66.4	42%	0.421	34%	0.342	S	S	.	.			trans	-127.9	146.2	-179.6	-70.8	179.6	-10.7	0	0	110.6	T75 E387	Q73-T75 PolarHBondContact O-N 3.13Å; Q73-E387 PolarHBondContact NE2-O 3.42Å
74	N	94.1	Very high	95.6	Very high	86 Å²	86	68.5 Å²	68.5	46%	0.46	35%	0.352	S	S	.	.			trans	47.1	54.7	174.6	-60.1	-47.5	0	0	0	113.9	A76 S147	N74-A76 VanDerWaalsContact C-N 3.29Å; N74-A76 PolarHBondContact O-N 3.41Å; N74-S147 WeakPolarHBondContact CA-O 3.46Å; N74-S147 PolarHBondContact N-O 3.1Å
75	T	96.7	Very high	95.6	Very high	63 Å²	63	70.1 Å²	70.1	39%	0.387	36%	0.359	S	S	.	.			trans	-83.5	-1.4	-174.5	53.7	0	0	0	0	114.4	A72 Q73 F146 S147	A72-T75 HydrophobicContact CB-CG2 3.91Å; Q73-T75 PolarHBondContact O-N 3.13Å; T75-F146 VanDerWaalsContact OG1-CA 3.31Å; T75-F146 WeakPolarHBondContact OG1-CA 3.45Å; T75-S147 PolarHBondContact N-O 2.76Å; T75-S147 PolarHBondContact OG1-N 3.07Å
76	A	97.5	Very high	95.6	Very high	18 Å²	18	65.8 Å²	65.8	15%	0.149	34%	0.34	C	S	.	.			trans	-160.3	-178.3	173.8	0	0	0	0	0	109.6	N74 F81 F146 F148	N74-A76 VanDerWaalsContact C-N 3.29Å; N74-A76 PolarHBondContact O-N 3.41Å; A76-F81 HydrophobicContact CB-CE2 3.82Å; A76-F81 HydrophobicContact CB-CZ 4.08Å; A76-F146 HydrophobicContact CB-CB 3.91Å; A76-F146 HydrophobicContact CB-CD1 3.95Å; A76-F146 HydrophobicContact CB-CG 4.03Å; A76-F148 HydrophobicContact CB-CD1 3.89Å; A76-F148 HydrophobicContact CB-CE1 4.05Å; A76-F148 WeakPolarHBondContact O-CB 3.12Å; A76-F148 VanDerWaalsContact O-CG 3.26Å; A76-F148 WeakPolarHBondContact O-CG 3.22Å
77	C	97	Very high	95.4	Very high	55 Å²	55	61.6 Å²	61.6	37%	0.372	32%	0.321	S	S	.	.			trans	-132.7	167.9	168.3	73.4	0	0	0	0	111.5	D79 D80 F81	C77-D79 PolarHBondContact O-N 3.38Å; C77-D80 PolarHBondContact N-OD2 2.81Å; C77-D80 WeakPolarHBondContact O-CB 3.42Å; C77-D80 PolarHBondContact O-N 3.08Å; C77-D80 PolarHBondContact SG-OD2 3.35Å; C77-F81 VanDerWaalsContact O-CD2 3.29Å; C77-F81 WeakPolarHBondContact O-CD2 3.42Å; C77-F81 WeakPolarHBondContact O-CE2 3.15Å
78	L	96.6	Very high	95.2	Very high	20 Å²	20	57.8 Å²	57.8	11%	0.105	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.3	-176.5	-174.9	64.4	0	0	0	112.6	D80 F81 M109 F148 Y155 L373 I375	L78-D80 PolarHBondContact O-N 3.36Å; L78-F81 PolarHBondContact O-N 3.01Å; L78-M109 HydrophobicContact CD1-CE 4.29Å; L78-M109 HydrophobicContact CD1-SD 3.91Å; L78-F148 HydrophobicContact CB-CE2 4Å; L78-F148 VanDerWaalsContact N-CE2 3.3Å; L78-Y155 HydrophobicContact CD1-CD1 4.29Å; L78-Y155 HydrophobicContact CD1-CE1 3.74Å; L78-L373 HydrophobicContact CD1-CD2 4.28Å; L78-L373 HydrophobicContact CD2-CD2 3.84Å; L78-I375 HydrophobicContact CD2-CD1 3.74Å
79	D	96.9	Very high	94.9	Very high	121 Å²	121	59 Å²	59	65%	0.647	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-72.7	-11.6	-177.3	-72.1	-21	0	0	0	113.3	C77 F81 K101	C77-D79 PolarHBondContact O-N 3.38Å; D79-F81 PolarHBondContact O-N 2.9Å; D79-K101 WeakPolarHBondContact O-CD 3.19Å; D79-K101 WeakPolarHBondContact O-CE 3.39Å; D79-K101 PolarHBondContact O-NZ 3.33Å
80	D	97.8	Very high	94.4	Very high	61 Å²	61	55.5 Å²	55.5	33%	0.326	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-73.7	-7.8	174.2	-61	-38.4	0	0	0	112.6	C77 L78 H100 K101	C77-D80 PolarHBondContact N-OD2 2.81Å; C77-D80 WeakPolarHBondContact O-CB 3.42Å; C77-D80 PolarHBondContact O-N 3.08Å; C77-D80 PolarHBondContact SG-OD2 3.35Å; L78-D80 PolarHBondContact O-N 3.36Å; D80-H100 PolarHBondContact O-CD2 3.45Å; D80-K101 WeakPolarHBondContact O-CB 3.33Å; D80-K101 WeakPolarHBondContact O-CG 3.43Å; D80-K101 PolarHBondContact O-N 2.9Å
81	F	98.3	Very high	93.8	Very high	3 Å²	3	52.4 Å²	52.4	1%	0.013	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.5	-171.7	-57.2	-88.3	0	0	0	113.1	A76 C77 L78 D79 V98 K99 H100 Y107 M109 F146 F148 V157	A76-F81 HydrophobicContact CB-CE2 3.82Å; A76-F81 HydrophobicContact CB-CZ 4.08Å; C77-F81 VanDerWaalsContact O-CD2 3.29Å; C77-F81 WeakPolarHBondContact O-CD2 3.42Å; C77-F81 WeakPolarHBondContact O-CE2 3.15Å; L78-F81 PolarHBondContact O-N 3.01Å; D79-F81 PolarHBondContact O-N 2.9Å; F81-V98 HydrophobicContact CB-CB 4.14Å; F81-V98 HydrophobicContact CB-CG2 4.37Å; F81-V98 HydrophobicContact CD1-CB 4.39Å; F81-V98 HydrophobicContact CD1-CG2 3.75Å; F81-V98 HydrophobicContact CE1-CG2 4.47Å; F81-V98 HydrophobicContact CG-CG2 4.3Å; F81-K99 WeakPolarHBondContact CA-O 3.29Å; F81-H100 HydrophobicContact CD1-CB 3.94Å; F81-H100 HydrophobicContact CE1-CB 3.78Å; F81-H100 AromaticContact CE1-CD2 3.71Å; F81-H100 AromaticContact CZ-CD2 3.97Å; F81-Y107 HydrophobicContact CE1-CD2 4.32Å; F81-M109 HydrophobicContact CB-CE 3.91Å; F81-M109 HydrophobicContact CD1-CE 4.2Å; F81-M109 HydrophobicContact CD2-CE 3.52Å; F81-M109 HydrophobicContact CE2-CE 4.07Å; F81-M109 HydrophobicContact CG-CE 3.6Å; F81-F146 HydrophobicContact CE1-CD2 4.16Å; F81-F146 HydrophobicContact CE1-CE2 4.27Å; F81-F146 AromaticContact CZ-CD2 3.74Å; F81-F146 HydrophobicContact CZ-CD2 3.74Å; F81-F146 HydrophobicContact CZ-CE2 4.13Å; F81-F146 HydrophobicContact CZ-CG 4.23Å; F81-F148 HydrophobicContact CD2-CE1 4.45Å; F81-F148 HydrophobicContact CD2-CZ 4.35Å; F81-F148 AromaticContact CE2-CE1 3.81Å; F81-F148 HydrophobicContact CE2-CE1 3.81Å; F81-F148 HydrophobicContact CE2-CZ 4.14Å; F81-V157 HydrophobicContact CE1-CG1 3.95Å; F81-V157 HydrophobicContact CE2-CG2 4.37Å; F81-V157 HydrophobicContact CZ-CG1 4.19Å; F81-V157 HydrophobicContact CZ-CG2 4.08Å
82	D	97.7	Very high	93.4	Very high	79 Å²	79	52 Å²	52	42%	0.422	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121	163.5	-64.7	-44.1	0	0	0	109.1	V98 K99 K101	D82-V98 CarbonylContact O-C 3.55Å; D82-V98 WeakPolarHBondContact O-CA 3.46Å; D82-K99 HydrophobicContact CB-CB 4.47Å; D82-K99 PolarHBondContact N-O 2.79Å; D82-K99 PolarHBondContact O-N 2.86Å; D82-K101 WeakPolarHBondContact OD1-CE 3.26Å; D82-K101 IonicContact OD1-NZ 3.72Å
83	R	96.3	Very high	93.2	Very high	118 Å²	118	50.5 Å²	50.5	45%	0.445	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	130.5	176.6	-61.8	-179.8	-62.4	-81.1	-1.1	110	M96 V98	R83-M96 HydrophobicContact CB-CE 4.07Å; R83-V98 HydrophobicContact CG-CG1 4.13Å
84	I	95.8	Very high	93.4	Very high	84 Å²	84	47.8 Å²	47.8	43%	0.431	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-63.3	-170	-61.3	165.3	0	0	0	112	L97 K99 Y106	I84-L97 HydrophobicContact CB-CB 4.42Å; I84-L97 HydrophobicContact CB-CD2 4.31Å; I84-L97 HydrophobicContact CB-CG 4.24Å; I84-L97 WeakPolarHBondContact CB-O 3.26Å; I84-L97 HydrophobicContact CD1-CD2 4.3Å; I84-L97 HydrophobicContact CD1-CG 4.12Å; I84-L97 HydrophobicContact CG2-CD2 4.11Å; I84-L97 PolarHBondContact N-O 2.87Å; I84-K99 HydrophobicContact CD1-CB 3.93Å; I84-Y106 HydrophobicContact CD1-CD1 3.74Å; I84-Y106 HydrophobicContact CD1-CE1 3.48Å; I84-Y106 VanDerWaalsContact CD1-CE1 3.48Å
85	K	94.8	Very high	93.4	Very high	36 Å²	36	45.7 Å²	45.7	16%	0.157	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	145.4	-173.8	176.4	-178.4	168.2	-174.6	0	110.1	M96 L97 A362 D366 D367 E370	K85-M96 CarbonylContact O-C 3.55Å; K85-M96 WeakPolarHBondContact O-CA 3.26Å; K85-L97 PolarHBondContact O-N 3.23Å; K85-A362 HydrophobicContact CD-CB 4.49Å; K85-D366 WeakPolarHBondContact CE-O 3.1Å; K85-D366 PolarHBondContact NZ-O 3.29Å; K85-D367 VanDerWaalsContact CE-OD1 3.3Å; K85-D367 WeakPolarHBondContact CE-OD1 3.03Å; K85-D367 IonicContact NZ-OD1 3.65Å; K85-D367 PolarHBondContact NZ-OD1 3.33Å; K85-E370 WeakPolarHBondContact CA-OE1 3.37Å
86	T	95.4	Very high	93.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	121.7	167.8	-64.2	0	0	0	0	110.4	T89 R94 V95 Y368 E370	T86-T89 HydrophobicContact CG2-CG2 3.97Å; T86-R94 HydrophobicContact CG2-CB 4.25Å; T86-V95 CarbonylContact C-O 3.57Å; T86-Y368 HydrophobicContact CG2-CD2 4.44Å; T86-Y368 HydrophobicContact CG2-CG 4.14Å; T86-E370 PolarHBondContact N-OE1 3.1Å; T86-E370 PolarHBondContact N-OE2 3.41Å; T86-E370 PolarHBondContact OG1-OE2 3.48Å
87	L	92.8	Very high	93.4	Very high	11 Å²	11	42.5 Å²	42.5	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-25.4	178.4	-64.5	174	0	0	0	112.4	V95 L97 A108 F160 A362 F365 Y368	L87-V95 HydrophobicContact CB-CG1 4.4Å; L87-V95 HydrophobicContact CD1-CG1 4.32Å; L87-V95 PolarHBondContact N-O 2.84Å; L87-L97 HydrophobicContact CD1-CB 4.02Å; L87-L97 HydrophobicContact CD2-CB 4.03Å; L87-L97 HydrophobicContact CG-CB 3.96Å; L87-A108 HydrophobicContact CD1-CB 4.06Å; L87-F160 HydrophobicContact CD1-CD2 3.76Å; L87-F160 HydrophobicContact CD1-CE2 3.67Å; L87-F160 HydrophobicContact CD2-CE2 3.94Å; L87-F160 HydrophobicContact CG-CE2 4.48Å; L87-A362 HydrophobicContact CD2-CB 3.66Å; L87-F365 HydrophobicContact CB-CD1 4.29Å; L87-F365 HydrophobicContact CD2-CB 4.23Å; L87-F365 HydrophobicContact CD2-CD1 4.35Å; L87-F365 HydrophobicContact CD2-CD2 3.93Å; L87-F365 HydrophobicContact CD2-CE2 4.39Å; L87-F365 HydrophobicContact CD2-CG 3.91Å; L87-Y368 WeakPolarHBondContact O-CE2 3.34Å
88	G	90.5	Very high	93.5	Very high	7 Å²	7	39.9 Å²	39.9	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	159.6	-179	0	0	0	0	0	112.3	R94 V95	G88-R94 WeakPolarHBondContact O-CA 3.18Å; G88-R94 WeakPolarHBondContact O-CB 3.4Å; G88-V95 PolarHBondContact N-O 3.24Å; G88-V95 PolarHBondContact O-N 3.12Å
89	T	89.9	Confident	93.6	Very high	58 Å²	58	42.5 Å²	42.5	36%	0.356	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.4	-178.8	56	0	0	0	0	111.1	I7 T86 R94 Y368	I7-T89 WeakPolarHBondContact CB-O 3.45Å; I7-T89 WeakPolarHBondContact CD1-O 3.33Å; T86-T89 HydrophobicContact CG2-CG2 3.97Å; T89-R94 HydrophobicContact CG2-CB 4.27Å; T89-Y368 HydrophobicContact CG2-CD1 3.81Å; T89-Y368 HydrophobicContact CG2-CE1 4.39Å; T89-Y368 HydrophobicContact CG2-CG 4.36Å
90	G	83.1	Confident	93.6	Very high	38 Å²	38	37.5 Å²	37.5	39%	0.392	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	179.6	176.1	0	0	0	0	0	112.6	F92 G93	G90-F92 PolarHBondContact O-N 3.01Å; G90-G93 PolarHBondContact N-O 2.64Å; G90-G93 PolarHBondContact O-N 2.85Å; G90-G93 VanDerWaalsContact O-O 3.07Å
91	S	82.2	Confident	93.6	Very high	54 Å²	54	39.9 Å²	39.9	38%	0.378	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.3	178.1	50.2	0	0	0	0	114.1
92	F	85.2	Confident	93.6	Very high	37 Å²	37	48.1 Å²	48.1	16%	0.162	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-10.4	-174.2	-45.3	-61.9	0	0	0	113.9	G90 L112 D113 V117 L120 Q122	G90-F92 PolarHBondContact O-N 3.01Å; F92-L112 HydrophobicContact CB-CD2 3.83Å; F92-D113 PolarHBondContact O-N 3.05Å; F92-V117 HydrophobicContact CB-CG2 4.03Å; F92-V117 HydrophobicContact CD1-CG2 4.42Å; F92-V117 HydrophobicContact CG-CG2 4.27Å; F92-L120 HydrophobicContact CD1-CB 4.41Å; F92-L120 HydrophobicContact CD1-CD1 3.65Å; F92-L120 HydrophobicContact CE1-CB 3.78Å; F92-L120 HydrophobicContact CE1-CD1 3.41Å; F92-L120 VanDerWaalsContact CE1-CD1 3.41Å; F92-L120 HydrophobicContact CE1-CG 4.21Å; F92-Q122 HydrophobicContact CE1-CB 4.13Å; F92-Q122 HydrophobicContact CE1-CG 3.66Å; F92-Q122 HydrophobicContact CE2-CG 4.43Å; F92-Q122 HydrophobicContact CZ-CB 4.11Å; F92-Q122 HydrophobicContact CZ-CG 3.52Å
93	G	88.2	Confident	93.5	Very high	21 Å²	21	47 Å²	47	22%	0.216	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.9	-143.8	-170.7	0	0	0	0	0	113.3	G90 I111	G90-G93 PolarHBondContact N-O 2.64Å; G90-G93 PolarHBondContact O-N 2.85Å; G90-G93 VanDerWaalsContact O-O 3.07Å; G93-I111 CarbonylContact C-O 3.5Å; G93-I111 VanDerWaalsContact CA-O 3.28Å; G93-I111 WeakPolarHBondContact CA-O 3.38Å
94	R	94	Very high	93.5	Very high	34 Å²	34	42.7 Å²	42.7	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	163	-174.8	69.9	-177.9	62.9	154.7	9.7	112.7	T86 G88 T89 M96 I111 E371	T86-R94 HydrophobicContact CG2-CB 4.25Å; G88-R94 WeakPolarHBondContact O-CA 3.18Å; G88-R94 WeakPolarHBondContact O-CB 3.4Å; T89-R94 HydrophobicContact CG2-CB 4.27Å; R94-M96 HydrophobicContact CG-CG 3.95Å; R94-I111 HydrophobicContact CG-CB 4.49Å; R94-I111 HydrophobicContact CG-CD1 4.4Å; R94-I111 PolarHBondContact N-O 3.34Å; R94-I111 PolarHBondContact O-N 3.29Å; R94-E371 IonicContact CZ-OE2 3.77Å; R94-E371 PolarHBondContact NH1-O 2.71Å; R94-E371 VanDerWaalsContact NH2-CB 3.34Å; R94-E371 IonicContact NH2-OE2 2.63Å; R94-E371 PolarHBondContact NH2-OE2 3.45Å
95	V	95.5	Very high	93.6	Very high	41 Å²	41	42.7 Å²	42.7	25%	0.248	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.6	170.5	-175.7	0	0	0	0	107.9	T86 L87 G88 A108 M109 K110	T86-V95 CarbonylContact C-O 3.57Å; L87-V95 HydrophobicContact CB-CG1 4.4Å; L87-V95 HydrophobicContact CD1-CG1 4.32Å; L87-V95 PolarHBondContact N-O 2.84Å; G88-V95 PolarHBondContact N-O 3.24Å; G88-V95 PolarHBondContact O-N 3.12Å; V95-A108 HydrophobicContact CG1-CB 3.88Å; V95-M109 CarbonylContact C-O 3.52Å; V95-M109 WeakPolarHBondContact CA-O 3.44Å; V95-K110 HydrophobicContact CG2-CB 4.17Å; V95-K110 HydrophobicContact CG2-CG 4.19Å
96	M	96.7	Very high	93.7	Very high	13 Å²	13	44.2 Å²	44.2	6%	0.064	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.6	178.2	-60.2	-170.9	77.5	0	0	111	R83 K85 R94 V98 A108 M109 I111	R83-M96 HydrophobicContact CB-CE 4.07Å; K85-M96 CarbonylContact O-C 3.55Å; K85-M96 WeakPolarHBondContact O-CA 3.26Å; R94-M96 HydrophobicContact CG-CG 3.95Å; M96-V98 HydrophobicContact CB-CG1 4.27Å; M96-V98 PolarHBondContact O-N 3.44Å; M96-A108 CarbonylContact O-C 3.51Å; M96-A108 WeakPolarHBondContact O-CA 3.22Å; M96-M109 PolarHBondContact N-O 3.23Å; M96-M109 PolarHBondContact O-N 2.87Å; M96-I111 HydrophobicContact CG-CD1 3.92Å; M96-I111 HydrophobicContact SD-CD1 3.61Å
97	L	97.4	Very high	93.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	125.9	160.6	179.7	63.4	0	0	0	108.4	I84 K85 L87 Y106 Y107 F160 G360 A362	I84-L97 HydrophobicContact CB-CB 4.42Å; I84-L97 HydrophobicContact CB-CD2 4.31Å; I84-L97 HydrophobicContact CB-CG 4.24Å; I84-L97 WeakPolarHBondContact CB-O 3.26Å; I84-L97 HydrophobicContact CD1-CD2 4.3Å; I84-L97 HydrophobicContact CD1-CG 4.12Å; I84-L97 HydrophobicContact CG2-CD2 4.11Å; I84-L97 PolarHBondContact N-O 2.87Å; K85-L97 PolarHBondContact O-N 3.23Å; L87-L97 HydrophobicContact CD1-CB 4.02Å; L87-L97 HydrophobicContact CD2-CB 4.03Å; L87-L97 HydrophobicContact CG-CB 3.96Å; L97-Y106 HydrophobicContact CD1-CD1 4.05Å; L97-Y106 HydrophobicContact CG-CD1 4.36Å; L97-Y107 WeakPolarHBondContact CA-O 3.24Å; L97-F160 HydrophobicContact CD1-CB 4.34Å; L97-F160 HydrophobicContact CD1-CD1 3.75Å; L97-F160 HydrophobicContact CD1-CD2 3.86Å; L97-F160 HydrophobicContact CD1-CE1 3.95Å; L97-F160 HydrophobicContact CD1-CE2 4.07Å; L97-F160 HydrophobicContact CD1-CG 3.7Å; L97-F160 HydrophobicContact CD1-CZ 4.11Å; L97-G360 WeakPolarHBondContact CD2-O 2.9Å; L97-A362 HydrophobicContact CD2-CB 4.15Å
98	V	98.2	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.3	177.1	-55.9	0	0	0	0	110.5	F81 D82 R83 M96 Y106 Y107 M109	F81-V98 HydrophobicContact CB-CB 4.14Å; F81-V98 HydrophobicContact CB-CG2 4.37Å; F81-V98 HydrophobicContact CD1-CB 4.39Å; F81-V98 HydrophobicContact CD1-CG2 3.75Å; F81-V98 HydrophobicContact CE1-CG2 4.47Å; F81-V98 HydrophobicContact CG-CG2 4.3Å; D82-V98 CarbonylContact O-C 3.55Å; D82-V98 WeakPolarHBondContact O-CA 3.46Å; R83-V98 HydrophobicContact CG-CG1 4.13Å; M96-V98 HydrophobicContact CB-CG1 4.27Å; M96-V98 PolarHBondContact O-N 3.44Å; V98-Y106 CarbonylContact O-C 3.6Å; V98-Y106 VanDerWaalsContact O-CA 3.29Å; V98-Y106 WeakPolarHBondContact O-CA 3.49Å; V98-Y107 PolarHBondContact N-O 3.21Å; V98-Y107 PolarHBondContact O-N 2.99Å; V98-M109 HydrophobicContact CG1-CB 3.68Å; V98-M109 HydrophobicContact CG1-CE 4.12Å; V98-M109 HydrophobicContact CG1-SD 4.14Å; V98-M109 HydrophobicContact CG2-CB 3.98Å; V98-M109 HydrophobicContact CG2-CE 4.2Å
99	K	98.4	Very high	94.5	Very high	74 Å²	74	44.9 Å²	44.9	32%	0.322	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.5	170.6	-175.6	-178.7	-179.4	-175.2	0	109.3	F81 D82 I84 K101 G104 N105 Y106	F81-K99 WeakPolarHBondContact CA-O 3.29Å; D82-K99 HydrophobicContact CB-CB 4.47Å; D82-K99 PolarHBondContact N-O 2.79Å; D82-K99 PolarHBondContact O-N 2.86Å; I84-K99 HydrophobicContact CD1-CB 3.93Å; K99-K101 PolarHBondContact O-N 2.86Å; K99-G104 WeakPolarHBondContact CE-O 3.2Å; K99-N105 CarbonylContact C-O 3.59Å; K99-N105 WeakPolarHBondContact CA-O 3.32Å; K99-Y106 HydrophobicContact CB-CD1 4.17Å; K99-Y106 HydrophobicContact CB-CE1 4.11Å; K99-Y106 HydrophobicContact CD-CE1 4.23Å; K99-Y106 HydrophobicContact CG-CE1 4.31Å
100	H	98.3	Very high	94.8	Very high	16 Å²	16	43.5 Å²	43.5	7%	0.074	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	117.8	174.7	-179.7	-130.8	0	0	0	109.4	D80 F81 Q102 S103 G104 N105 Y107	D80-H100 PolarHBondContact O-CD2 3.45Å; F81-H100 HydrophobicContact CD1-CB 3.94Å; F81-H100 HydrophobicContact CE1-CB 3.78Å; F81-H100 AromaticContact CE1-CD2 3.71Å; F81-H100 AromaticContact CZ-CD2 3.97Å; H100-Q102 VanDerWaalsContact C-N 3.34Å; H100-Q102 PolarHBondContact O-N 3.03Å; H100-S103 WeakPolarHBondContact ND1-CB 3.42Å; H100-S103 PolarHBondContact ND1-OG 3.31Å; H100-S103 PolarHBondContact O-N 2.54Å; H100-G104 WeakPolarHBondContact O-CA 3.44Å; H100-G104 PolarHBondContact O-N 3.05Å; H100-N105 PolarHBondContact N-O 3.34Å; H100-Y107 HydrophobicContact CB-CD2 3.95Å; H100-Y107 HydrophobicContact CB-CE2 3.6Å
101	K	98	Very high	95.5	Very high	111 Å²	111	41.9 Å²	41.9	48%	0.483	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-43.3	-169.4	-71.6	174.1	178.8	170.6	0	112.7	D79 D80 D82 K99	D79-K101 WeakPolarHBondContact O-CD 3.19Å; D79-K101 WeakPolarHBondContact O-CE 3.39Å; D79-K101 PolarHBondContact O-NZ 3.33Å; D80-K101 WeakPolarHBondContact O-CB 3.33Å; D80-K101 WeakPolarHBondContact O-CG 3.43Å; D80-K101 PolarHBondContact O-N 2.9Å; D82-K101 WeakPolarHBondContact OD1-CE 3.26Å; D82-K101 IonicContact OD1-NZ 3.72Å; K99-K101 PolarHBondContact O-N 2.86Å
102	Q	96.8	Very high	96.1	Very high	177 Å²	177	39.5 Å²	39.5	83%	0.827	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-46.3	-176.1	-170.8	-176.5	22.3	0	0	112.5	H100	H100-Q102 VanDerWaalsContact C-N 3.34Å; H100-Q102 PolarHBondContact O-N 3.03Å
103	S	96.5	Very high	96.7	Very high	55 Å²	55	39.8 Å²	39.8	39%	0.385	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-19.6	-174.8	68.4	0	0	0	0	114.4	H100 N105	H100-S103 WeakPolarHBondContact ND1-CB 3.42Å; H100-S103 PolarHBondContact ND1-OG 3.31Å; H100-S103 PolarHBondContact O-N 2.54Å; S103-N105 PolarHBondContact O-N 2.95Å; S103-N105 WeakPolarHBondContact OG-CB 3.33Å; S103-N105 PolarHBondContact OG-N 3.42Å; S103-N105 PolarHBondContact OG-ND2 2.99Å
104	G	96.7	Very high	97.1	Very high	28 Å²	28	38.9 Å²	38.9	29%	0.289	20%	0.196	S	C	.	.			trans	73.6	-2.7	-171.1	0	0	0	0	0	115.5	K99 H100	K99-G104 WeakPolarHBondContact CE-O 3.2Å; H100-G104 WeakPolarHBondContact O-CA 3.44Å; H100-G104 PolarHBondContact O-N 3.05Å
105	N	97.2	Very high	97.3	Very high	83 Å²	83	42.5 Å²	42.5	44%	0.444	22%	0.215	S	C	.	.			trans	-73.1	150	179.9	-66.4	-30.5	0	0	0	112.5	K99 H100 S103 Y107	K99-N105 CarbonylContact C-O 3.59Å; K99-N105 WeakPolarHBondContact CA-O 3.32Å; H100-N105 PolarHBondContact N-O 3.34Å; S103-N105 PolarHBondContact O-N 2.95Å; S103-N105 WeakPolarHBondContact OG-CB 3.33Å; S103-N105 PolarHBondContact OG-N 3.42Å; S103-N105 PolarHBondContact OG-ND2 2.99Å; N105-Y107 HydrophobicContact CB-CD2 4.48Å; N105-Y107 HydrophobicContact CB-CE2 3.64Å
106	Y	97.8	Very high	97.3	Very high	69 Å²	69	45.3 Å²	45.3	27%	0.271	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	143.4	176.9	-65.7	-94.9	0	0	0	111.2	I84 L97 V98 K99 P359	I84-Y106 HydrophobicContact CD1-CD1 3.74Å; I84-Y106 HydrophobicContact CD1-CE1 3.48Å; I84-Y106 VanDerWaalsContact CD1-CE1 3.48Å; L97-Y106 HydrophobicContact CD1-CD1 4.05Å; L97-Y106 HydrophobicContact CG-CD1 4.36Å; V98-Y106 CarbonylContact O-C 3.6Å; V98-Y106 VanDerWaalsContact O-CA 3.29Å; V98-Y106 WeakPolarHBondContact O-CA 3.49Å; K99-Y106 HydrophobicContact CB-CD1 4.17Å; K99-Y106 HydrophobicContact CB-CE1 4.11Å; K99-Y106 HydrophobicContact CD-CE1 4.23Å; K99-Y106 HydrophobicContact CG-CE1 4.31Å; Y106-P359 HydrophobicContact CD2-CB 3.93Å; Y106-P359 HydrophobicContact CD2-CG 4.17Å; Y106-P359 HydrophobicContact CE2-CB 4.23Å; Y106-P359 HydrophobicContact CE2-CG 3.95Å
107	Y	98.2	Very high	97.2	Very high	20 Å²	20	44.7 Å²	44.7	8%	0.078	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	159.6	-178.3	-63.7	-85.3	0	0	0	111.1	F81 L97 V98 H100 N105 T145 F146 V157 L158	F81-Y107 HydrophobicContact CE1-CD2 4.32Å; L97-Y107 WeakPolarHBondContact CA-O 3.24Å; V98-Y107 PolarHBondContact N-O 3.21Å; V98-Y107 PolarHBondContact O-N 2.99Å; H100-Y107 HydrophobicContact CB-CD2 3.95Å; H100-Y107 HydrophobicContact CB-CE2 3.6Å; N105-Y107 HydrophobicContact CB-CD2 4.48Å; N105-Y107 HydrophobicContact CB-CE2 3.64Å; Y107-T145 HydrophobicContact CE1-CG2 4Å; Y107-T145 WeakPolarHBondContact CE1-OG1 3.27Å; Y107-F146 HydrophobicContact CE1-CE2 4.28Å; Y107-F146 HydrophobicContact CE2-CE2 4.15Å; Y107-F146 AromaticContact CZ-CE2 3.89Å; Y107-V157 VanDerWaalsContact CB-CG1 3.42Å; Y107-V157 HydrophobicContact CD1-CG1 3.96Å; Y107-V157 HydrophobicContact CD2-CG1 4.34Å; Y107-V157 HydrophobicContact CG-CG1 3.66Å; Y107-L158 CarbonylContact C-O 3.6Å; Y107-L158 WeakPolarHBondContact CA-O 3.43Å; Y107-L158 WeakPolarHBondContact CB-O 3.24Å; Y107-L158 WeakPolarHBondContact CD1-O 3.27Å
108	A	97.7	Very high	97.1	Very high	11 Å²	11	46.9 Å²	46.9	9%	0.091	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	106.6	168.3	0	0	0	0	0	109	L87 V95 M96 L158	L87-A108 HydrophobicContact CD1-CB 4.06Å; V95-A108 HydrophobicContact CG1-CB 3.88Å; M96-A108 CarbonylContact O-C 3.51Å; M96-A108 WeakPolarHBondContact O-CA 3.22Å; A108-L158 HydrophobicContact CB-CB 4.47Å; A108-L158 PolarHBondContact N-O 3.04Å; A108-L158 WeakPolarHBondContact O-CB 3.27Å; A108-L158 PolarHBondContact O-N 3.33Å
109	M	98	Very high	97	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	107.8	178.7	-178	-177.5	-73.7	0	0	110.1	L78 F81 V95 M96 V98 I111 F148 Y155 V157	L78-M109 HydrophobicContact CD1-CE 4.29Å; L78-M109 HydrophobicContact CD1-SD 3.91Å; F81-M109 HydrophobicContact CB-CE 3.91Å; F81-M109 HydrophobicContact CD1-CE 4.2Å; F81-M109 HydrophobicContact CD2-CE 3.52Å; F81-M109 HydrophobicContact CE2-CE 4.07Å; F81-M109 HydrophobicContact CG-CE 3.6Å; V95-M109 CarbonylContact C-O 3.52Å; V95-M109 WeakPolarHBondContact CA-O 3.44Å; M96-M109 PolarHBondContact N-O 3.23Å; M96-M109 PolarHBondContact O-N 2.87Å; V98-M109 HydrophobicContact CG1-CB 3.68Å; V98-M109 HydrophobicContact CG1-CE 4.12Å; V98-M109 HydrophobicContact CG1-SD 4.14Å; V98-M109 HydrophobicContact CG2-CB 3.98Å; V98-M109 HydrophobicContact CG2-CE 4.2Å; M109-I111 HydrophobicContact CG-CD1 4.5Å; M109-I111 HydrophobicContact CG-CG1 3.89Å; M109-I111 HydrophobicContact SD-CD1 4.27Å; M109-I111 HydrophobicContact SD-CG1 4.15Å; M109-F148 HydrophobicContact CE-CE1 4.39Å; M109-F148 HydrophobicContact CE-CZ 3.86Å; M109-Y155 HydrophobicContact CG-CD1 4.17Å; M109-Y155 HydrophobicContact SD-CD1 3.74Å; M109-Y155 HydrophobicContact SD-CE1 4.28Å; M109-V157 HydrophobicContact CE-CG2 3.89Å; M109-V157 HydrophobicContact CG-CG2 4.22Å
110	K	96.7	Very high	96.7	Very high	29 Å²	29	55.9 Å²	55.9	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.1	170	-175.5	168.4	175.1	-179.5	0	108.7	V95 L112 E129 Y155 M156 D222	V95-K110 HydrophobicContact CG2-CB 4.17Å; V95-K110 HydrophobicContact CG2-CG 4.19Å; K110-L112 HydrophobicContact CG-CD2 4.16Å; K110-L112 HydrophobicContact CG-CG 4.35Å; K110-E129 IonicContact NZ-OE1 3.85Å; K110-E129 PolarHBondContact NZ-OE1 3.28Å; K110-E129 IonicContact NZ-OE2 2.64Å; K110-E129 PolarHBondContact NZ-OE2 2.91Å; K110-Y155 WeakPolarHBondContact O-CA 3.5Å; K110-M156 HydrophobicContact CB-CB 4.36Å; K110-M156 HydrophobicContact CD-CE 3.84Å; K110-M156 HydrophobicContact CG-CE 4.21Å; K110-M156 PolarHBondContact N-O 3.49Å; K110-M156 PolarHBondContact O-N 2.82Å; K110-D222 IonicContact NZ-OD1 2.54Å
111	I	97.3	Very high	96.4	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.4	-177.3	-50.6	173.8	0	0	0	107.8	G93 R94 M96 M109 N153 L154 Y155 L373	G93-I111 CarbonylContact C-O 3.5Å; G93-I111 VanDerWaalsContact CA-O 3.28Å; G93-I111 WeakPolarHBondContact CA-O 3.38Å; R94-I111 HydrophobicContact CG-CB 4.49Å; R94-I111 HydrophobicContact CG-CD1 4.4Å; R94-I111 PolarHBondContact N-O 3.34Å; R94-I111 PolarHBondContact O-N 3.29Å; M96-I111 HydrophobicContact CG-CD1 3.92Å; M96-I111 HydrophobicContact SD-CD1 3.61Å; M109-I111 HydrophobicContact CG-CD1 4.5Å; M109-I111 HydrophobicContact CG-CG1 3.89Å; M109-I111 HydrophobicContact SD-CD1 4.27Å; M109-I111 HydrophobicContact SD-CG1 4.15Å; I111-N153 HydrophobicContact CG2-CB 4.01Å; I111-L154 WeakPolarHBondContact CA-O 3.49Å; I111-Y155 HydrophobicContact CB-CD1 4.42Å; I111-Y155 HydrophobicContact CB-CE1 4.39Å; I111-Y155 HydrophobicContact CD1-CE1 4.41Å; I111-Y155 HydrophobicContact CG1-CD1 3.96Å; I111-Y155 HydrophobicContact CG1-CE1 4.04Å; I111-Y155 HydrophobicContact CG2-CD1 4.14Å; I111-Y155 HydrophobicContact CG2-CE1 3.71Å; I111-L373 HydrophobicContact CD1-CD2 4.22Å; I111-L373 HydrophobicContact CG2-CD1 3.81Å
112	L	96.5	Very high	96.1	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.8	-178	-55.6	171.9	0	0	0	110.6	F92 K110 K114 V117 T126 N153 L154 M156	F92-L112 HydrophobicContact CB-CD2 3.83Å; K110-L112 HydrophobicContact CG-CD2 4.16Å; K110-L112 HydrophobicContact CG-CG 4.35Å; L112-K114 PolarHBondContact O-N 3.11Å; L112-V117 HydrophobicContact CB-CG2 4.18Å; L112-T126 HydrophobicContact CD1-CG2 3.66Å; L112-N153 CarbonylContact O-C 3.56Å; L112-N153 WeakPolarHBondContact O-CA 3.48Å; L112-L154 HydrophobicContact CB-CB 4.28Å; L112-L154 PolarHBondContact N-O 2.88Å; L112-L154 PolarHBondContact O-N 3.19Å; L112-M156 HydrophobicContact CD1-CE 3.58Å
113	D	96.9	Very high	96	Very high	43 Å²	43	51.4 Å²	51.4	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	117.2	175.3	176.9	-42.2	0	0	0	109.8	F92 Q115 K116 V117	F92-D113 PolarHBondContact O-N 3.05Å; D113-Q115 VanDerWaalsContact C-N 3.27Å; D113-Q115 PolarHBondContact O-N 3.25Å; D113-Q115 WeakPolarHBondContact OD1-CA 3.2Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.32Å; D113-Q115 PolarHBondContact OD1-N 3.45Å; D113-K116 HydrophobicContact CB-CB 3.99Å; D113-K116 HydrophobicContact CB-CD 3.93Å; D113-K116 HydrophobicContact CB-CG 3.92Å; D113-K116 PolarHBondContact O-N 3.24Å; D113-K116 VanDerWaalsContact O-N 3.15Å; D113-K116 PolarHBondContact OD1-N 3.08Å; D113-V117 WeakPolarHBondContact O-CG2 3.34Å; D113-V117 PolarHBondContact O-N 2.92Å
114	K	97.6	Very high	95.8	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-55.5	-42	-177.3	-72.1	-176.9	-175.1	-174.6	0	112.3	L112 V117 V118 D150 S152 L154 K380 C381 F385	L112-K114 PolarHBondContact O-N 3.11Å; K114-V117 PolarHBondContact O-N 2.98Å; K114-V118 WeakPolarHBondContact O-CG2 3.45Å; K114-V118 PolarHBondContact O-N 2.96Å; K114-D150 WeakPolarHBondContact CE-O 3.45Å; K114-D150 PolarHBondContact NZ-O 3.28Å; K114-S152 WeakPolarHBondContact CB-O 3.32Å; K114-S152 WeakPolarHBondContact CG-O 3.27Å; K114-S152 PolarHBondContact N-O 3.32Å; K114-L154 HydrophobicContact CD-CD2 4.25Å; K114-L154 HydrophobicContact CG-CD2 3.91Å; K114-L154 HydrophobicContact CG-CG 3.85Å; K114-K380 WeakPolarHBondContact CD-O 3.41Å; K114-K380 PolarHBondContact NZ-O 2.91Å; K114-C381 HydrophobicContact CB-CB 4.07Å; K114-C381 HydrophobicContact CD-CB 4.38Å; K114-F385 HydrophobicContact CB-CD2 4.08Å; K114-F385 HydrophobicContact CB-CE2 3.74Å; K114-F385 HydrophobicContact CD-CD2 3.98Å; K114-F385 HydrophobicContact CD-CE2 4.49Å; K114-F385 HydrophobicContact CG-CD2 3.82Å; K114-F385 HydrophobicContact CG-CE2 3.91Å
115	Q	96.5	Very high	95.4	Very high	111 Å²	111	53.9 Å²	53.9	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-70.3	-38.2	-177.8	-58.8	-170.3	-88.9	0	0	111.2	D113 V118 K119 K380	D113-Q115 VanDerWaalsContact C-N 3.27Å; D113-Q115 PolarHBondContact O-N 3.25Å; D113-Q115 WeakPolarHBondContact OD1-CA 3.2Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.32Å; D113-Q115 PolarHBondContact OD1-N 3.45Å; Q115-V118 PolarHBondContact O-N 3.3Å; Q115-K119 VanDerWaalsContact O-CB 3.24Å; Q115-K119 WeakPolarHBondContact O-CB 3.46Å; Q115-K119 PolarHBondContact O-N 2.99Å; Q115-K380 HydrophobicContact CG-CB 4.16Å; Q115-K380 HydrophobicContact CG-CG 4.31Å
116	K	95.5	Very high	95.3	Very high	99 Å²	99	50.2 Å²	50.2	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-64.4	-43.2	174.2	-69.2	-175.4	-172.4	176.4	0	111.7	D113 V118 K119 L120	D113-K116 HydrophobicContact CB-CB 3.99Å; D113-K116 HydrophobicContact CB-CD 3.93Å; D113-K116 HydrophobicContact CB-CG 3.92Å; D113-K116 PolarHBondContact O-N 3.24Å; D113-K116 VanDerWaalsContact O-N 3.15Å; D113-K116 PolarHBondContact OD1-N 3.08Å; K116-V118 PolarHBondContact O-N 3.43Å; K116-K119 PolarHBondContact O-N 2.87Å; K116-L120 WeakPolarHBondContact O-CB 3.18Å; K116-L120 WeakPolarHBondContact O-CG 3.29Å; K116-L120 PolarHBondContact O-N 3.44Å
117	V	95.6	Very high	95.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-46.6	177.2	174.6	0	0	0	0	110.9	F92 L112 D113 K114 L120 K121 Q122 V123 T126 F385	F92-V117 HydrophobicContact CB-CG2 4.03Å; F92-V117 HydrophobicContact CD1-CG2 4.42Å; F92-V117 HydrophobicContact CG-CG2 4.27Å; L112-V117 HydrophobicContact CB-CG2 4.18Å; D113-V117 WeakPolarHBondContact O-CG2 3.34Å; D113-V117 PolarHBondContact O-N 2.92Å; K114-V117 PolarHBondContact O-N 2.98Å; V117-L120 PolarHBondContact O-N 3.22Å; V117-K121 PolarHBondContact O-N 2.67Å; V117-Q122 HydrophobicContact CG1-CB 4.05Å; V117-Q122 PolarHBondContact O-N 2.79Å; V117-V123 HydrophobicContact CG1-CG2 4.44Å; V117-T126 VanDerWaalsContact CG1-OG1 3.28Å; V117-T126 WeakPolarHBondContact CG1-OG1 2.84Å; V117-F385 HydrophobicContact CB-CZ 3.88Å; V117-F385 HydrophobicContact CG1-CE1 3.91Å; V117-F385 HydrophobicContact CG1-CZ 3.55Å
118	V	96	Very high	94.9	Very high	48 Å²	48	49.4 Å²	49.4	29%	0.291	24%	0.237	S	C	.	.	H	α-helix	trans	-63.7	-47.9	176.3	172.1	0	0	0	0	111.4	K114 Q115 K116 L120 K121 V123 C381 E384 F385	K114-V118 WeakPolarHBondContact O-CG2 3.45Å; K114-V118 PolarHBondContact O-N 2.96Å; Q115-V118 PolarHBondContact O-N 3.3Å; K116-V118 PolarHBondContact O-N 3.43Å; V118-L120 PolarHBondContact O-N 3.32Å; V118-K121 PolarHBondContact O-N 3Å; V118-V123 HydrophobicContact CB-CG2 4.44Å; V118-V123 HydrophobicContact CG2-CG2 3.74Å; V118-C381 HydrophobicContact CG2-CB 4.09Å; V118-E384 HydrophobicContact CG2-CB 4.27Å; V118-E384 HydrophobicContact CG2-CG 4.17Å; V118-F385 HydrophobicContact CG2-CE2 3.81Å; V118-F385 HydrophobicContact CG2-CZ 4.05Å
119	K	95.1	Very high	94.8	Very high	177 Å²	177	49.3 Å²	49.3	77%	0.77	24%	0.235	S	C	*	.	H	α-helix	trans	-57	-37.2	-179.9	-178.4	179.6	177.9	-177.6	0	112.4	Q115 K116 K121	Q115-K119 VanDerWaalsContact O-CB 3.24Å; Q115-K119 WeakPolarHBondContact O-CB 3.46Å; Q115-K119 PolarHBondContact O-N 2.99Å; K116-K119 PolarHBondContact O-N 2.87Å; K119-K121 VanDerWaalsContact C-N 3.33Å
120	L	91.9	Very high	94.7	Very high	87 Å²	87	49.5 Å²	49.5	46%	0.455	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.5	179.8	-65.1	174.1	0	0	0	113.4	F92 K116 V117 V118 Q122	F92-L120 HydrophobicContact CD1-CB 4.41Å; F92-L120 HydrophobicContact CD1-CD1 3.65Å; F92-L120 HydrophobicContact CE1-CB 3.78Å; F92-L120 HydrophobicContact CE1-CD1 3.41Å; F92-L120 VanDerWaalsContact CE1-CD1 3.41Å; F92-L120 HydrophobicContact CE1-CG 4.21Å; K116-L120 WeakPolarHBondContact O-CB 3.18Å; K116-L120 WeakPolarHBondContact O-CG 3.29Å; K116-L120 PolarHBondContact O-N 3.44Å; V117-L120 PolarHBondContact O-N 3.22Å; V118-L120 PolarHBondContact O-N 3.32Å; L120-Q122 HydrophobicContact CB-CG 4.23Å; L120-Q122 WeakPolarHBondContact O-CG 3.45Å
121	K	92.6	Very high	94.7	Very high	154 Å²	154	52 Å²	52	67%	0.67	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	41	178.7	-55.8	-178.4	178.2	-178.4	0	113.8	V117 V118 K119	V117-K121 PolarHBondContact O-N 2.67Å; V118-K121 PolarHBondContact O-N 3Å; K119-K121 VanDerWaalsContact C-N 3.33Å
122	Q	91.8	Very high	94.6	Very high	22 Å²	22	51.8 Å²	51.8	10%	0.103	24%	0.244	C	C	.	.			trans	-110.7	18.9	-175	-64	-69.5	-37.2	0	0	113.2	F92 V117 L120 H125 T126	F92-Q122 HydrophobicContact CE1-CB 4.13Å; F92-Q122 HydrophobicContact CE1-CG 3.66Å; F92-Q122 HydrophobicContact CE2-CG 4.43Å; F92-Q122 HydrophobicContact CZ-CB 4.11Å; F92-Q122 HydrophobicContact CZ-CG 3.52Å; V117-Q122 HydrophobicContact CG1-CB 4.05Å; V117-Q122 PolarHBondContact O-N 2.79Å; L120-Q122 HydrophobicContact CB-CG 4.23Å; L120-Q122 WeakPolarHBondContact O-CG 3.45Å; Q122-H125 PolarHBondContact O-N 2.9Å; Q122-H125 PolarHBondContact OE1-ND1 3.17Å; Q122-T126 WeakPolarHBondContact O-CB 3.42Å; Q122-T126 PolarHBondContact O-N 3.39Å; Q122-T126 PolarHBondContact O-OG1 3.23Å
123	V	94.3	Very high	94.7	Very high	33 Å²	33	51.7 Å²	51.7	20%	0.2	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-53.7	-178.7	178.8	0	0	0	0	110.9	V117 V118 H125 T126 L127 E384 F385	V117-V123 HydrophobicContact CG1-CG2 4.44Å; V118-V123 HydrophobicContact CB-CG2 4.44Å; V118-V123 HydrophobicContact CG2-CG2 3.74Å; V123-H125 PolarHBondContact O-N 3.17Å; V123-T126 PolarHBondContact O-N 3.31Å; V123-L127 HydrophobicContact CG1-CD1 4.04Å; V123-L127 WeakPolarHBondContact O-CG 3.49Å; V123-L127 PolarHBondContact O-N 3.44Å; V123-E384 HydrophobicContact CG1-CB 4.16Å; V123-E384 VanDerWaalsContact CG1-O 3.32Å; V123-E384 WeakPolarHBondContact CG1-O 3.36Å; V123-E384 HydrophobicContact CG2-CB 4.4Å; V123-F385 HydrophobicContact CB-CE1 4.34Å; V123-F385 HydrophobicContact CG1-CD1 4.35Å; V123-F385 HydrophobicContact CG1-CE1 3.93Å; V123-F385 HydrophobicContact CG1-CZ 4.42Å; V123-F385 HydrophobicContact CG2-CE1 4.25Å; V123-F385 HydrophobicContact CG2-CZ 3.98Å
124	E	91.9	Very high	94.6	Very high	112 Å²	112	50.9 Å²	50.9	52%	0.523	24%	0.238	S	C	.	.	H	α-helix	trans	-59.8	-44.7	-179.7	-167.4	-161.8	145	0	0	111.5	T126 L127 N128 K227	E124-T126 PolarHBondContact O-N 3.19Å; E124-L127 PolarHBondContact O-N 3.03Å; E124-N128 VanDerWaalsContact O-CB 3.27Å; E124-N128 WeakPolarHBondContact O-CB 3.35Å; E124-N128 VanDerWaalsContact O-CG 3.25Å; E124-N128 PolarHBondContact O-N 2.89Å; E124-N128 PolarHBondContact O-ND2 3.35Å; E124-N128 PolarHBondContact OE1-ND2 3.15Å; E124-K227 IonicContact OE1-NZ 3.63Å
125	H	88.9	Confident	94.6	Very high	24 Å²	24	50.9 Å²	50.9	11%	0.111	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-39.1	178	-63.7	149.1	0	0	0	112.6	Q12 Q122 V123 N128 E129	Q12-H125 VanDerWaalsContact CD-CE1 3.43Å; Q12-H125 PolarHBondContact NE2-CE1 3.3Å; Q12-H125 PolarHBondContact OE1-CE1 3.11Å; Q12-H125 PolarHBondContact OE1-ND1 3Å; Q122-H125 PolarHBondContact O-N 2.9Å; Q122-H125 PolarHBondContact OE1-ND1 3.17Å; V123-H125 PolarHBondContact O-N 3.17Å; H125-N128 PolarHBondContact O-N 2.84Å; H125-E129 VanDerWaalsContact O-CB 3.28Å; H125-E129 WeakPolarHBondContact O-CB 3.39Å; H125-E129 PolarHBondContact O-N 3.07Å
126	T	93.8	Very high	94.6	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-42.6	177.6	-56.4	0	0	0	0	111.7	L112 V117 Q122 V123 E124 E129 K130 L154 F388	L112-T126 HydrophobicContact CD1-CG2 3.66Å; V117-T126 VanDerWaalsContact CG1-OG1 3.28Å; V117-T126 WeakPolarHBondContact CG1-OG1 2.84Å; Q122-T126 WeakPolarHBondContact O-CB 3.42Å; Q122-T126 PolarHBondContact O-N 3.39Å; Q122-T126 PolarHBondContact O-OG1 3.23Å; V123-T126 PolarHBondContact O-N 3.31Å; E124-T126 PolarHBondContact O-N 3.19Å; T126-E129 PolarHBondContact O-N 2.79Å; T126-K130 PolarHBondContact O-N 3.35Å; T126-K130 VanDerWaalsContact O-N 3.1Å; T126-L154 HydrophobicContact CG2-CD1 3.65Å; T126-F388 HydrophobicContact CG2-CD2 4.43Å; T126-F388 HydrophobicContact CG2-CE2 4.08Å
127	L	95	Very high	94.6	Very high	37 Å²	37	42.1 Å²	42.1	19%	0.194	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-43.4	175.5	-68.4	173.2	0	0	0	111.3	V123 E124 K130 R131 F385 F388	V123-L127 HydrophobicContact CG1-CD1 4.04Å; V123-L127 WeakPolarHBondContact O-CG 3.49Å; V123-L127 PolarHBondContact O-N 3.44Å; E124-L127 PolarHBondContact O-N 3.03Å; L127-K130 PolarHBondContact O-N 3.24Å; L127-R131 VanDerWaalsContact O-CB 3.22Å; L127-R131 WeakPolarHBondContact O-CB 3.39Å; L127-R131 PolarHBondContact O-N 3.42Å; L127-F385 HydrophobicContact CD2-CD1 4.34Å; L127-F388 HydrophobicContact CD2-CB 3.89Å; L127-F388 HydrophobicContact CD2-CD2 4.24Å
128	N	92.9	Very high	94.7	Very high	36 Å²	36	42.2 Å²	42.2	19%	0.193	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-45	175.7	-78.2	-29	0	0	0	111.9	E124 H125 R131 I132	E124-N128 VanDerWaalsContact O-CB 3.27Å; E124-N128 WeakPolarHBondContact O-CB 3.35Å; E124-N128 VanDerWaalsContact O-CG 3.25Å; E124-N128 PolarHBondContact O-N 2.89Å; E124-N128 PolarHBondContact O-ND2 3.35Å; E124-N128 PolarHBondContact OE1-ND2 3.15Å; H125-N128 PolarHBondContact O-N 2.84Å; N128-R131 PolarHBondContact O-N 3.06Å; N128-I132 WeakPolarHBondContact O-CB 3.47Å; N128-I132 VanDerWaalsContact O-CG1 3.24Å; N128-I132 WeakPolarHBondContact O-CG1 3.36Å; N128-I132 PolarHBondContact O-N 3.44Å
129	E	95.1	Very high	94.7	Very high	9 Å²	9	40.3 Å²	40.3	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-56.1	-54	177.2	177.7	175.7	-163.3	0	0	110.3	K110 H125 T126 R131 I132 L133 M156 F223	K110-E129 IonicContact NZ-OE1 3.85Å; K110-E129 PolarHBondContact NZ-OE1 3.28Å; K110-E129 IonicContact NZ-OE2 2.64Å; K110-E129 PolarHBondContact NZ-OE2 2.91Å; H125-E129 VanDerWaalsContact O-CB 3.28Å; H125-E129 WeakPolarHBondContact O-CB 3.39Å; H125-E129 PolarHBondContact O-N 3.07Å; T126-E129 PolarHBondContact O-N 2.79Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.34Å; E129-I132 PolarHBondContact O-N 3.4Å; E129-L133 HydrophobicContact CG-CD1 3.67Å; E129-L133 HydrophobicContact CG-CG 4.42Å; E129-L133 WeakPolarHBondContact O-CB 3.47Å; E129-L133 WeakPolarHBondContact O-CG 3.4Å; E129-L133 PolarHBondContact O-N 2.84Å; E129-M156 HydrophobicContact CG-CE 4.41Å; E129-M156 HydrophobicContact CG-SD 4.31Å; E129-F223 HydrophobicContact CG-CB 4.1Å
130	K	96.3	Very high	94.9	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-43.8	178.1	-176.2	-93.2	171.3	162.9	0	111.6	A72 T126 L127 I132 L133 Q134 M144 S147 M156 F388	A72-K130 PolarHBondContact O-NZ 3.01Å; T126-K130 PolarHBondContact O-N 3.35Å; T126-K130 VanDerWaalsContact O-N 3.1Å; L127-K130 PolarHBondContact O-N 3.24Å; K130-I132 PolarHBondContact O-N 2.66Å; K130-L133 PolarHBondContact O-N 3.45Å; K130-Q134 WeakPolarHBondContact O-CG 3.44Å; K130-Q134 PolarHBondContact O-N 3.35Å; K130-Q134 VanDerWaalsContact O-N 3.14Å; K130-M144 HydrophobicContact CG-CE 4.12Å; K130-M144 HydrophobicContact CG-SD 4.48Å; K130-S147 WeakPolarHBondContact CE-OG 3.43Å; K130-M156 HydrophobicContact CB-SD 3.97Å; K130-M156 HydrophobicContact CG-CG 4.49Å; K130-M156 HydrophobicContact CG-SD 4.43Å; K130-F388 HydrophobicContact CB-CD2 4.26Å; K130-F388 HydrophobicContact CB-CE2 3.8Å; K130-F388 HydrophobicContact CB-CZ 4.27Å; K130-F388 WeakPolarHBondContact CD-OXT 3.11Å; K130-F388 WeakPolarHBondContact CE-OXT 3.45Å; K130-F388 HydrophobicContact CG-CD2 4.29Å; K130-F388 HydrophobicContact CG-CE1 4.36Å; K130-F388 HydrophobicContact CG-CE2 3.88Å; K130-F388 HydrophobicContact CG-CZ 3.92Å; K130-F388 PolarHBondContact NZ-OXT 3.03Å
131	R	96.4	Very high	95.2	Very high	80 Å²	80	27.7 Å²	27.7	30%	0.302	13%	0.13	S	C	.	.	H	α-helix	trans	-66.4	-36.7	-177.7	-168.7	177.7	-175.6	162.9	3.7	112.8	W68 L127 N128 E129 Q134 A135	W68-R131 HydrophobicContact CD2-CG 4.31Å; W68-R131 HydrophobicContact CE3-CG 3.88Å; W68-R131 HydrophobicContact CH2-CG 4Å; W68-R131 HydrophobicContact CZ2-CG 4.42Å; W68-R131 HydrophobicContact CZ3-CB 4.23Å; W68-R131 HydrophobicContact CZ3-CG 3.7Å; W68-R131 PolarHBondContact O-NE 2.64Å; W68-R131 PolarHBondContact O-NH2 2.81Å; L127-R131 VanDerWaalsContact O-CB 3.22Å; L127-R131 WeakPolarHBondContact O-CB 3.39Å; L127-R131 PolarHBondContact O-N 3.42Å; N128-R131 PolarHBondContact O-N 3.06Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.34Å; R131-Q134 VanDerWaalsContact O-CG 3.3Å; R131-Q134 WeakPolarHBondContact O-CG 3.32Å; R131-A135 WeakPolarHBondContact O-CB 3Å
132	I	96.9	Very high	95.4	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-70	-52.4	174.4	-68.5	167.6	0	0	0	109.8	W68 N128 E129 K130 Q134 A135 I136 L200 F223 A226	W68-I132 HydrophobicContact CH2-CG1 4.25Å; W68-I132 HydrophobicContact CZ3-CG1 3.7Å; N128-I132 WeakPolarHBondContact O-CB 3.47Å; N128-I132 VanDerWaalsContact O-CG1 3.24Å; N128-I132 WeakPolarHBondContact O-CG1 3.36Å; N128-I132 PolarHBondContact O-N 3.44Å; E129-I132 PolarHBondContact O-N 3.4Å; K130-I132 PolarHBondContact O-N 2.66Å; I132-Q134 VanDerWaalsContact C-N 3.31Å; I132-Q134 PolarHBondContact O-N 3.16Å; I132-A135 PolarHBondContact O-N 3.35Å; I132-I136 HydrophobicContact CG2-CD1 4.43Å; I132-I136 HydrophobicContact CG2-CG2 4.08Å; I132-I136 WeakPolarHBondContact O-CG1 3.48Å; I132-I136 PolarHBondContact O-N 2.86Å; I132-L200 HydrophobicContact CD1-CD2 3.91Å; I132-L200 HydrophobicContact CG1-CD2 3.85Å; I132-L200 HydrophobicContact CG2-CD1 4Å; I132-L200 HydrophobicContact CG2-CD2 4.31Å; I132-F223 HydrophobicContact CG2-CD1 3.79Å; I132-F223 HydrophobicContact CG2-CE1 4.32Å; I132-A226 VanDerWaalsContact CD1-C 3.45Å; I132-A226 HydrophobicContact CD1-CB 3.62Å; I132-A226 VanDerWaalsContact CD1-O 3.3Å; I132-A226 WeakPolarHBondContact CD1-O 3.42Å; I132-A226 HydrophobicContact CG2-CB 4.45Å
133	L	96.9	Very high	95.5	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-59.2	-35.2	-174.3	-79.6	171.3	0	0	0	114.1	E129 K130 A135 I136 V142 M144 M156 L158 F223	E129-L133 HydrophobicContact CG-CD1 3.67Å; E129-L133 HydrophobicContact CG-CG 4.42Å; E129-L133 WeakPolarHBondContact O-CB 3.47Å; E129-L133 WeakPolarHBondContact O-CG 3.4Å; E129-L133 PolarHBondContact O-N 2.84Å; K130-L133 PolarHBondContact O-N 3.45Å; L133-A135 VanDerWaalsContact C-N 3.3Å; L133-I136 HydrophobicContact CD2-CD1 4.37Å; L133-V142 HydrophobicContact CD2-CG1 4.19Å; L133-M144 HydrophobicContact CB-CB 4.04Å; L133-M144 HydrophobicContact CB-CE 4.26Å; L133-M144 HydrophobicContact CB-SD 4.15Å; L133-M156 HydrophobicContact CD1-SD 4.09Å; L133-L158 HydrophobicContact CD1-CD2 4.17Å; L133-F223 HydrophobicContact CD1-CB 4.44Å; L133-F223 HydrophobicContact CD2-CB 4.14Å; L133-F223 HydrophobicContact CD2-CD2 3.5Å; L133-F223 HydrophobicContact CD2-CE2 4.01Å; L133-F223 HydrophobicContact CD2-CG 3.86Å; L133-F223 HydrophobicContact CG-CB 4.04Å; L133-F223 HydrophobicContact CG-CD2 4.34Å; L133-F223 HydrophobicContact CG-CG 4.25Å
134	Q	96	Very high	95.7	Very high	25 Å²	25	21.3 Å²	21.3	12%	0.117	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-21.8	175.2	65.6	-172.1	-1.8	0	0	113.4	A72 K130 R131 I132 M144	A72-Q134 PolarHBondContact O-OE1 2.94Å; K130-Q134 WeakPolarHBondContact O-CG 3.44Å; K130-Q134 PolarHBondContact O-N 3.35Å; K130-Q134 VanDerWaalsContact O-N 3.14Å; R131-Q134 VanDerWaalsContact O-CG 3.3Å; R131-Q134 WeakPolarHBondContact O-CG 3.32Å; I132-Q134 VanDerWaalsContact C-N 3.31Å; I132-Q134 PolarHBondContact O-N 3.16Å; Q134-M144 HydrophobicContact CB-CE 3.43Å; Q134-M144 VanDerWaalsContact CB-CE 3.43Å; Q134-M144 HydrophobicContact CG-CE 4.46Å
135	A	96.9	Very high	95.9	Very high	2 Å²	2	18.9 Å²	18.9	2%	0.017	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-25.6	-171.5	0	0	0	0	0	112.7	F64 R67 W68 R131 I132 L133	F64-A135 HydrophobicContact CD2-CB 3.59Å; F64-A135 WeakPolarHBondContact CD2-O 3.24Å; F64-A135 HydrophobicContact CE2-CB 3.55Å; F64-A135 HydrophobicContact CZ-CB 4.48Å; R67-A135 HydrophobicContact CB-CB 3.97Å; W68-A135 HydrophobicContact CB-CB 4.35Å; W68-A135 HydrophobicContact CE3-CB 4.33Å; R131-A135 WeakPolarHBondContact O-CB 3Å; I132-A135 PolarHBondContact O-N 3.35Å; L133-A135 VanDerWaalsContact C-N 3.3Å
136	I	97.4	Very high	96.3	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.021	10%	0.097	C	C	.	.			trans	-83.7	153.2	177.4	61.4	169.1	0	0	0	112.4	F64 I132 L133 L141 Y194 L195 L198 L200 F223	F64-I136 HydrophobicContact CD2-CG2 4.11Å; F64-I136 HydrophobicContact CE2-CG2 4.02Å; I132-I136 HydrophobicContact CG2-CD1 4.43Å; I132-I136 HydrophobicContact CG2-CG2 4.08Å; I132-I136 WeakPolarHBondContact O-CG1 3.48Å; I132-I136 PolarHBondContact O-N 2.86Å; L133-I136 HydrophobicContact CD2-CD1 4.37Å; I136-L141 HydrophobicContact CB-CD1 4.47Å; I136-L141 HydrophobicContact CD1-CB 4.28Å; I136-L141 HydrophobicContact CD1-CD1 3.77Å; I136-Y194 WeakPolarHBondContact CA-OH 3.26Å; I136-Y194 HydrophobicContact CB-CE1 4.04Å; I136-Y194 HydrophobicContact CG2-CE1 4.13Å; I136-L195 HydrophobicContact CG2-CD2 4.14Å; I136-L198 HydrophobicContact CG2-CD1 4.27Å; I136-L200 HydrophobicContact CG2-CD1 3.65Å; I136-F223 HydrophobicContact CD1-CD1 4.19Å; I136-F223 HydrophobicContact CD1-CE1 3.52Å; I136-F223 HydrophobicContact CD1-CE2 4.15Å; I136-F223 HydrophobicContact CD1-CZ 3.48Å; I136-F223 VanDerWaalsContact CD1-CZ 3.48Å
137	D	95.9	Very high	96.5	Very high	22 Å²	22	19.3 Å²	19.3	12%	0.118	10%	0.097	C	C	.	.			trans	-158.1	104.5	177.2	-168.2	-4	0	0	0	108.8	R67 Y194	R67-D137 IonicContact CZ-OD2 3.99Å; R67-D137 IonicContact NH1-OD2 3.54Å; R67-D137 IonicContact NH2-OD2 3.44Å; R67-D137 PolarHBondContact NH2-OD2 3.37Å; D137-Y194 PolarHBondContact N-OH 2.85Å; D137-Y194 PolarHBondContact O-OH 2.92Å
138	F	97	Very high	96.7	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	9%	0.089	C	C	.	.			trans	-153.8	144.2	-177.5	-165.5	-108.2	0	0	0	111.3	F53 F56 F140 L141 L190 A191 Y194 Y344	F53-F138 HydrophobicContact CE2-CE2 4.01Å; F53-F138 HydrophobicContact CE2-CZ 4.07Å; F53-F138 AromaticContact CZ-CE2 3.92Å; F53-F138 HydrophobicContact CZ-CE2 3.92Å; F53-F138 AromaticContact CZ-CZ 3.87Å; F53-F138 HydrophobicContact CZ-CZ 3.87Å; F56-F138 HydrophobicContact CD1-CE2 4.4Å; F56-F138 AromaticContact CE1-CD2 3.64Å; F56-F138 HydrophobicContact CE1-CD2 3.64Å; F56-F138 AromaticContact CE1-CE2 3.45Å; F56-F138 HydrophobicContact CE1-CE2 3.45Å; F56-F138 VanDerWaalsContact CE1-CE2 3.45Å; F56-F138 AromaticContact CZ-CD2 3.66Å; F56-F138 HydrophobicContact CZ-CD2 3.66Å; F56-F138 AromaticContact CZ-CE2 3.87Å; F56-F138 HydrophobicContact CZ-CE2 3.87Å; F138-F140 HydrophobicContact CD1-CB 4.41Å; F138-F140 HydrophobicContact CD1-CD2 4.33Å; F138-F140 AromaticContact CE1-CD2 3.68Å; F138-F140 HydrophobicContact CE1-CD2 3.68Å; F138-F140 HydrophobicContact CE1-CE2 4.24Å; F138-F140 HydrophobicContact CE1-CG 4.43Å; F138-F140 PolarHBondContact O-N 3.3Å; F138-L141 HydrophobicContact CB-CB 4.36Å; F138-L141 HydrophobicContact CB-CD1 3.78Å; F138-L141 HydrophobicContact CB-CG 3.87Å; F138-L141 HydrophobicContact CD1-CG 4.26Å; F138-L141 PolarHBondContact O-N 2.83Å; F138-L190 HydrophobicContact CE1-CB 4.13Å; F138-L190 HydrophobicContact CZ-CB 3.99Å; F138-A191 HydrophobicContact CD1-CB 4.28Å; F138-A191 HydrophobicContact CE1-CB 4.22Å; F138-Y194 HydrophobicContact CB-CD1 3.74Å; F138-Y194 HydrophobicContact CB-CD2 4.32Å; F138-Y194 HydrophobicContact CB-CE1 3.79Å; F138-Y194 HydrophobicContact CB-CE2 4.33Å; F138-Y194 HydrophobicContact CB-CG 4.02Å; F138-Y194 HydrophobicContact CD1-CD1 4.46Å; F138-Y194 HydrophobicContact CD1-CG 4.37Å; F138-Y194 HydrophobicContact CD2-CD1 4.18Å; F138-Y194 AromaticContact CD2-CD2 3.56Å; F138-Y194 HydrophobicContact CD2-CD2 3.56Å; F138-Y194 HydrophobicContact CD2-CE2 4.15Å; F138-Y194 AromaticContact CD2-CG 3.56Å; F138-Y194 HydrophobicContact CD2-CG 3.56Å; F138-Y194 HydrophobicContact CE2-CD2 4.18Å; F138-Y194 HydrophobicContact CE2-CG 4.14Å; F138-Y194 AromaticContact CG-CD1 3.88Å; F138-Y194 HydrophobicContact CG-CD1 3.88Å; F138-Y194 HydrophobicContact CG-CD2 4.11Å; F138-Y194 HydrophobicContact CG-CE1 4.4Å; F138-Y194 AromaticContact CG-CG 3.72Å; F138-Y194 HydrophobicContact CG-CG 3.72Å; F138-Y344 HydrophobicContact CD2-CE2 4.43Å; F138-Y344 HydrophobicContact CE2-CD2 4.02Å; F138-Y344 AromaticContact CE2-CE2 3.7Å; F138-Y344 HydrophobicContact CE2-CE2 3.7Å; F138-Y344 AromaticContact CZ-CD2 3.99Å; F138-Y344 HydrophobicContact CZ-CD2 3.99Å; F138-Y344 HydrophobicContact CZ-CE2 4.15Å
139	P	96.1	Very high	96.9	Very high	8 Å²	8	18.3 Å²	18.3	5%	0.052	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-29.1	-170.7	-29.4	36.3	0	0	0	115.8	L46 K219 Y344	L46-P139 HydrophobicContact CD1-CG 3.9Å; L46-P139 HydrophobicContact CD2-CG 3.59Å; L46-P139 HydrophobicContact CG-CG 4.41Å; P139-K219 WeakPolarHBondContact O-CE 3.41Å; P139-K219 PolarHBondContact O-NZ 3.41Å; P139-Y344 HydrophobicContact CG-CD2 3.98Å; P139-Y344 HydrophobicContact CG-CE2 3.62Å
140	F	98.2	Very high	97	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	10.4	-176.7	-46.1	-45.7	0	0	0	113.8	F138 Q187 L190 A191 Y217 L218 K219 I220 I343 K346	F138-F140 HydrophobicContact CD1-CB 4.41Å; F138-F140 HydrophobicContact CD1-CD2 4.33Å; F138-F140 AromaticContact CE1-CD2 3.68Å; F138-F140 HydrophobicContact CE1-CD2 3.68Å; F138-F140 HydrophobicContact CE1-CE2 4.24Å; F138-F140 HydrophobicContact CE1-CG 4.43Å; F138-F140 PolarHBondContact O-N 3.3Å; F140-Q187 HydrophobicContact CD1-CB 4.26Å; F140-Q187 HydrophobicContact CD1-CG 4.14Å; F140-Q187 HydrophobicContact CD2-CB 3.73Å; F140-Q187 HydrophobicContact CD2-CG 4.14Å; F140-Q187 WeakPolarHBondContact CD2-O 3.45Å; F140-Q187 HydrophobicContact CE1-CG 3.97Å; F140-Q187 HydrophobicContact CE2-CB 4Å; F140-Q187 HydrophobicContact CE2-CG 3.96Å; F140-Q187 HydrophobicContact CG-CB 3.9Å; F140-Q187 HydrophobicContact CG-CG 4.25Å; F140-Q187 HydrophobicContact CZ-CB 4.39Å; F140-Q187 HydrophobicContact CZ-CG 3.88Å; F140-L190 HydrophobicContact CD2-CB 4.36Å; F140-L190 HydrophobicContact CE2-CB 4.15Å; F140-L190 HydrophobicContact CE2-CD1 3.86Å; F140-A191 HydrophobicContact CB-CB 4.47Å; F140-Y217 HydrophobicContact CD1-CD1 4.35Å; F140-Y217 AromaticContact CE1-CD1 3.62Å; F140-Y217 HydrophobicContact CE1-CD1 3.62Å; F140-Y217 HydrophobicContact CE1-CE1 4.16Å; F140-Y217 HydrophobicContact CZ-CD1 4.39Å; F140-L218 WeakPolarHBondContact CA-O 3.27Å; F140-K219 CarbonylContact O-C 3.48Å; F140-K219 WeakPolarHBondContact O-CA 3.43Å; F140-I220 WeakPolarHBondContact O-CG1 3.39Å; F140-I220 PolarHBondContact O-N 3.41Å; F140-I343 HydrophobicContact CE2-CG2 4.17Å; F140-I343 HydrophobicContact CZ-CG2 3.95Å; F140-I343 WeakPolarHBondContact CZ-O 3.16Å; F140-K346 HydrophobicContact CE1-CG 4.19Å
141	L	98.2	Very high	97.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-109.2	148.7	172.8	-54.8	-177.1	0	0	0	109	I136 F138 A191 Y194 L195 K219 I220 F223	I136-L141 HydrophobicContact CB-CD1 4.47Å; I136-L141 HydrophobicContact CD1-CB 4.28Å; I136-L141 HydrophobicContact CD1-CD1 3.77Å; F138-L141 HydrophobicContact CB-CB 4.36Å; F138-L141 HydrophobicContact CB-CD1 3.78Å; F138-L141 HydrophobicContact CB-CG 3.87Å; F138-L141 HydrophobicContact CD1-CG 4.26Å; F138-L141 PolarHBondContact O-N 2.83Å; L141-A191 HydrophobicContact CD2-CB 3.93Å; L141-Y194 HydrophobicContact CD1-CD1 3.69Å; L141-Y194 HydrophobicContact CD1-CE1 3.67Å; L141-L195 HydrophobicContact CD1-CD2 3.8Å; L141-L195 HydrophobicContact CD1-CG 4.12Å; L141-L195 HydrophobicContact CD2-CD1 4.46Å; L141-K219 WeakPolarHBondContact O-CD 2.97Å; L141-K219 PolarHBondContact O-NZ 2.77Å; L141-I220 HydrophobicContact CD2-CB 3.74Å; L141-I220 HydrophobicContact CD2-CD1 3.74Å; L141-I220 HydrophobicContact CD2-CG1 3.98Å; L141-I220 HydrophobicContact CD2-CG2 4.47Å; L141-F223 HydrophobicContact CB-CZ 4.41Å; L141-F223 HydrophobicContact CD1-CZ 4.24Å; L141-F223 HydrophobicContact CD2-CZ 4Å; L141-F223 HydrophobicContact CG-CZ 4.43Å
142	V	97.2	Very high	97.1	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.012	10%	0.098	C	C	.	.	P	Polyproline II helix	trans	-71.9	129.5	173.5	83.4	0	0	0	0	109.7	L133 L158 E159 I161 I220	L133-V142 HydrophobicContact CD2-CG1 4.19Å; V142-L158 HydrophobicContact CG1-CD1 4.49Å; V142-L158 HydrophobicContact CG1-CD2 4.31Å; V142-L158 HydrophobicContact CG2-CB 4.22Å; V142-E159 WeakPolarHBondContact CA-OE1 3.25Å; V142-E159 HydrophobicContact CG2-CG 3.52Å; V142-I161 HydrophobicContact CG2-CG1 4.37Å; V142-I220 WeakPolarHBondContact CB-O 3.26Å; V142-I220 PolarHBondContact N-O 3.42Å
143	N	95.4	Very high	97.2	Very high	47 Å²	47	19 Å²	19	25%	0.251	10%	0.1	S	C	.	.	P	Polyproline II helix	trans	-89.8	130.1	-179.5	-71.6	-19.7	0	0	0	110.9	L158 E159	N143-L158 CarbonylContact O-C 3.59Å; N143-L158 WeakPolarHBondContact O-CA 3.38Å; N143-E159 HydrophobicContact CB-CG 4.41Å; N143-E159 WeakPolarHBondContact CB-OE1 3.4Å; N143-E159 PolarHBondContact N-OE1 3.3Å; N143-E159 PolarHBondContact O-N 3.48Å
144	M	97.3	Very high	97.2	Very high	26 Å²	26	18.8 Å²	18.8	13%	0.128	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.8	168.3	-170.2	173.4	71	0	0	110	K130 L133 Q134 M156 L158	K130-M144 HydrophobicContact CG-CE 4.12Å; K130-M144 HydrophobicContact CG-SD 4.48Å; L133-M144 HydrophobicContact CB-CB 4.04Å; L133-M144 HydrophobicContact CB-CE 4.26Å; L133-M144 HydrophobicContact CB-SD 4.15Å; Q134-M144 HydrophobicContact CB-CE 3.43Å; Q134-M144 VanDerWaalsContact CB-CE 3.43Å; Q134-M144 HydrophobicContact CG-CE 4.46Å; M144-M156 HydrophobicContact SD-CB 3.82Å; M144-M156 HydrophobicContact SD-CG 3.8Å; M144-M156 HydrophobicContact SD-SD 4.26Å; M144-L158 HydrophobicContact CB-CD2 3.72Å; M144-L158 HydrophobicContact CG-CD2 3.95Å
145	T	96.4	Very high	97.4	Very high	61 Å²	61	17.6 Å²	17.6	37%	0.374	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-42	-178.4	-52.5	0	0	0	0	111.8	Y107 V157	Y107-T145 HydrophobicContact CE1-CG2 4Å; Y107-T145 WeakPolarHBondContact CE1-OG1 3.27Å; T145-V157 PolarHBondContact N-O 2.98Å
146	F	97.9	Very high	97.4	Very high	35 Å²	35	17.6 Å²	17.6	15%	0.154	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.8	-180	-45.6	-83.3	0	0	0	111.5	T75 A76 F81 Y107 V157	T75-F146 VanDerWaalsContact OG1-CA 3.31Å; T75-F146 WeakPolarHBondContact OG1-CA 3.45Å; A76-F146 HydrophobicContact CB-CB 3.91Å; A76-F146 HydrophobicContact CB-CD1 3.95Å; A76-F146 HydrophobicContact CB-CG 4.03Å; F81-F146 HydrophobicContact CE1-CD2 4.16Å; F81-F146 HydrophobicContact CE1-CE2 4.27Å; F81-F146 AromaticContact CZ-CD2 3.74Å; F81-F146 HydrophobicContact CZ-CD2 3.74Å; F81-F146 HydrophobicContact CZ-CE2 4.13Å; F81-F146 HydrophobicContact CZ-CG 4.23Å; Y107-F146 HydrophobicContact CE1-CE2 4.28Å; Y107-F146 HydrophobicContact CE2-CE2 4.15Å; Y107-F146 AromaticContact CZ-CE2 3.89Å; F146-V157 HydrophobicContact CB-CB 3.89Å; F146-V157 HydrophobicContact CB-CG2 4.03Å; F146-V157 HydrophobicContact CD2-CB 4.02Å; F146-V157 HydrophobicContact CD2-CG1 3.88Å; F146-V157 HydrophobicContact CG-CB 4.47Å; F146-V157 PolarHBondContact N-O 3.21Å; F146-V157 PolarHBondContact O-N 2.86Å
147	S	98	Very high	97.4	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.021	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	137.9	170.5	60.4	0	0	0	0	110.5	N74 T75 K130 Y155	N74-S147 WeakPolarHBondContact CA-O 3.46Å; N74-S147 PolarHBondContact N-O 3.1Å; T75-S147 PolarHBondContact N-O 2.76Å; T75-S147 PolarHBondContact OG1-N 3.07Å; K130-S147 WeakPolarHBondContact CE-OG 3.43Å; S147-Y155 VanDerWaalsContact CA-O 3.27Å; S147-Y155 WeakPolarHBondContact CA-O 3.26Å
148	F	98.3	Very high	97.5	Very high	5 Å²	5	16.9 Å²	16.9	2%	0.022	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	173.4	-179.3	56.4	-88.4	0	0	0	110.7	A76 L78 F81 M109 Y155 V157 F388	A76-F148 HydrophobicContact CB-CD1 3.89Å; A76-F148 HydrophobicContact CB-CE1 4.05Å; A76-F148 WeakPolarHBondContact O-CB 3.12Å; A76-F148 VanDerWaalsContact O-CG 3.26Å; A76-F148 WeakPolarHBondContact O-CG 3.22Å; L78-F148 HydrophobicContact CB-CE2 4Å; L78-F148 VanDerWaalsContact N-CE2 3.3Å; F81-F148 HydrophobicContact CD2-CE1 4.45Å; F81-F148 HydrophobicContact CD2-CZ 4.35Å; F81-F148 AromaticContact CE2-CE1 3.81Å; F81-F148 HydrophobicContact CE2-CE1 3.81Å; F81-F148 HydrophobicContact CE2-CZ 4.14Å; M109-F148 HydrophobicContact CE-CE1 4.39Å; M109-F148 HydrophobicContact CE-CZ 3.86Å; F148-Y155 AromaticContact CD2-CD2 3.37Å; F148-Y155 HydrophobicContact CD2-CD2 3.37Å; F148-Y155 HydrophobicContact CD2-CE2 4.12Å; F148-Y155 AromaticContact CD2-CG 3.74Å; F148-Y155 HydrophobicContact CD2-CG 3.74Å; F148-Y155 HydrophobicContact CE1-CG 4.49Å; F148-Y155 AromaticContact CE2-CD1 3.91Å; F148-Y155 HydrophobicContact CE2-CD1 3.91Å; F148-Y155 AromaticContact CE2-CD2 3.25Å; F148-Y155 HydrophobicContact CE2-CD2 3.25Å; F148-Y155 HydrophobicContact CE2-CE1 4.44Å; F148-Y155 AromaticContact CE2-CE2 3.85Å; F148-Y155 HydrophobicContact CE2-CE2 3.85Å; F148-Y155 AromaticContact CE2-CG 3.27Å; F148-Y155 HydrophobicContact CE2-CG 3.27Å; F148-Y155 HydrophobicContact CG-CD2 4.34Å; F148-Y155 HydrophobicContact CZ-CD1 4.14Å; F148-Y155 HydrophobicContact CZ-CD2 4.17Å; F148-Y155 AromaticContact CZ-CG 3.72Å; F148-Y155 HydrophobicContact CZ-CG 3.72Å; F148-Y155 PolarHBondContact N-O 3.32Å; F148-Y155 VanDerWaalsContact N-O 3.09Å; F148-Y155 WeakPolarHBondContact O-CB 3.31Å; F148-Y155 PolarHBondContact O-N 2.83Å; F148-V157 HydrophobicContact CE1-CG2 3.75Å; F148-V157 HydrophobicContact CZ-CG2 4.48Å; F148-F388 WeakPolarHBondContact O-CE1 3.4Å
149	K	97.8	Very high	97.5	Very high	46 Å²	46	18.9 Å²	18.9	20%	0.2	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156	177.7	63.6	-161.6	173.7	-150	0	110.8	N153 L154 F385 A386 F388	K149-N153 WeakPolarHBondContact CA-O 3.26Å; K149-L154 HydrophobicContact CB-CD2 3.8Å; K149-L154 HydrophobicContact CD-CD2 4.46Å; K149-F385 PolarHBondContact NZ-O 3.11Å; K149-A386 PolarHBondContact NZ-O 3.03Å; K149-F388 HydrophobicContact CB-CD1 4.39Å; K149-F388 HydrophobicContact CD-CB 4.21Å; K149-F388 HydrophobicContact CD-CD1 4.45Å; K149-F388 PolarHBondContact NZ-O 3.39Å
150	D	97.4	Very high	97.5	Very high	30 Å²	30	19.8 Å²	19.8	16%	0.16	10%	0.102	C	C	.	.			trans	-125.2	-164.7	169.1	68.7	26	0	0	0	110.4	K114 S152 N153 Y155 I375	K114-D150 WeakPolarHBondContact CE-O 3.45Å; K114-D150 PolarHBondContact NZ-O 3.28Å; D150-S152 PolarHBondContact O-N 3.49Å; D150-S152 VanDerWaalsContact O-N 3.16Å; D150-S152 WeakPolarHBondContact OD1-CA 3.32Å; D150-S152 PolarHBondContact OD1-N 3.15Å; D150-N153 PolarHBondContact N-O 2.83Å; D150-N153 PolarHBondContact OD1-N 2.97Å; D150-Y155 HydrophobicContact CB-CE2 4.16Å; D150-Y155 VanDerWaalsContact OD2-CE2 3.24Å; D150-Y155 WeakPolarHBondContact OD2-CE2 3.28Å; D150-Y155 VanDerWaalsContact OD2-CZ 3.26Å; D150-Y155 PolarHBondContact OD2-OH 2.97Å; D150-I375 HydrophobicContact CB-CG2 4.35Å; D150-I375 WeakPolarHBondContact OD2-CD1 3.42Å; D150-I375 WeakPolarHBondContact OD2-CG1 3.25Å
151	N	97.7	Very high	97.5	Very high	54 Å²	54	20.2 Å²	20.2	29%	0.289	11%	0.105	S	C	.	.	S	Bend	trans	-61.1	-21.5	-179.9	-76	-14.3	0	0	0	114.6	I375 S376 K380	N151-I375 HydrophobicContact CB-CG2 4.02Å; N151-S376 WeakPolarHBondContact CB-O 3.43Å; N151-S376 PolarHBondContact ND2-O 2.76Å; N151-K380 VanDerWaalsContact O-CB 3.31Å; N151-K380 WeakPolarHBondContact O-CB 3.42Å; N151-K380 WeakPolarHBondContact O-CG 3.44Å; N151-K380 PolarHBondContact O-N 3.48Å
152	S	97.5	Very high	97.2	Very high	14 Å²	14	20.8 Å²	20.8	10%	0.098	11%	0.109	C	C	.	.	S	Bend	trans	-127.2	-29.2	-171.3	-61.5	0	0	0	0	114.4	K114 D150 S376	K114-S152 WeakPolarHBondContact CB-O 3.32Å; K114-S152 WeakPolarHBondContact CG-O 3.27Å; K114-S152 PolarHBondContact N-O 3.32Å; D150-S152 PolarHBondContact O-N 3.49Å; D150-S152 VanDerWaalsContact O-N 3.16Å; D150-S152 WeakPolarHBondContact OD1-CA 3.32Å; D150-S152 PolarHBondContact OD1-N 3.15Å; S152-S376 WeakPolarHBondContact OG-CB 3.48Å; S152-S376 PolarHBondContact OG-N 2.96Å
153	N	97.9	Very high	97.1	Very high	10 Å²	10	20.7 Å²	20.7	5%	0.053	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156.4	-168	-54	-67.5	0	0	0	112.4	I111 L112 K149 D150 Y155	I111-N153 HydrophobicContact CG2-CB 4.01Å; L112-N153 CarbonylContact O-C 3.56Å; L112-N153 WeakPolarHBondContact O-CA 3.48Å; K149-N153 WeakPolarHBondContact CA-O 3.26Å; D150-N153 PolarHBondContact N-O 2.83Å; D150-N153 PolarHBondContact OD1-N 2.97Å; N153-Y155 HydrophobicContact CB-CD2 4.45Å; N153-Y155 HydrophobicContact CB-CE1 4.19Å; N153-Y155 HydrophobicContact CB-CE2 3.69Å; N153-Y155 WeakPolarHBondContact CB-OH 3.21Å; N153-Y155 PolarHBondContact ND2-OH 3.35Å
154	L	97.9	Very high	96.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.9	165.9	-50.7	171.9	0	0	0	108.2	I111 L112 K114 T126 K149 F385 F388	I111-L154 WeakPolarHBondContact CA-O 3.49Å; L112-L154 HydrophobicContact CB-CB 4.28Å; L112-L154 PolarHBondContact N-O 2.88Å; L112-L154 PolarHBondContact O-N 3.19Å; K114-L154 HydrophobicContact CD-CD2 4.25Å; K114-L154 HydrophobicContact CG-CD2 3.91Å; K114-L154 HydrophobicContact CG-CG 3.85Å; T126-L154 HydrophobicContact CG2-CD1 3.65Å; K149-L154 HydrophobicContact CB-CD2 3.8Å; K149-L154 HydrophobicContact CD-CD2 4.46Å; L154-F385 HydrophobicContact CD1-CD1 3.55Å; L154-F385 HydrophobicContact CD1-CD2 4.39Å; L154-F385 HydrophobicContact CD1-CE1 3.56Å; L154-F385 HydrophobicContact CD1-CE2 4.4Å; L154-F385 HydrophobicContact CD1-CG 3.99Å; L154-F385 HydrophobicContact CD1-CZ 4Å; L154-F385 HydrophobicContact CD2-CB 3.98Å; L154-F385 HydrophobicContact CD2-CD1 4.28Å; L154-F385 HydrophobicContact CD2-CD2 4.39Å; L154-F385 HydrophobicContact CD2-CG 3.96Å; L154-F388 HydrophobicContact CB-CD1 4.44Å; L154-F388 HydrophobicContact CB-CD2 4.3Å; L154-F388 HydrophobicContact CB-CE1 3.98Å; L154-F388 HydrophobicContact CB-CE2 3.83Å; L154-F388 HydrophobicContact CB-CZ 3.66Å; L154-F388 HydrophobicContact CD1-CD2 3.84Å; L154-F388 HydrophobicContact CD1-CE2 3.9Å; L154-F388 HydrophobicContact CD1-CG 4.45Å; L154-F388 HydrophobicContact CD2-CB 4.24Å; L154-F388 HydrophobicContact CD2-CD1 3.98Å; L154-F388 HydrophobicContact CD2-CD2 4.04Å; L154-F388 HydrophobicContact CD2-CE1 4.37Å; L154-F388 HydrophobicContact CD2-CE2 4.42Å; L154-F388 HydrophobicContact CD2-CG 3.81Å; L154-F388 HydrophobicContact CG-CD2 4.27Å; L154-F388 HydrophobicContact CG-CE2 4.26Å; L154-F388 HydrophobicContact CG-CZ 4.48Å
155	Y	98.1	Very high	96.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	124.7	-175.8	-57.3	-89.3	0	0	0	110.3	L78 M109 K110 I111 S147 F148 D150 N153 L373	L78-Y155 HydrophobicContact CD1-CD1 4.29Å; L78-Y155 HydrophobicContact CD1-CE1 3.74Å; M109-Y155 HydrophobicContact CG-CD1 4.17Å; M109-Y155 HydrophobicContact SD-CD1 3.74Å; M109-Y155 HydrophobicContact SD-CE1 4.28Å; K110-Y155 WeakPolarHBondContact O-CA 3.5Å; I111-Y155 HydrophobicContact CB-CD1 4.42Å; I111-Y155 HydrophobicContact CB-CE1 4.39Å; I111-Y155 HydrophobicContact CD1-CE1 4.41Å; I111-Y155 HydrophobicContact CG1-CD1 3.96Å; I111-Y155 HydrophobicContact CG1-CE1 4.04Å; I111-Y155 HydrophobicContact CG2-CD1 4.14Å; I111-Y155 HydrophobicContact CG2-CE1 3.71Å; S147-Y155 VanDerWaalsContact CA-O 3.27Å; S147-Y155 WeakPolarHBondContact CA-O 3.26Å; F148-Y155 AromaticContact CD2-CD2 3.37Å; F148-Y155 HydrophobicContact CD2-CD2 3.37Å; F148-Y155 HydrophobicContact CD2-CE2 4.12Å; F148-Y155 AromaticContact CD2-CG 3.74Å; F148-Y155 HydrophobicContact CD2-CG 3.74Å; F148-Y155 HydrophobicContact CE1-CG 4.49Å; F148-Y155 AromaticContact CE2-CD1 3.91Å; F148-Y155 HydrophobicContact CE2-CD1 3.91Å; F148-Y155 AromaticContact CE2-CD2 3.25Å; F148-Y155 HydrophobicContact CE2-CD2 3.25Å; F148-Y155 HydrophobicContact CE2-CE1 4.44Å; F148-Y155 AromaticContact CE2-CE2 3.85Å; F148-Y155 HydrophobicContact CE2-CE2 3.85Å; F148-Y155 AromaticContact CE2-CG 3.27Å; F148-Y155 HydrophobicContact CE2-CG 3.27Å; F148-Y155 HydrophobicContact CG-CD2 4.34Å; F148-Y155 HydrophobicContact CZ-CD1 4.14Å; F148-Y155 HydrophobicContact CZ-CD2 4.17Å; F148-Y155 AromaticContact CZ-CG 3.72Å; F148-Y155 HydrophobicContact CZ-CG 3.72Å; F148-Y155 PolarHBondContact N-O 3.32Å; F148-Y155 VanDerWaalsContact N-O 3.09Å; F148-Y155 WeakPolarHBondContact O-CB 3.31Å; F148-Y155 PolarHBondContact O-N 2.83Å; D150-Y155 HydrophobicContact CB-CE2 4.16Å; D150-Y155 VanDerWaalsContact OD2-CE2 3.24Å; D150-Y155 WeakPolarHBondContact OD2-CE2 3.28Å; D150-Y155 VanDerWaalsContact OD2-CZ 3.26Å; D150-Y155 PolarHBondContact OD2-OH 2.97Å; N153-Y155 HydrophobicContact CB-CD2 4.45Å; N153-Y155 HydrophobicContact CB-CE1 4.19Å; N153-Y155 HydrophobicContact CB-CE2 3.69Å; N153-Y155 WeakPolarHBondContact CB-OH 3.21Å; N153-Y155 PolarHBondContact ND2-OH 3.35Å; Y155-L373 HydrophobicContact CE1-CD2 4.05Å
156	M	97.9	Very high	96.8	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.5	168	-65.2	179.9	-81.2	0	0	108.3	K110 L112 E129 K130 L133 M144 F388	K110-M156 HydrophobicContact CB-CB 4.36Å; K110-M156 HydrophobicContact CD-CE 3.84Å; K110-M156 HydrophobicContact CG-CE 4.21Å; K110-M156 PolarHBondContact N-O 3.49Å; K110-M156 PolarHBondContact O-N 2.82Å; L112-M156 HydrophobicContact CD1-CE 3.58Å; E129-M156 HydrophobicContact CG-CE 4.41Å; E129-M156 HydrophobicContact CG-SD 4.31Å; K130-M156 HydrophobicContact CB-SD 3.97Å; K130-M156 HydrophobicContact CG-CG 4.49Å; K130-M156 HydrophobicContact CG-SD 4.43Å; L133-M156 HydrophobicContact CD1-SD 4.09Å; M144-M156 HydrophobicContact SD-CB 3.82Å; M144-M156 HydrophobicContact SD-CG 3.8Å; M144-M156 HydrophobicContact SD-SD 4.26Å; M156-F388 HydrophobicContact CG-CZ 3.83Å
157	V	98.1	Very high	96.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	103.1	-178	-172.5	0	0	0	0	108.7	F81 Y107 M109 T145 F146 F148	F81-V157 HydrophobicContact CE1-CG1 3.95Å; F81-V157 HydrophobicContact CE2-CG2 4.37Å; F81-V157 HydrophobicContact CZ-CG1 4.19Å; F81-V157 HydrophobicContact CZ-CG2 4.08Å; Y107-V157 VanDerWaalsContact CB-CG1 3.42Å; Y107-V157 HydrophobicContact CD1-CG1 3.96Å; Y107-V157 HydrophobicContact CD2-CG1 4.34Å; Y107-V157 HydrophobicContact CG-CG1 3.66Å; M109-V157 HydrophobicContact CE-CG2 3.89Å; M109-V157 HydrophobicContact CG-CG2 4.22Å; T145-V157 PolarHBondContact N-O 2.98Å; F146-V157 HydrophobicContact CB-CB 3.89Å; F146-V157 HydrophobicContact CB-CG2 4.03Å; F146-V157 HydrophobicContact CD2-CB 4.02Å; F146-V157 HydrophobicContact CD2-CG1 3.88Å; F146-V157 HydrophobicContact CG-CB 4.47Å; F146-V157 PolarHBondContact N-O 3.21Å; F146-V157 PolarHBondContact O-N 2.86Å; F148-V157 HydrophobicContact CE1-CG2 3.75Å; F148-V157 HydrophobicContact CZ-CG2 4.48Å
158	L	97.7	Very high	96.4	Very high	11 Å²	11	18.2 Å²	18.2	6%	0.058	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	155.9	-176.2	-54.1	169.2	0	0	0	110.2	Y107 A108 L133 V142 N143 M144 F160	Y107-L158 CarbonylContact C-O 3.6Å; Y107-L158 WeakPolarHBondContact CA-O 3.43Å; Y107-L158 WeakPolarHBondContact CB-O 3.24Å; Y107-L158 WeakPolarHBondContact CD1-O 3.27Å; A108-L158 HydrophobicContact CB-CB 4.47Å; A108-L158 PolarHBondContact N-O 3.04Å; A108-L158 WeakPolarHBondContact O-CB 3.27Å; A108-L158 PolarHBondContact O-N 3.33Å; L133-L158 HydrophobicContact CD1-CD2 4.17Å; V142-L158 HydrophobicContact CG1-CD1 4.49Å; V142-L158 HydrophobicContact CG1-CD2 4.31Å; V142-L158 HydrophobicContact CG2-CB 4.22Å; N143-L158 CarbonylContact O-C 3.59Å; N143-L158 WeakPolarHBondContact O-CA 3.38Å; M144-L158 HydrophobicContact CB-CD2 3.72Å; M144-L158 HydrophobicContact CG-CD2 3.95Å; L158-F160 PolarHBondContact O-N 2.96Å
159	E	96.3	Very high	96.1	Very high	44 Å²	44	18.3 Å²	18.3	21%	0.206	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	139.6	167.7	65.3	178.5	132.3	0	0	110.9	V142 N143 I161 K219	V142-E159 WeakPolarHBondContact CA-OE1 3.25Å; V142-E159 HydrophobicContact CG2-CG 3.52Å; N143-E159 HydrophobicContact CB-CG 4.41Å; N143-E159 WeakPolarHBondContact CB-OE1 3.4Å; N143-E159 PolarHBondContact N-OE1 3.3Å; N143-E159 PolarHBondContact O-N 3.48Å; E159-I161 HydrophobicContact CG-CD1 3.71Å; E159-I161 HydrophobicContact CG-CG1 4.37Å; E159-K219 WeakPolarHBondContact OE1-CE 3.27Å; E159-K219 IonicContact OE1-NZ 3.02Å; E159-K219 PolarHBondContact OE1-NZ 2.82Å; E159-K219 IonicContact OE2-NZ 2.92Å; E159-K219 PolarHBondContact OE2-NZ 3.4Å
160	F	97.1	Very high	96.1	Very high	27 Å²	27	16.1 Å²	16.1	12%	0.118	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-85.1	122.9	176.9	174.2	-122.3	0	0	0	110.7	L87 L97 L158 P359 D361 A362 F365	L87-F160 HydrophobicContact CD1-CD2 3.76Å; L87-F160 HydrophobicContact CD1-CE2 3.67Å; L87-F160 HydrophobicContact CD2-CE2 3.94Å; L87-F160 HydrophobicContact CG-CE2 4.48Å; L97-F160 HydrophobicContact CD1-CB 4.34Å; L97-F160 HydrophobicContact CD1-CD1 3.75Å; L97-F160 HydrophobicContact CD1-CD2 3.86Å; L97-F160 HydrophobicContact CD1-CE1 3.95Å; L97-F160 HydrophobicContact CD1-CE2 4.07Å; L97-F160 HydrophobicContact CD1-CG 3.7Å; L97-F160 HydrophobicContact CD1-CZ 4.11Å; L158-F160 PolarHBondContact O-N 2.96Å; F160-P359 WeakPolarHBondContact CD1-O 3.48Å; F160-D361 WeakPolarHBondContact CE1-O 3.37Å; F160-D361 WeakPolarHBondContact CZ-O 3.42Å; F160-A362 HydrophobicContact CZ-CB 4.31Å; F160-F365 HydrophobicContact CE2-CD2 4.38Å; F160-F365 AromaticContact CE2-CE2 3.68Å; F160-F365 HydrophobicContact CE2-CE2 3.68Å; F160-F365 HydrophobicContact CE2-CZ 4.15Å; F160-F365 AromaticContact CZ-CE2 4Å; F160-F365 HydrophobicContact CZ-CE2 4Å
161	I	96.5	Very high	96	Very high	9 Å²	9	20.1 Å²	20.1	5%	0.046	10%	0.099	C	C	.	.			trans	-106.4	105.8	178.8	-52.3	-51.9	0	0	0	109	V142 E159 G163 L211 I212 D213 K219 F365	V142-I161 HydrophobicContact CG2-CG1 4.37Å; E159-I161 HydrophobicContact CG-CD1 3.71Å; E159-I161 HydrophobicContact CG-CG1 4.37Å; I161-G163 PolarHBondContact O-N 2.87Å; I161-L211 HydrophobicContact CB-CB 3.96Å; I161-L211 HydrophobicContact CB-CD1 3.9Å; I161-L211 HydrophobicContact CG1-CB 4.47Å; I161-L211 HydrophobicContact CG1-CD1 4.16Å; I161-L211 HydrophobicContact CG2-CB 3.6Å; I161-L211 HydrophobicContact CG2-CD1 4.49Å; I161-I212 VanDerWaalsContact CG2-O 3.27Å; I161-I212 WeakPolarHBondContact CG2-O 3.47Å; I161-D213 HydrophobicContact CG2-CB 4.02Å; I161-K219 HydrophobicContact CD1-CB 4.17Å; I161-K219 HydrophobicContact CD1-CD 4.2Å; I161-K219 HydrophobicContact CD1-CG 3.64Å; I161-K219 HydrophobicContact CG1-CB 3.88Å; I161-K219 HydrophobicContact CG1-CG 3.94Å; I161-K219 HydrophobicContact CG2-CB 4.34Å; I161-K219 HydrophobicContact CG2-CG 4.42Å; I161-F365 WeakPolarHBondContact O-CE2 3.47Å; I161-F365 WeakPolarHBondContact O-CZ 3.26Å
162	S	93.7	Very high	95.8	Very high	12 Å²	12	25.3 Å²	25.3	8%	0.084	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.9	-165.3	55.6	0	0	0	0	116	G164 C356 N364	S162-G164 VanDerWaalsContact C-N 3.32Å; S162-G164 PolarHBondContact O-N 3.04Å; S162-C356 PolarHBondContact OG-SG 3.05Å; S162-C356 VanDerWaalsContact OG-SG 3.34Å; S162-N364 PolarHBondContact O-ND2 3.06Å
163	G	93.5	Very high	95.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.2	-174.3	0	0	0	0	0	114.8	I161 H169 I212 N364	I161-G163 PolarHBondContact O-N 2.87Å; G163-H169 PolarHBondContact O-CE1 2.62Å; G163-H169 PolarHBondContact O-NE2 2.94Å; G163-I212 CarbonylContact C-O 3.49Å; G163-I212 WeakPolarHBondContact CA-O 3.24Å; G163-I212 PolarHBondContact N-O 2.83Å; G163-N364 WeakPolarHBondContact O-CB 3.29Å
164	G	92.7	Very high	95.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.			trans	85.1	-171.4	179.8	0	0	0	0	0	113.5	S162 L211 I212	S162-G164 VanDerWaalsContact C-N 3.32Å; S162-G164 PolarHBondContact O-N 3.04Å; G164-L211 CarbonylContact O-C 3.54Å; G164-L211 WeakPolarHBondContact O-CA 3.38Å; G164-I212 PolarHBondContact O-N 3.22Å
165	E	94	Very high	95.6	Very high	37 Å²	37	35.8 Å²	35.8	17%	0.173	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-81.9	139.5	-173.8	-62.6	169	-172.2	0	0	112.6	F167 S168 H169 L211	E165-F167 HydrophobicContact CB-CB 4.38Å; E165-F167 PolarHBondContact O-N 3.31Å; E165-S168 PolarHBondContact O-N 3.2Å; E165-H169 PolarHBondContact O-CD2 3.21Å; E165-H169 PolarHBondContact O-N 3.34Å; E165-L211 HydrophobicContact CG-CD2 3.82Å
166	M	96.8	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.4	-37.4	170.4	179.7	-172.5	-68.9	0	0	110.8	S168 H169 L170 F176 Y184 P207 L210 L218 L265 M269	M166-S168 PolarHBondContact O-N 3.19Å; M166-H169 PolarHBondContact O-N 3.17Å; M166-L170 WeakPolarHBondContact O-CB 3.16Å; M166-L170 PolarHBondContact O-N 2.96Å; M166-F176 HydrophobicContact CG-CE2 3.93Å; M166-F176 HydrophobicContact CG-CZ 4.19Å; M166-F176 HydrophobicContact SD-CE2 4.16Å; M166-Y184 HydrophobicContact CE-CD1 4.26Å; M166-Y184 HydrophobicContact CE-CD2 3.59Å; M166-Y184 HydrophobicContact CE-CE2 4.13Å; M166-Y184 HydrophobicContact CE-CG 3.68Å; M166-P207 HydrophobicContact CB-CB 4.4Å; M166-P207 HydrophobicContact CG-CB 4.35Å; M166-P207 HydrophobicContact SD-CB 4.42Å; M166-L210 HydrophobicContact CB-CB 3.98Å; M166-L210 WeakPolarHBondContact CB-O 3.33Å; M166-L210 HydrophobicContact CE-CB 4.2Å; M166-L210 HydrophobicContact CE-CD1 3.73Å; M166-L210 PolarHBondContact N-O 3.46Å; M166-L210 HydrophobicContact SD-CD1 3.87Å; M166-L218 HydrophobicContact CE-CD1 3.7Å; M166-L218 HydrophobicContact CE-CD2 3.41Å; M166-L218 VanDerWaalsContact CE-CD2 3.41Å; M166-L218 HydrophobicContact CE-CG 4.19Å; M166-L265 HydrophobicContact SD-CD1 4.45Å; M166-M269 HydrophobicContact CE-SD 4.15Å; M166-M269 HydrophobicContact SD-CG 4.17Å; M166-M269 HydrophobicContact SD-SD 3.82Å
167	F	94.8	Very high	95.7	Very high	36 Å²	36	39.3 Å²	39.3	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-50.6	-56.7	177.9	-178.8	-96.2	0	0	0	112.3	L5 E165 H169 L170 R171 P207 E208	L5-F167 HydrophobicContact CD1-CE1 4.49Å; E165-F167 HydrophobicContact CB-CB 4.38Å; E165-F167 PolarHBondContact O-N 3.31Å; F167-H169 VanDerWaalsContact C-N 3.28Å; F167-H169 PolarHBondContact O-N 3.39Å; F167-L170 PolarHBondContact O-N 2.96Å; F167-R171 HydrophobicContact CD1-CG 4.22Å; F167-R171 HydrophobicContact CD2-CG 4.38Å; F167-R171 HydrophobicContact CE1-CG 3.93Å; F167-R171 HydrophobicContact CE2-CG 4.12Å; F167-R171 HydrophobicContact CG-CG 4.44Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 WeakPolarHBondContact O-CB 3.16Å; F167-R171 VanDerWaalsContact O-CG 3.27Å; F167-R171 WeakPolarHBondContact O-CG 3.24Å; F167-R171 PolarHBondContact O-N 3.46Å; F167-P207 HydrophobicContact CB-CB 3.86Å; F167-P207 HydrophobicContact CD2-CB 4.25Å; F167-P207 PolarHBondContact N-O 3.29Å; F167-P207 VanDerWaalsContact N-O 3.16Å; F167-E208 HydrophobicContact CB-CG 3.98Å; F167-E208 VanDerWaalsContact CD2-CD 3.48Å; F167-E208 HydrophobicContact CD2-CG 3.78Å; F167-E208 HydrophobicContact CE2-CG 4.39Å; F167-E208 WeakPolarHBondContact CE2-OE1 3.35Å; F167-E208 HydrophobicContact CG-CG 3.85Å
168	S	92.2	Very high	95.7	Very high	47 Å²	47	40.9 Å²	40.9	33%	0.329	20%	0.2	S	C	.	.	H	α-helix	trans	-59.9	-38.6	-179.6	-69.2	0	0	0	0	112.1	E165 M166 R172	E165-S168 PolarHBondContact O-N 3.2Å; M166-S168 PolarHBondContact O-N 3.19Å; S168-R172 VanDerWaalsContact O-CB 3.26Å; S168-R172 WeakPolarHBondContact O-CB 3.38Å; S168-R172 PolarHBondContact O-N 2.92Å; S168-R172 VanDerWaalsContact O-N 3.08Å
169	H	93	Very high	95.7	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.032	22%	0.223	C	C	.	.	H	α-helix	trans	-68.3	-45.9	175.8	-64.2	-44.9	0	0	0	113.3	G163 E165 M166 F167 R172 I173 I212 F352	G163-H169 PolarHBondContact O-CE1 2.62Å; G163-H169 PolarHBondContact O-NE2 2.94Å; E165-H169 PolarHBondContact O-CD2 3.21Å; E165-H169 PolarHBondContact O-N 3.34Å; M166-H169 PolarHBondContact O-N 3.17Å; F167-H169 VanDerWaalsContact C-N 3.28Å; F167-H169 PolarHBondContact O-N 3.39Å; H169-R172 PolarHBondContact ND1-NH2 3.14Å; H169-R172 PolarHBondContact O-N 2.89Å; H169-I173 WeakPolarHBondContact O-CG1 3.42Å; H169-I173 PolarHBondContact O-N 2.63Å; H169-I212 VanDerWaalsContact CD2-CD1 3.45Å; H169-I212 WeakPolarHBondContact CD2-CD1 3.41Å; H169-F352 AromaticContact CD2-CE1 3.87Å; H169-F352 AromaticContact CE1-CE1 3.83Å; H169-F352 AromaticContact CE1-CZ 3.76Å; H169-F352 AromaticContact ND1-CZ 3.87Å; H169-F352 AromaticContact NE2-CE1 3.69Å
170	L	96.7	Very high	95.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-46.5	178.8	179	59.5	0	0	0	110.6	M166 F167 R172 I173 G174 F176 P207 E268	M166-L170 WeakPolarHBondContact O-CB 3.16Å; M166-L170 PolarHBondContact O-N 2.96Å; F167-L170 PolarHBondContact O-N 2.96Å; L170-R172 VanDerWaalsContact C-N 3.35Å; L170-R172 PolarHBondContact O-N 3.42Å; L170-I173 PolarHBondContact O-N 3.04Å; L170-G174 CarbonylContact O-C 3.57Å; L170-G174 WeakPolarHBondContact O-CA 3.09Å; L170-G174 PolarHBondContact O-N 2.9Å; L170-F176 HydrophobicContact CB-CE1 4.29Å; L170-F176 HydrophobicContact CB-CE2 4.27Å; L170-F176 HydrophobicContact CB-CZ 3.83Å; L170-F176 HydrophobicContact CD1-CD1 4.06Å; L170-F176 HydrophobicContact CD1-CD2 4.05Å; L170-F176 HydrophobicContact CD1-CE1 4.04Å; L170-F176 HydrophobicContact CD1-CE2 4.04Å; L170-F176 HydrophobicContact CD1-CG 4.05Å; L170-F176 HydrophobicContact CD1-CZ 4.03Å; L170-P207 HydrophobicContact CD2-CG 4.32Å; L170-E268 HydrophobicContact CD2-CG 4.05Å
171	R	95.5	Very high	95.9	Very high	113 Å²	113	41.8 Å²	41.8	43%	0.426	21%	0.212	S	C	.	.	H	α-helix	trans	-63.5	-39	178.3	-66.9	-68.7	166.2	-157.7	-3.6	112.4	F167 E268 G272	F167-R171 HydrophobicContact CD1-CG 4.22Å; F167-R171 HydrophobicContact CD2-CG 4.38Å; F167-R171 HydrophobicContact CE1-CG 3.93Å; F167-R171 HydrophobicContact CE2-CG 4.12Å; F167-R171 HydrophobicContact CG-CG 4.44Å; F167-R171 HydrophobicContact CZ-CG 3.88Å; F167-R171 WeakPolarHBondContact O-CB 3.16Å; F167-R171 VanDerWaalsContact O-CG 3.27Å; F167-R171 WeakPolarHBondContact O-CG 3.24Å; F167-R171 PolarHBondContact O-N 3.46Å; R171-E268 IonicContact CZ-OE1 3.74Å; R171-E268 IonicContact NH2-OE1 2.71Å; R171-E268 PolarHBondContact NH2-OE1 3.21Å; R171-G272 PolarHBondContact NH1-O 3.26Å
172	R	93.8	Very high	96	Very high	164 Å²	164	43.2 Å²	43.2	62%	0.619	22%	0.217	S	C	*	.	H	α-helix	trans	-67.4	-41.7	177.1	-177.3	176.9	64.7	-168.3	-1.1	112.9	S168 H169 L170	S168-R172 VanDerWaalsContact O-CB 3.26Å; S168-R172 WeakPolarHBondContact O-CB 3.38Å; S168-R172 PolarHBondContact O-N 2.92Å; S168-R172 VanDerWaalsContact O-N 3.08Å; H169-R172 PolarHBondContact ND1-NH2 3.14Å; H169-R172 PolarHBondContact O-N 2.89Å; L170-R172 VanDerWaalsContact C-N 3.35Å; L170-R172 PolarHBondContact O-N 3.42Å
173	I	94.7	Very high	96.2	Very high	89 Å²	89	43.3 Å²	43.3	46%	0.456	22%	0.215	S	C	.	.	H	α-helix	trans	-81.7	-22	-178.9	-65.5	171.4	0	0	0	111.1	H169 L170 R175 F176	H169-I173 WeakPolarHBondContact O-CG1 3.42Å; H169-I173 PolarHBondContact O-N 2.63Å; L170-I173 PolarHBondContact O-N 3.04Å; I173-R175 VanDerWaalsContact C-N 3.33Å; I173-R175 WeakPolarHBondContact CG2-O 3.39Å; I173-R175 PolarHBondContact O-N 3.11Å; I173-F176 HydrophobicContact CD1-CE1 4.15Å
174	G	97.6	Very high	96.5	Very high	39 Å²	39	43.4 Å²	43.4	40%	0.402	22%	0.216	S	C	.	.	S	Bend	trans	92.8	-55.2	-176.8	0	0	0	0	0	111.5	L170 G272	L170-G174 CarbonylContact O-C 3.57Å; L170-G174 WeakPolarHBondContact O-CA 3.09Å; L170-G174 PolarHBondContact O-N 2.9Å; G174-G272 WeakPolarHBondContact O-CA 3.27Å
175	R	97.8	Very high	96.7	Very high	116 Å²	116	43.4 Å²	43.4	44%	0.438	22%	0.216	S	C	.	.			trans	-157.4	154	174.7	63.5	-178.2	175.5	137.9	-7.7	111.3	I173 H298	I173-R175 VanDerWaalsContact C-N 3.33Å; I173-R175 WeakPolarHBondContact CG2-O 3.39Å; I173-R175 PolarHBondContact O-N 3.11Å; R175-H298 PolarHBondContact NH1-CD2 2.86Å; R175-H298 PolarHBondContact NH1-CE1 3.48Å; R175-H298 PolarHBondContact NH1-ND1 2.9Å; R175-H298 PolarHBondContact NH1-NE2 3.1Å
176	F	98.3	Very high	97	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.026	21%	0.207	C	C	.	.			trans	-85.3	153.7	170.5	-60.2	-26.2	0	0	0	111.2	M166 L170 I173 H180 Y184 M269	M166-F176 HydrophobicContact CG-CE2 3.93Å; M166-F176 HydrophobicContact CG-CZ 4.19Å; M166-F176 HydrophobicContact SD-CE2 4.16Å; L170-F176 HydrophobicContact CB-CE1 4.29Å; L170-F176 HydrophobicContact CB-CE2 4.27Å; L170-F176 HydrophobicContact CB-CZ 3.83Å; L170-F176 HydrophobicContact CD1-CD1 4.06Å; L170-F176 HydrophobicContact CD1-CD2 4.05Å; L170-F176 HydrophobicContact CD1-CE1 4.04Å; L170-F176 HydrophobicContact CD1-CE2 4.04Å; L170-F176 HydrophobicContact CD1-CG 4.05Å; L170-F176 HydrophobicContact CD1-CZ 4.03Å; I173-F176 HydrophobicContact CD1-CE1 4.15Å; F176-H180 HydrophobicContact CB-CB 4.03Å; F176-H180 AromaticContact CD1-CE1 3.66Å; F176-H180 AromaticContact CD1-ND1 3.74Å; F176-H180 AromaticContact CE1-CE1 3.94Å; F176-H180 AromaticContact CG-CG 3.98Å; F176-H180 AromaticContact CG-ND1 3.87Å; F176-Y184 AromaticContact CD2-CD2 4Å; F176-Y184 HydrophobicContact CD2-CD2 4Å; F176-Y184 HydrophobicContact CD2-CE2 4.06Å; F176-Y184 AromaticContact CE2-CD2 3.82Å; F176-Y184 HydrophobicContact CE2-CD2 3.82Å; F176-Y184 AromaticContact CE2-CE2 3.66Å; F176-Y184 HydrophobicContact CE2-CE2 3.66Å; F176-Y184 HydrophobicContact CZ-CE2 4.17Å; F176-M269 HydrophobicContact CD2-CB 3.93Å; F176-M269 HydrophobicContact CD2-CG 3.89Å; F176-M269 HydrophobicContact CD2-SD 4.06Å; F176-M269 HydrophobicContact CE2-CG 4.21Å; F176-M269 HydrophobicContact CE2-SD 4.32Å; F176-M269 PolarHBondContact N-O 2.83Å
177	S	98.3	Very high	97.1	Very high	69 Å²	69	41.6 Å²	41.6	48%	0.483	21%	0.207	S	C	.	.			trans	-67.6	161.8	167.7	69.4	0	0	0	0	110.1	H180 S181	S177-H180 PolarHBondContact O-N 3.49Å; S177-H180 VanDerWaalsContact OG-CB 3.32Å; S177-H180 WeakPolarHBondContact OG-CB 3.37Å; S177-H180 PolarHBondContact OG-N 3.34Å; S177-S181 WeakPolarHBondContact O-CB 3.45Å; S177-S181 PolarHBondContact O-N 3.14Å; S177-S181 PolarHBondContact O-OG 2.88Å
178	E	98.5	Very high	97.3	Very high	32 Å²	32	40 Å²	40	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-42.3	176.2	-67.1	-166.3	-154.8	0	0	113.3	H180 S181 R182 S300 L303 W334	E178-H180 VanDerWaalsContact C-N 3.33Å; E178-H180 PolarHBondContact O-N 3.39Å; E178-S181 PolarHBondContact O-N 3.1Å; E178-R182 VanDerWaalsContact O-CB 3.27Å; E178-R182 WeakPolarHBondContact O-CB 3.4Å; E178-R182 PolarHBondContact O-N 3.34Å; E178-S300 WeakPolarHBondContact OE1-CB 3.25Å; E178-S300 PolarHBondContact OE1-N 3.34Å; E178-S300 PolarHBondContact OE1-OG 3.27Å; E178-S300 WeakPolarHBondContact OE2-CB 3.17Å; E178-S300 PolarHBondContact OE2-OG 2.92Å; E178-L303 HydrophobicContact CG-CD2 3.96Å; E178-W334 HydrophobicContact CB-CZ2 4.36Å; E178-W334 PolarHBondContact OE2-NE1 2.8Å
179	P	98.3	Very high	97.6	Very high	82 Å²	82	37.7 Å²	37.7	53%	0.532	19%	0.185	S	C	.	.	H	α-helix	trans	-59.1	-40.4	172.8	-25.6	35.6	0	0	0	113.9	R182 F183	P179-R182 PolarHBondContact O-N 3.2Å; P179-F183 PolarHBondContact O-N 2.95Å
180	H	97.9	Very high	97.8	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.093	18%	0.183	C	C	.	.	H	α-helix	trans	-66.3	-46.6	176.6	-173	167.4	0	0	0	111.1	F176 S177 E178 R182 F183 Y184 P351	F176-H180 HydrophobicContact CB-CB 4.03Å; F176-H180 AromaticContact CD1-CE1 3.66Å; F176-H180 AromaticContact CD1-ND1 3.74Å; F176-H180 AromaticContact CE1-CE1 3.94Å; F176-H180 AromaticContact CG-CG 3.98Å; F176-H180 AromaticContact CG-ND1 3.87Å; S177-H180 PolarHBondContact O-N 3.49Å; S177-H180 VanDerWaalsContact OG-CB 3.32Å; S177-H180 WeakPolarHBondContact OG-CB 3.37Å; S177-H180 PolarHBondContact OG-N 3.34Å; E178-H180 VanDerWaalsContact C-N 3.33Å; E178-H180 PolarHBondContact O-N 3.39Å; H180-R182 VanDerWaalsContact C-N 3.27Å; H180-R182 PolarHBondContact O-N 3.43Å; H180-F183 WeakPolarHBondContact O-CB 3.12Å; H180-F183 PolarHBondContact O-N 2.8Å; H180-Y184 AromaticContact CD2-CD2 3.72Å; H180-Y184 AromaticContact CD2-CE2 3.24Å; H180-Y184 WeakPolarHBondContact CD2-CE2 3.48Å; H180-Y184 AromaticContact CD2-CZ 3.77Å; H180-Y184 AromaticContact NE2-CD2 3.94Å; H180-Y184 AromaticContact NE2-CE2 3Å; H180-Y184 WeakPolarHBondContact NE2-CE2 3.2Å; H180-Y184 AromaticContact NE2-CZ 3.35Å; H180-Y184 VanDerWaalsContact NE2-CZ 3.35Å; H180-Y184 PolarHBondContact NE2-OH 2.92Å; H180-Y184 VanDerWaalsContact NE2-OH 3.15Å; H180-Y184 PolarHBondContact O-N 2.9Å; H180-P351 HydrophobicContact CB-CB 4.13Å; H180-P351 HydrophobicContact CB-CG 4.23Å; H180-P351 WeakPolarHBondContact CD2-CG 3.46Å
181	S	98.6	Very high	97.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-39.7	175.3	-54.6	0	0	0	0	111.6	S177 E178 Y184 A185 M269	S177-S181 WeakPolarHBondContact O-CB 3.45Å; S177-S181 PolarHBondContact O-N 3.14Å; S177-S181 PolarHBondContact O-OG 2.88Å; E178-S181 PolarHBondContact O-N 3.1Å; S181-Y184 PolarHBondContact O-N 3.39Å; S181-A185 WeakPolarHBondContact O-CB 3.42Å; S181-A185 PolarHBondContact O-N 3.28Å; S181-M269 WeakPolarHBondContact O-CE 3.47Å
182	R	98.7	Very high	98	Very high	39 Å²	39	32 Å²	32	15%	0.147	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-42.3	177.8	-174.9	-173.4	-59	116.5	7.8	112.5	E178 P179 H180 Y184 A185 A186 W334 F335 T338	E178-R182 VanDerWaalsContact O-CB 3.27Å; E178-R182 WeakPolarHBondContact O-CB 3.4Å; E178-R182 PolarHBondContact O-N 3.34Å; P179-R182 PolarHBondContact O-N 3.2Å; H180-R182 VanDerWaalsContact C-N 3.27Å; H180-R182 PolarHBondContact O-N 3.43Å; R182-Y184 VanDerWaalsContact C-N 3.32Å; R182-Y184 PolarHBondContact O-N 2.98Å; R182-A185 PolarHBondContact O-N 3.42Å; R182-A186 WeakPolarHBondContact O-CB 3.22Å; R182-A186 PolarHBondContact O-N 3.26Å; R182-W334 HydrophobicContact CB-CE3 4.48Å; R182-W334 HydrophobicContact CB-CH2 3.61Å; R182-W334 HydrophobicContact CB-CZ2 3.96Å; R182-W334 HydrophobicContact CB-CZ3 3.88Å; R182-W334 WeakPolarHBondContact CD-O 3.38Å; R182-W334 HydrophobicContact CG-CE3 4.26Å; R182-W334 HydrophobicContact CG-CH2 4.24Å; R182-W334 HydrophobicContact CG-CZ3 3.99Å; R182-W334 PolarHBondContact NE-O 2.94Å; R182-W334 PolarHBondContact NH2-O 2.86Å; R182-F335 HydrophobicContact CG-CD1 3.69Å; R182-F335 HydrophobicContact CG-CE1 3.89Å; R182-T338 WeakPolarHBondContact CD-OG1 3.44Å
183	F	98.7	Very high	98.2	Very high	14 Å²	14	25.8 Å²	25.8	6%	0.061	14%	0.141	C	C	.	.	H	α-helix	trans	-57.1	-45.6	176.8	172.1	-98.6	0	0	0	111.8	P179 H180 Q187 Y217 I343 I348 A350 P351	P179-F183 PolarHBondContact O-N 2.95Å; H180-F183 WeakPolarHBondContact O-CB 3.12Å; H180-F183 PolarHBondContact O-N 2.8Å; F183-Q187 VanDerWaalsContact CD1-NE2 3.29Å; F183-Q187 PolarHBondContact O-NE2 3.26Å; F183-Y217 AromaticContact CE2-CE1 3.87Å; F183-Y217 HydrophobicContact CE2-CE1 3.87Å; F183-Y217 HydrophobicContact CE2-CE2 4.3Å; F183-Y217 AromaticContact CE2-CZ 3.73Å; F183-Y217 AromaticContact CZ-CD1 3.91Å; F183-Y217 HydrophobicContact CZ-CD1 3.91Å; F183-Y217 HydrophobicContact CZ-CD2 4.07Å; F183-Y217 AromaticContact CZ-CE1 3.68Å; F183-Y217 HydrophobicContact CZ-CE1 3.68Å; F183-Y217 AromaticContact CZ-CE2 3.85Å; F183-Y217 HydrophobicContact CZ-CE2 3.85Å; F183-Y217 HydrophobicContact CZ-CG 4.1Å; F183-Y217 AromaticContact CZ-CZ 3.64Å; F183-I343 HydrophobicContact CD2-CD1 3.67Å; F183-I343 HydrophobicContact CE2-CD1 3.9Å; F183-I348 HydrophobicContact CD2-CG2 3.94Å; F183-I348 HydrophobicContact CE2-CB 4.13Å; F183-I348 HydrophobicContact CE2-CG2 3.95Å; F183-A350 HydrophobicContact CE1-CB 4.03Å; F183-A350 HydrophobicContact CZ-CB 3.81Å; F183-P351 HydrophobicContact CB-CG 4.26Å; F183-P351 HydrophobicContact CD1-CG 3.77Å; F183-P351 HydrophobicContact CE1-CG 4.37Å; F183-P351 HydrophobicContact CG-CG 4.12Å
184	Y	98.7	Very high	98.4	Very high	1 Å²	1	21.7 Å²	21.7	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-71.7	-44	176.1	-70.4	-32.4	0	0	0	112.8	M166 F176 H180 S181 R182 A186 Q187 I188 G216 L218 M269	M166-Y184 HydrophobicContact CE-CD1 4.26Å; M166-Y184 HydrophobicContact CE-CD2 3.59Å; M166-Y184 HydrophobicContact CE-CE2 4.13Å; M166-Y184 HydrophobicContact CE-CG 3.68Å; F176-Y184 AromaticContact CD2-CD2 4Å; F176-Y184 HydrophobicContact CD2-CD2 4Å; F176-Y184 HydrophobicContact CD2-CE2 4.06Å; F176-Y184 AromaticContact CE2-CD2 3.82Å; F176-Y184 HydrophobicContact CE2-CD2 3.82Å; F176-Y184 AromaticContact CE2-CE2 3.66Å; F176-Y184 HydrophobicContact CE2-CE2 3.66Å; F176-Y184 HydrophobicContact CZ-CE2 4.17Å; H180-Y184 AromaticContact CD2-CD2 3.72Å; H180-Y184 AromaticContact CD2-CE2 3.24Å; H180-Y184 WeakPolarHBondContact CD2-CE2 3.48Å; H180-Y184 AromaticContact CD2-CZ 3.77Å; H180-Y184 AromaticContact NE2-CD2 3.94Å; H180-Y184 AromaticContact NE2-CE2 3Å; H180-Y184 WeakPolarHBondContact NE2-CE2 3.2Å; H180-Y184 AromaticContact NE2-CZ 3.35Å; H180-Y184 VanDerWaalsContact NE2-CZ 3.35Å; H180-Y184 PolarHBondContact NE2-OH 2.92Å; H180-Y184 VanDerWaalsContact NE2-OH 3.15Å; H180-Y184 PolarHBondContact O-N 2.9Å; S181-Y184 PolarHBondContact O-N 3.39Å; R182-Y184 VanDerWaalsContact C-N 3.32Å; R182-Y184 PolarHBondContact O-N 2.98Å; Y184-A186 VanDerWaalsContact C-N 3.25Å; Y184-A186 PolarHBondContact O-N 3.43Å; Y184-Q187 WeakPolarHBondContact O-CB 3.17Å; Y184-Q187 PolarHBondContact O-N 2.85Å; Y184-Q187 VanDerWaalsContact O-N 3.1Å; Y184-I188 PolarHBondContact O-N 2.91Å; Y184-G216 WeakPolarHBondContact CE1-O 3.3Å; Y184-L218 HydrophobicContact CD1-CD1 3.81Å; Y184-L218 HydrophobicContact CD1-CD2 3.62Å; Y184-L218 HydrophobicContact CD1-CG 3.56Å; Y184-L218 HydrophobicContact CE1-CD2 3.81Å; Y184-L218 HydrophobicContact CE1-CG 4.14Å; Y184-L218 HydrophobicContact CG-CD1 4.04Å; Y184-L218 HydrophobicContact CG-CD2 4.23Å; Y184-L218 HydrophobicContact CG-CG 4.27Å; Y184-M269 HydrophobicContact CD2-SD 4.04Å; Y184-M269 HydrophobicContact CG-SD 4.46Å
185	A	98.9	Very high	98.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-37.8	178	0	0	0	0	0	112.3	S181 R182 Q187 I188 V189 I266 M269 W334 F335	S181-A185 WeakPolarHBondContact O-CB 3.42Å; S181-A185 PolarHBondContact O-N 3.28Å; R182-A185 PolarHBondContact O-N 3.42Å; A185-Q187 VanDerWaalsContact C-N 3.29Å; A185-Q187 PolarHBondContact O-N 3.24Å; A185-I188 PolarHBondContact O-N 2.96Å; A185-V189 VanDerWaalsContact O-CG2 3.31Å; A185-V189 WeakPolarHBondContact O-CG2 3.5Å; A185-V189 PolarHBondContact O-N 3.4Å; A185-I266 HydrophobicContact CB-CD1 3.85Å; A185-I266 HydrophobicContact CB-CG1 3.69Å; A185-M269 HydrophobicContact CB-CE 4.3Å; A185-W334 HydrophobicContact CB-CH2 4.38Å; A185-W334 HydrophobicContact CB-CZ3 4.11Å; A185-F335 HydrophobicContact CB-CE1 4.05Å; A185-F335 HydrophobicContact CB-CZ 3.83Å
186	A	98.8	Very high	98.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.9	-38.8	177.1	0	0	0	0	0	112.2	R182 Y184 V189 L190 F335 T338 W340 I343	R182-A186 WeakPolarHBondContact O-CB 3.22Å; R182-A186 PolarHBondContact O-N 3.26Å; Y184-A186 VanDerWaalsContact C-N 3.25Å; Y184-A186 PolarHBondContact O-N 3.43Å; A186-V189 PolarHBondContact O-N 3.22Å; A186-L190 WeakPolarHBondContact O-CG 3.32Å; A186-L190 PolarHBondContact O-N 2.86Å; A186-L190 VanDerWaalsContact O-N 3.13Å; A186-F335 HydrophobicContact CB-CE1 4.17Å; A186-T338 HydrophobicContact CB-CG2 3.73Å; A186-W340 HydrophobicContact CB-CE3 4.37Å; A186-W340 HydrophobicContact CB-CH2 4.15Å; A186-W340 HydrophobicContact CB-CZ3 3.75Å; A186-W340 WeakPolarHBondContact O-CZ3 3.3Å; A186-I343 HydrophobicContact CB-CG1 4.25Å; A186-I343 HydrophobicContact CB-CG2 4.27Å
187	Q	98.7	Very high	98.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.1	-41.5	176.9	-65	166.9	65.2	0	0	111.4	F140 F183 Y184 A185 L190 A191 Y217 L218 I343	F140-Q187 HydrophobicContact CD1-CB 4.26Å; F140-Q187 HydrophobicContact CD1-CG 4.14Å; F140-Q187 HydrophobicContact CD2-CB 3.73Å; F140-Q187 HydrophobicContact CD2-CG 4.14Å; F140-Q187 WeakPolarHBondContact CD2-O 3.45Å; F140-Q187 HydrophobicContact CE1-CG 3.97Å; F140-Q187 HydrophobicContact CE2-CB 4Å; F140-Q187 HydrophobicContact CE2-CG 3.96Å; F140-Q187 HydrophobicContact CG-CB 3.9Å; F140-Q187 HydrophobicContact CG-CG 4.25Å; F140-Q187 HydrophobicContact CZ-CB 4.39Å; F140-Q187 HydrophobicContact CZ-CG 3.88Å; F183-Q187 VanDerWaalsContact CD1-NE2 3.29Å; F183-Q187 PolarHBondContact O-NE2 3.26Å; Y184-Q187 WeakPolarHBondContact O-CB 3.17Å; Y184-Q187 PolarHBondContact O-N 2.85Å; Y184-Q187 VanDerWaalsContact O-N 3.1Å; A185-Q187 VanDerWaalsContact C-N 3.29Å; A185-Q187 PolarHBondContact O-N 3.24Å; Q187-L190 PolarHBondContact O-N 2.87Å; Q187-A191 WeakPolarHBondContact O-CB 3.43Å; Q187-A191 PolarHBondContact O-N 3.34Å; Q187-Y217 HydrophobicContact CG-CD1 4.27Å; Q187-Y217 VanDerWaalsContact OE1-CD1 3.29Å; Q187-L218 HydrophobicContact CB-CD1 4.39Å; Q187-I343 HydrophobicContact CG-CG2 3.73Å
188	I	98.8	Very high	98.3	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-65.3	-40.5	176	-55.5	-55	0	0	0	111.4	Y184 A185 L190 A191 F192 L205 L210 L218 I220 L262 L265	Y184-I188 PolarHBondContact O-N 2.91Å; A185-I188 PolarHBondContact O-N 2.96Å; I188-L190 VanDerWaalsContact C-N 3.33Å; I188-L190 PolarHBondContact O-N 3.38Å; I188-A191 PolarHBondContact O-N 2.95Å; I188-F192 HydrophobicContact CG2-CD1 4.46Å; I188-F192 HydrophobicContact CG2-CD2 3.92Å; I188-F192 HydrophobicContact CG2-CE1 4.28Å; I188-F192 HydrophobicContact CG2-CE2 3.69Å; I188-F192 HydrophobicContact CG2-CG 4.31Å; I188-F192 HydrophobicContact CG2-CZ 3.92Å; I188-F192 WeakPolarHBondContact O-CB 3.49Å; I188-F192 WeakPolarHBondContact O-CG 3.49Å; I188-F192 PolarHBondContact O-N 3.27Å; I188-L205 HydrophobicContact CD1-CD1 4.21Å; I188-L205 HydrophobicContact CG2-CD1 4.03Å; I188-L205 HydrophobicContact CG2-CD2 3.91Å; I188-L210 HydrophobicContact CD1-CD1 4.13Å; I188-L210 HydrophobicContact CD1-CD2 3.59Å; I188-L218 HydrophobicContact CD1-CD1 3.84Å; I188-L218 HydrophobicContact CG1-CD1 4.21Å; I188-I220 HydrophobicContact CD1-CD1 3.76Å; I188-I220 HydrophobicContact CD1-CG1 3.94Å; I188-L262 HydrophobicContact CB-CD1 4.03Å; I188-L262 HydrophobicContact CG2-CD1 3.86Å; I188-L265 HydrophobicContact CG1-CD2 3.99Å
189	V	98.8	Very high	98.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.1	-46.3	175.8	168	0	0	0	0	111.1	A185 A186 F192 E193 W259 L262 V326 I329 K330 F335 W340	A185-V189 VanDerWaalsContact O-CG2 3.31Å; A185-V189 WeakPolarHBondContact O-CG2 3.5Å; A185-V189 PolarHBondContact O-N 3.4Å; A186-V189 PolarHBondContact O-N 3.22Å; V189-F192 PolarHBondContact O-N 2.63Å; V189-E193 WeakPolarHBondContact O-CB 3.33Å; V189-E193 PolarHBondContact O-N 3.48Å; V189-W259 HydrophobicContact CG2-CZ3 4.31Å; V189-L262 HydrophobicContact CG2-CD2 3.57Å; V189-V326 HydrophobicContact CG1-CG2 3.71Å; V189-I329 HydrophobicContact CG1-CG2 4.48Å; V189-I329 HydrophobicContact CG2-CG2 3.83Å; V189-K330 HydrophobicContact CG1-CG 3.95Å; V189-F335 HydrophobicContact CG2-CZ 4.18Å; V189-W340 HydrophobicContact CB-CH2 4.05Å; V189-W340 HydrophobicContact CB-CZ3 3.8Å; V189-W340 HydrophobicContact CG1-CH2 3.82Å; V189-W340 HydrophobicContact CG1-CZ3 3.66Å; V189-W340 HydrophobicContact CG2-CH2 4.33Å
190	L	98.1	Very high	98.2	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-66.8	-40.3	177.5	-69.3	171	0	0	0	112.2	F53 F138 F140 A186 Q187 I188 E193 Y194 W340 I343	F53-L190 HydrophobicContact CE1-CD2 4.14Å; F53-L190 HydrophobicContact CE2-CD2 4.11Å; F53-L190 HydrophobicContact CZ-CD2 3.86Å; F138-L190 HydrophobicContact CE1-CB 4.13Å; F138-L190 HydrophobicContact CZ-CB 3.99Å; F140-L190 HydrophobicContact CD2-CB 4.36Å; F140-L190 HydrophobicContact CE2-CB 4.15Å; F140-L190 HydrophobicContact CE2-CD1 3.86Å; A186-L190 WeakPolarHBondContact O-CG 3.32Å; A186-L190 PolarHBondContact O-N 2.86Å; A186-L190 VanDerWaalsContact O-N 3.13Å; Q187-L190 PolarHBondContact O-N 2.87Å; I188-L190 VanDerWaalsContact C-N 3.33Å; I188-L190 PolarHBondContact O-N 3.38Å; L190-E193 PolarHBondContact O-N 3.29Å; L190-Y194 WeakPolarHBondContact O-CB 3.35Å; L190-Y194 PolarHBondContact O-N 3.15Å; L190-W340 HydrophobicContact CD1-CE3 4.2Å; L190-W340 HydrophobicContact CD2-CE3 3.98Å; L190-W340 HydrophobicContact CG-CE3 3.89Å; L190-W340 HydrophobicContact CG-CZ3 4.29Å; L190-I343 HydrophobicContact CD1-CB 4.25Å; L190-I343 HydrophobicContact CD1-CG2 3.76Å
191	A	98.4	Very high	98.2	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.2	-41.3	177	0	0	0	0	0	112.3	F138 F140 L141 Q187 I188 Y194 L195 I220	F138-A191 HydrophobicContact CD1-CB 4.28Å; F138-A191 HydrophobicContact CE1-CB 4.22Å; F140-A191 HydrophobicContact CB-CB 4.47Å; L141-A191 HydrophobicContact CD2-CB 3.93Å; Q187-A191 WeakPolarHBondContact O-CB 3.43Å; Q187-A191 PolarHBondContact O-N 3.34Å; I188-A191 PolarHBondContact O-N 2.95Å; A191-Y194 WeakPolarHBondContact O-CB 3.44Å; A191-Y194 PolarHBondContact O-N 3.11Å; A191-L195 WeakPolarHBondContact O-CG 3.44Å; A191-L195 PolarHBondContact O-N 2.84Å; A191-I220 HydrophobicContact CB-CD1 3.61Å
192	F	98.6	Very high	98.1	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-70.3	-40.6	175.6	-75.8	-9.5	0	0	0	112.8	I188 V189 Y194 L195 H196 Y202 L205 D258 W259 L262	I188-F192 HydrophobicContact CG2-CD1 4.46Å; I188-F192 HydrophobicContact CG2-CD2 3.92Å; I188-F192 HydrophobicContact CG2-CE1 4.28Å; I188-F192 HydrophobicContact CG2-CE2 3.69Å; I188-F192 HydrophobicContact CG2-CG 4.31Å; I188-F192 HydrophobicContact CG2-CZ 3.92Å; I188-F192 WeakPolarHBondContact O-CB 3.49Å; I188-F192 WeakPolarHBondContact O-CG 3.49Å; I188-F192 PolarHBondContact O-N 3.27Å; V189-F192 PolarHBondContact O-N 2.63Å; F192-Y194 VanDerWaalsContact C-N 3.26Å; F192-Y194 PolarHBondContact O-N 3.2Å; F192-L195 HydrophobicContact CD1-CD1 4.41Å; F192-L195 PolarHBondContact O-N 3.46Å; F192-H196 WeakPolarHBondContact O-CB 3.35Å; F192-H196 PolarHBondContact O-CD2 3.28Å; F192-H196 VanDerWaalsContact O-CD2 3.29Å; F192-H196 PolarHBondContact O-N 3.17Å; F192-Y202 HydrophobicContact CE1-CD1 4.07Å; F192-Y202 HydrophobicContact CE1-CG 4.27Å; F192-Y202 HydrophobicContact CZ-CD1 4.42Å; F192-L205 HydrophobicContact CE2-CD2 3.83Å; F192-L205 HydrophobicContact CZ-CB 4.02Å; F192-L205 HydrophobicContact CZ-CD1 4.15Å; F192-L205 HydrophobicContact CZ-CD2 3.7Å; F192-L205 HydrophobicContact CZ-CG 4.17Å; F192-D258 HydrophobicContact CD2-CB 3.93Å; F192-D258 HydrophobicContact CE1-CB 4.29Å; F192-D258 HydrophobicContact CE2-CB 3.64Å; F192-D258 VanDerWaalsContact CE2-O 3.25Å; F192-D258 WeakPolarHBondContact CE2-O 3.39Å; F192-D258 HydrophobicContact CG-CB 4.38Å; F192-D258 HydrophobicContact CZ-CB 3.8Å; F192-W259 HydrophobicContact CB-CH2 3.57Å; F192-W259 HydrophobicContact CB-CZ2 4.03Å; F192-W259 HydrophobicContact CB-CZ3 3.93Å; F192-W259 HydrophobicContact CD2-CE3 4.06Å; F192-W259 HydrophobicContact CD2-CH2 4.42Å; F192-W259 AromaticContact CD2-CZ3 3.95Å; F192-W259 HydrophobicContact CD2-CZ3 3.95Å; F192-W259 HydrophobicContact CG-CZ3 4.48Å; F192-L262 HydrophobicContact CE2-CB 4.28Å
193	E	97.9	Very high	98.1	Very high	33 Å²	33	7.9 Å²	7.9	15%	0.154	4%	0.04	C	C	.	.	H	α-helix	trans	-57.1	-43.9	172.4	-177.3	179.4	-150.1	0	0	111.5	F53 L57 V189 L190 S197 V326 K330	F53-E193 VanDerWaalsContact CE1-CD 3.43Å; F53-E193 HydrophobicContact CE1-CG 4.04Å; F53-E193 WeakPolarHBondContact CE1-OE2 3.13Å; L57-E193 HydrophobicContact CD1-CG 3.99Å; V189-E193 WeakPolarHBondContact O-CB 3.33Å; V189-E193 PolarHBondContact O-N 3.48Å; L190-E193 PolarHBondContact O-N 3.29Å; E193-S197 WeakPolarHBondContact O-CB 3.48Å; E193-S197 PolarHBondContact O-N 3.48Å; E193-V326 HydrophobicContact CB-CG2 4.34Å; E193-V326 HydrophobicContact CG-CG1 3.96Å; E193-V326 WeakPolarHBondContact OE1-CG1 3.41Å; E193-K330 IonicContact OE1-NZ 3.81Å; E193-K330 PolarHBondContact OE1-NZ 2.81Å; E193-K330 WeakPolarHBondContact OE2-CE 3.46Å; E193-K330 IonicContact OE2-NZ 2.84Å; E193-K330 PolarHBondContact OE2-NZ 2.87Å
194	Y	98.1	Very high	98	Very high	3 Å²	3	7.4 Å²	7.4	1%	0.012	4%	0.038	C	C	.	.	H	α-helix	trans	-58.5	-58.3	172.4	169.9	-97.3	0	0	0	112.1	F56 L57 A60 I136 D137 F138 L141 L190 A191 F192 H196 S197 L198	F56-Y194 HydrophobicContact CE1-CD2 4.03Å; F56-Y194 HydrophobicContact CE1-CE2 4.49Å; F56-Y194 HydrophobicContact CZ-CD2 4.44Å; L57-Y194 HydrophobicContact CD2-CD2 4.24Å; A60-Y194 HydrophobicContact CB-CD2 4.43Å; A60-Y194 HydrophobicContact CB-CE2 3.8Å; I136-Y194 WeakPolarHBondContact CA-OH 3.26Å; I136-Y194 HydrophobicContact CB-CE1 4.04Å; I136-Y194 HydrophobicContact CG2-CE1 4.13Å; D137-Y194 PolarHBondContact N-OH 2.85Å; D137-Y194 PolarHBondContact O-OH 2.92Å; F138-Y194 HydrophobicContact CB-CD1 3.74Å; F138-Y194 HydrophobicContact CB-CD2 4.32Å; F138-Y194 HydrophobicContact CB-CE1 3.79Å; F138-Y194 HydrophobicContact CB-CE2 4.33Å; F138-Y194 HydrophobicContact CB-CG 4.02Å; F138-Y194 HydrophobicContact CD1-CD1 4.46Å; F138-Y194 HydrophobicContact CD1-CG 4.37Å; F138-Y194 HydrophobicContact CD2-CD1 4.18Å; F138-Y194 AromaticContact CD2-CD2 3.56Å; F138-Y194 HydrophobicContact CD2-CD2 3.56Å; F138-Y194 HydrophobicContact CD2-CE2 4.15Å; F138-Y194 AromaticContact CD2-CG 3.56Å; F138-Y194 HydrophobicContact CD2-CG 3.56Å; F138-Y194 HydrophobicContact CE2-CD2 4.18Å; F138-Y194 HydrophobicContact CE2-CG 4.14Å; F138-Y194 AromaticContact CG-CD1 3.88Å; F138-Y194 HydrophobicContact CG-CD1 3.88Å; F138-Y194 HydrophobicContact CG-CD2 4.11Å; F138-Y194 HydrophobicContact CG-CE1 4.4Å; F138-Y194 AromaticContact CG-CG 3.72Å; F138-Y194 HydrophobicContact CG-CG 3.72Å; L141-Y194 HydrophobicContact CD1-CD1 3.69Å; L141-Y194 HydrophobicContact CD1-CE1 3.67Å; L190-Y194 WeakPolarHBondContact O-CB 3.35Å; L190-Y194 PolarHBondContact O-N 3.15Å; A191-Y194 WeakPolarHBondContact O-CB 3.44Å; A191-Y194 PolarHBondContact O-N 3.11Å; F192-Y194 VanDerWaalsContact C-N 3.26Å; F192-Y194 PolarHBondContact O-N 3.2Å; Y194-H196 VanDerWaalsContact C-N 3.34Å; Y194-H196 PolarHBondContact O-N 3.37Å; Y194-S197 WeakPolarHBondContact O-CB 3.04Å; Y194-S197 PolarHBondContact O-N 3.24Å; Y194-S197 VanDerWaalsContact O-N 3.12Å; Y194-S197 PolarHBondContact O-OG 3Å; Y194-L198 HydrophobicContact CD1-CD1 4.39Å; Y194-L198 HydrophobicContact CE1-CD1 3.73Å; Y194-L198 HydrophobicContact CE2-CD1 4.01Å
195	L	98.2	Very high	97.9	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-58.7	-44.7	-178.3	-71.2	175.4	0	0	0	112.1	I136 L141 A191 F192 S197 L198 L200 F223	I136-L195 HydrophobicContact CG2-CD2 4.14Å; L141-L195 HydrophobicContact CD1-CD2 3.8Å; L141-L195 HydrophobicContact CD1-CG 4.12Å; L141-L195 HydrophobicContact CD2-CD1 4.46Å; A191-L195 WeakPolarHBondContact O-CG 3.44Å; A191-L195 PolarHBondContact O-N 2.84Å; F192-L195 HydrophobicContact CD1-CD1 4.41Å; F192-L195 PolarHBondContact O-N 3.46Å; L195-S197 PolarHBondContact O-N 3.35Å; L195-L198 WeakPolarHBondContact O-CA 3.45Å; L195-L198 WeakPolarHBondContact O-CB 3.5Å; L195-L198 PolarHBondContact O-N 3.42Å; L195-L200 CarbonylContact C-O 3.54Å; L195-L200 HydrophobicContact CB-CB 4.13Å; L195-L200 HydrophobicContact CD2-CB 4.24Å; L195-L200 HydrophobicContact CD2-CD1 3.76Å; L195-L200 WeakPolarHBondContact O-CB 3.31Å; L195-L200 PolarHBondContact O-N 3.45Å; L195-F223 HydrophobicContact CD1-CE1 4.21Å; L195-F223 HydrophobicContact CD2-CE1 4.07Å
196	H	97.5	Very high	97.9	Very high	11 Å²	11	8.1 Å²	8.1	5%	0.051	4%	0.042	C	C	.	.	H	α-helix	trans	-68.8	-22.9	-178.4	-67.3	-174.9	0	0	0	112.6	F192 Y194 L198 D199 L200 K255 D258 W259	F192-H196 WeakPolarHBondContact O-CB 3.35Å; F192-H196 PolarHBondContact O-CD2 3.28Å; F192-H196 VanDerWaalsContact O-CD2 3.29Å; F192-H196 PolarHBondContact O-N 3.17Å; Y194-H196 VanDerWaalsContact C-N 3.34Å; Y194-H196 PolarHBondContact O-N 3.37Å; H196-L198 PolarHBondContact O-N 3.46Å; H196-D199 PolarHBondContact O-N 3.49Å; H196-L200 PolarHBondContact CD2-O 2.98Å; H196-K255 HydrophobicContact CB-CD 3.82Å; H196-K255 PolarHBondContact CE1-O 3.43Å; H196-D258 IonicContact CD2-OD2 2.8Å; H196-D258 IonicContact CE1-OD2 2.71Å; H196-D258 IonicContact NE2-OD2 3.36Å; H196-D258 PolarHBondContact NE2-OD2 2.94Å; H196-W259 AromaticContact CE1-CE2 3.64Å; H196-W259 AromaticContact CE1-CZ2 3.89Å; H196-W259 AromaticContact CE1-NE1 3.45Å; H196-W259 PolarHBondContact CE1-NE1 2.92Å; H196-W259 AromaticContact ND1-CE2 3.63Å; H196-W259 AromaticContact ND1-CZ2 3.61Å; H196-W259 AromaticContact ND1-NE1 3.37Å; H196-W259 PolarHBondContact ND1-NE1 3.39Å
197	S	96.4	Very high	97.8	Very high	21 Å²	21	8.1 Å²	8.1	15%	0.147	4%	0.042	C	C	.	.	H	α-helix	trans	-72.9	-15.5	172.8	81.7	0	0	0	0	113.1	R61 E193 Y194 L195	R61-S197 PolarHBondContact NE-O 3.5Å; E193-S197 WeakPolarHBondContact O-CB 3.48Å; E193-S197 PolarHBondContact O-N 3.48Å; Y194-S197 WeakPolarHBondContact O-CB 3.04Å; Y194-S197 PolarHBondContact O-N 3.24Å; Y194-S197 VanDerWaalsContact O-N 3.12Å; Y194-S197 PolarHBondContact O-OG 3Å; L195-S197 PolarHBondContact O-N 3.35Å
198	L	97	Very high	97.6	Very high	2 Å²	2	11.2 Å²	11.2	1%	0.01	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	9.1	178	-53.7	177.7	0	0	0	112.6	R61 F64 I136 Y194 L195 H196 L200 R228	R61-L198 HydrophobicContact CB-CD2 4.04Å; R61-L198 HydrophobicContact CG-CD2 4.14Å; F64-L198 HydrophobicContact CB-CD1 4.06Å; F64-L198 HydrophobicContact CB-CD2 3.72Å; F64-L198 HydrophobicContact CB-CG 4.46Å; F64-L198 HydrophobicContact CD1-CB 4.1Å; F64-L198 HydrophobicContact CD1-CD1 4.35Å; F64-L198 HydrophobicContact CD1-CD2 3.92Å; F64-L198 HydrophobicContact CD1-CG 4.34Å; F64-L198 HydrophobicContact CD2-CD1 3.67Å; F64-L198 HydrophobicContact CE1-CB 4.1Å; F64-L198 HydrophobicContact CE2-CD1 4.2Å; F64-L198 HydrophobicContact CG-CB 4.35Å; F64-L198 HydrophobicContact CG-CD1 3.76Å; F64-L198 HydrophobicContact CG-CD2 3.83Å; F64-L198 HydrophobicContact CG-CG 4.18Å; F64-L198 HydrophobicContact CZ-CB 4.38Å; I136-L198 HydrophobicContact CG2-CD1 4.27Å; Y194-L198 HydrophobicContact CD1-CD1 4.39Å; Y194-L198 HydrophobicContact CE1-CD1 3.73Å; Y194-L198 HydrophobicContact CE2-CD1 4.01Å; L195-L198 WeakPolarHBondContact O-CA 3.45Å; L195-L198 WeakPolarHBondContact O-CB 3.5Å; L195-L198 PolarHBondContact O-N 3.42Å; H196-L198 PolarHBondContact O-N 3.46Å; L198-L200 HydrophobicContact CB-CD1 4.04Å; L198-L200 HydrophobicContact CB-CG 4.07Å; L198-L200 HydrophobicContact CD1-CD1 4.14Å; L198-L200 PolarHBondContact O-N 2.75Å; L198-R228 PolarHBondContact O-NE 3.13Å
199	D	97.1	Very high	97.5	Very high	57 Å²	57	11.7 Å²	11.7	31%	0.305	6%	0.059	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	22.5	-170.2	-52.2	-51	0	0	0	113.6	H196 R228 V229 K230	H196-D199 PolarHBondContact O-N 3.49Å; D199-R228 HydrophobicContact CB-CG 4.1Å; D199-R228 CarbonylContact O-C 3.59Å; D199-R228 VanDerWaalsContact O-CA 3.27Å; D199-R228 WeakPolarHBondContact O-CA 3.46Å; D199-V229 PolarHBondContact O-N 3.23Å; D199-K230 HydrophobicContact CB-CG 4.27Å
200	L	97.9	Very high	97.4	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	136.3	177.4	-63	170.7	0	0	0	110.9	F64 I132 I136 L195 H196 L198 R228	F64-L200 HydrophobicContact CE2-CD1 3.82Å; F64-L200 HydrophobicContact CZ-CD1 4.01Å; F64-L200 HydrophobicContact CZ-CD2 4.3Å; F64-L200 HydrophobicContact CZ-CG 4.29Å; I132-L200 HydrophobicContact CD1-CD2 3.91Å; I132-L200 HydrophobicContact CG1-CD2 3.85Å; I132-L200 HydrophobicContact CG2-CD1 4Å; I132-L200 HydrophobicContact CG2-CD2 4.31Å; I136-L200 HydrophobicContact CG2-CD1 3.65Å; L195-L200 CarbonylContact C-O 3.54Å; L195-L200 HydrophobicContact CB-CB 4.13Å; L195-L200 HydrophobicContact CD2-CB 4.24Å; L195-L200 HydrophobicContact CD2-CD1 3.76Å; L195-L200 WeakPolarHBondContact O-CB 3.31Å; L195-L200 PolarHBondContact O-N 3.45Å; H196-L200 PolarHBondContact CD2-O 2.98Å; L198-L200 HydrophobicContact CB-CD1 4.04Å; L198-L200 HydrophobicContact CB-CG 4.07Å; L198-L200 HydrophobicContact CD1-CD1 4.14Å; L198-L200 PolarHBondContact O-N 2.75Å; L200-R228 HydrophobicContact CD2-CB 3.75Å; L200-R228 HydrophobicContact CD2-CG 4.13Å
201	I	97.6	Very high	97.4	Very high	4 Å²	4	12.7 Å²	12.7	2%	0.021	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132	169.5	-47.9	174.3	0	0	0	107.4	R203 A226 K227 V229 K255 V257 D258	I201-R203 HydrophobicContact CB-CG 4.07Å; I201-R203 HydrophobicContact CG2-CG 3.44Å; I201-R203 VanDerWaalsContact CG2-CG 3.44Å; I201-A226 CarbonylContact O-C 3.54Å; I201-A226 VanDerWaalsContact O-CA 3.23Å; I201-A226 WeakPolarHBondContact O-CA 3.34Å; I201-K227 PolarHBondContact N-O 3.37Å; I201-K227 PolarHBondContact O-N 3.17Å; I201-V229 HydrophobicContact CD1-CB 3.88Å; I201-V229 HydrophobicContact CD1-CG1 4.37Å; I201-V229 HydrophobicContact CD1-CG2 4.13Å; I201-V229 HydrophobicContact CG1-CB 4.47Å; I201-K255 HydrophobicContact CG1-CB 4.14Å; I201-V257 HydrophobicContact CG2-CG2 3.93Å; I201-D258 VanDerWaalsContact CG2-OD2 3.31Å; I201-D258 WeakPolarHBondContact CG2-OD2 3.24Å
202	Y	97.9	Very high	97.3	Very high	1 Å²	1	12.7 Å²	12.7	0%	0.004	6%	0.064	C	C	.	.			trans	-83	-47	-174.3	178.9	-113.9	0	0	0	113.4	F192 D204 L205 N209 I220 T221 D222 F223 F225 D258	F192-Y202 HydrophobicContact CE1-CD1 4.07Å; F192-Y202 HydrophobicContact CE1-CG 4.27Å; F192-Y202 HydrophobicContact CZ-CD1 4.42Å; Y202-D204 VanDerWaalsContact C-N 3.3Å; Y202-D204 HydrophobicContact CE1-CB 4.49Å; Y202-D204 WeakPolarHBondContact CE1-O 3.48Å; Y202-D204 PolarHBondContact O-N 3.46Å; Y202-L205 HydrophobicContact CD1-CB 4.14Å; Y202-L205 HydrophobicContact CE1-CB 4.18Å; Y202-L205 VanDerWaalsContact CE1-N 3.34Å; Y202-N209 VanDerWaalsContact OH-CB 3.26Å; Y202-N209 WeakPolarHBondContact OH-CB 3.44Å; Y202-N209 PolarHBondContact OH-ND2 3.24Å; Y202-I220 HydrophobicContact CD2-CG2 4.33Å; Y202-I220 HydrophobicContact CE1-CG2 3.98Å; Y202-I220 HydrophobicContact CE2-CG2 3.65Å; Y202-I220 VanDerWaalsContact CZ-CG2 3.46Å; Y202-T221 PolarHBondContact OH-O 3.04Å; Y202-D222 VanDerWaalsContact CE2-O 3.24Å; Y202-D222 WeakPolarHBondContact CE2-O 3.22Å; Y202-D222 PolarHBondContact OH-O 2.71Å; Y202-F223 HydrophobicContact CD2-CD1 4.17Å; Y202-F223 HydrophobicContact CD2-CE1 4.1Å; Y202-F223 HydrophobicContact CD2-CZ 4.42Å; Y202-F223 HydrophobicContact CE2-CD1 4.37Å; Y202-F223 HydrophobicContact CE2-CD2 4.24Å; Y202-F223 HydrophobicContact CE2-CE1 4.41Å; Y202-F223 HydrophobicContact CE2-CE2 4.3Å; Y202-F223 HydrophobicContact CE2-CG 4.29Å; Y202-F223 HydrophobicContact CE2-CZ 4.39Å; Y202-F225 CarbonylContact O-C 3.45Å; Y202-D258 PolarHBondContact N-OD1 3.05Å; Y202-D258 PolarHBondContact N-OD2 3.2Å
203	R	97.1	Very high	97.2	Very high	15 Å²	15	13.4 Å²	13.4	6%	0.057	7%	0.067	C	C	.	.			trans	68.7	-3	170.6	-52.3	-170	-67.9	172.1	1.3	118.7	I201 F225 Y253 V257 D258	I201-R203 HydrophobicContact CB-CG 4.07Å; I201-R203 HydrophobicContact CG2-CG 3.44Å; I201-R203 VanDerWaalsContact CG2-CG 3.44Å; R203-F225 HydrophobicContact CB-CB 4.18Å; R203-F225 PolarHBondContact NE-O 2.92Å; R203-F225 PolarHBondContact NH2-O 2.79Å; R203-Y253 WeakPolarHBondContact CD-OH 3.39Å; R203-Y253 HydrophobicContact CG-CE2 4.48Å; R203-Y253 PolarHBondContact NH1-OH 3.34Å; R203-V257 HydrophobicContact CG-CG2 4.46Å; R203-D258 PolarHBondContact N-OD1 2.71Å
204	D	96.8	Very high	97	Very high	3 Å²	3	15.2 Å²	15.2	2%	0.016	8%	0.084	C	C	.	.			trans	-134.7	41.7	176.9	-152.3	28.3	0	0	0	113.8	Y202 K206 N209 F225 T239	Y202-D204 VanDerWaalsContact C-N 3.3Å; Y202-D204 HydrophobicContact CE1-CB 4.49Å; Y202-D204 WeakPolarHBondContact CE1-O 3.48Å; Y202-D204 PolarHBondContact O-N 3.46Å; D204-K206 PolarHBondContact O-N 3.15Å; D204-K206 IonicContact OD1-NZ 3.32Å; D204-K206 PolarHBondContact OD1-NZ 2.88Å; D204-K206 WeakPolarHBondContact OD2-CE 3.36Å; D204-K206 IonicContact OD2-NZ 2.83Å; D204-K206 PolarHBondContact OD2-NZ 3.03Å; D204-N209 PolarHBondContact O-ND2 2.87Å; D204-N209 PolarHBondContact OD2-ND2 3.29Å; D204-F225 HydrophobicContact CB-CD2 3.82Å; D204-T239 PolarHBondContact OD1-N 2.96Å; D204-T239 PolarHBondContact OD1-OG1 3.02Å
205	L	98.4	Very high	96.8	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.103	C	C	.	.			trans	-68	123	175.8	-175.7	72	0	0	0	110.1	I188 F192 Y202 L210 Y242 A261 L262 L265	I188-L205 HydrophobicContact CD1-CD1 4.21Å; I188-L205 HydrophobicContact CG2-CD1 4.03Å; I188-L205 HydrophobicContact CG2-CD2 3.91Å; F192-L205 HydrophobicContact CE2-CD2 3.83Å; F192-L205 HydrophobicContact CZ-CB 4.02Å; F192-L205 HydrophobicContact CZ-CD1 4.15Å; F192-L205 HydrophobicContact CZ-CD2 3.7Å; F192-L205 HydrophobicContact CZ-CG 4.17Å; Y202-L205 HydrophobicContact CD1-CB 4.14Å; Y202-L205 HydrophobicContact CE1-CB 4.18Å; Y202-L205 VanDerWaalsContact CE1-N 3.34Å; L205-L210 HydrophobicContact CD1-CD1 4.29Å; L205-L210 HydrophobicContact CD1-CD2 4.01Å; L205-L210 HydrophobicContact CD1-CG 4.45Å; L205-Y242 WeakPolarHBondContact O-CD1 3.07Å; L205-Y242 WeakPolarHBondContact O-CE1 3.28Å; L205-A261 HydrophobicContact CB-CB 3.98Å; L205-A261 HydrophobicContact CD2-CB 4.24Å; L205-L262 HydrophobicContact CD2-CB 4.35Å; L205-L265 HydrophobicContact CD1-CD2 4.05Å; L205-L265 HydrophobicContact CD2-CB 4.09Å; L205-L265 HydrophobicContact CD2-CD2 3.84Å; L205-L265 HydrophobicContact CG-CD2 4.05Å
206	K	97.4	Very high	96.8	Very high	16 Å²	16	18.2 Å²	18.2	7%	0.07	10%	0.103	C	C	.	.	S	Bend	trans	-165.5	157.8	174.6	60.8	-174.5	162.6	-160.5	0	109.5	D204 E208 N209 L210 T239 Y242	D204-K206 PolarHBondContact O-N 3.15Å; D204-K206 IonicContact OD1-NZ 3.32Å; D204-K206 PolarHBondContact OD1-NZ 2.88Å; D204-K206 WeakPolarHBondContact OD2-CE 3.36Å; D204-K206 IonicContact OD2-NZ 2.83Å; D204-K206 PolarHBondContact OD2-NZ 3.03Å; K206-E208 VanDerWaalsContact CB-OE2 3.27Å; K206-E208 WeakPolarHBondContact CB-OE2 3.5Å; K206-E208 HydrophobicContact CD-CB 4.14Å; K206-E208 HydrophobicContact CG-CB 4.08Å; K206-E208 WeakPolarHBondContact CG-OE2 3.46Å; K206-E208 PolarHBondContact O-N 3.34Å; K206-E208 VanDerWaalsContact O-N 3.11Å; K206-N209 VanDerWaalsContact CE-CG 3.48Å; K206-N209 VanDerWaalsContact CE-ND2 3.27Å; K206-N209 WeakPolarHBondContact CE-ND2 3.29Å; K206-N209 WeakPolarHBondContact CE-OD1 3.31Å; K206-N209 HydrophobicContact CG-CB 4.23Å; K206-N209 PolarHBondContact O-N 2.73Å; K206-L210 WeakPolarHBondContact O-CG 3.28Å; K206-T239 HydrophobicContact CD-CG2 4.16Å; K206-T239 VanDerWaalsContact CD-OG1 3.28Å; K206-T239 WeakPolarHBondContact CD-OG1 3.4Å; K206-T239 PolarHBondContact NZ-OG1 2.79Å; K206-Y242 HydrophobicContact CB-CD2 4.08Å; K206-Y242 HydrophobicContact CB-CE2 3.91Å
207	P	97.2	Very high	96.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-55.5	-27.3	-179.4	-27	34.3	0	0	0	114.6	M166 F167 L170 N209 L210 Y242 L265	M166-P207 HydrophobicContact CB-CB 4.4Å; M166-P207 HydrophobicContact CG-CB 4.35Å; M166-P207 HydrophobicContact SD-CB 4.42Å; F167-P207 HydrophobicContact CB-CB 3.86Å; F167-P207 HydrophobicContact CD2-CB 4.25Å; F167-P207 PolarHBondContact N-O 3.29Å; F167-P207 VanDerWaalsContact N-O 3.16Å; L170-P207 HydrophobicContact CD2-CG 4.32Å; P207-N209 VanDerWaalsContact C-N 3.32Å; P207-L210 PolarHBondContact O-N 2.93Å; P207-Y242 WeakPolarHBondContact CD-OH 3.24Å; P207-L265 HydrophobicContact CG-CD1 3.8Å
208	E	94.5	Very high	96.9	Very high	64 Å²	64	17 Å²	17	30%	0.299	9%	0.094	S	C	.	.	G	3₁₀ helix	trans	-67.4	-32.1	178.4	-60.9	88.6	149.9	0	0	111.9	F167 K206 L210	F167-E208 HydrophobicContact CB-CG 3.98Å; F167-E208 VanDerWaalsContact CD2-CD 3.48Å; F167-E208 HydrophobicContact CD2-CG 3.78Å; F167-E208 HydrophobicContact CE2-CG 4.39Å; F167-E208 WeakPolarHBondContact CE2-OE1 3.35Å; F167-E208 HydrophobicContact CG-CG 3.85Å; K206-E208 VanDerWaalsContact CB-OE2 3.27Å; K206-E208 WeakPolarHBondContact CB-OE2 3.5Å; K206-E208 HydrophobicContact CD-CB 4.14Å; K206-E208 HydrophobicContact CG-CB 4.08Å; K206-E208 WeakPolarHBondContact CG-OE2 3.46Å; K206-E208 PolarHBondContact O-N 3.34Å; K206-E208 VanDerWaalsContact O-N 3.11Å; E208-L210 VanDerWaalsContact C-N 3.32Å
209	N	96.5	Very high	97	Very high	12 Å²	12	17.4 Å²	17.4	6%	0.064	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-92.7	10.1	179.1	-69.3	-5.4	0	0	0	113	Y202 D204 K206 P207 T221	Y202-N209 VanDerWaalsContact OH-CB 3.26Å; Y202-N209 WeakPolarHBondContact OH-CB 3.44Å; Y202-N209 PolarHBondContact OH-ND2 3.24Å; D204-N209 PolarHBondContact O-ND2 2.87Å; D204-N209 PolarHBondContact OD2-ND2 3.29Å; K206-N209 VanDerWaalsContact CE-CG 3.48Å; K206-N209 VanDerWaalsContact CE-ND2 3.27Å; K206-N209 WeakPolarHBondContact CE-ND2 3.29Å; K206-N209 WeakPolarHBondContact CE-OD1 3.31Å; K206-N209 HydrophobicContact CG-CB 4.23Å; K206-N209 PolarHBondContact O-N 2.73Å; P207-N209 VanDerWaalsContact C-N 3.32Å; N209-T221 WeakPolarHBondContact O-CG2 3.44Å; N209-T221 PolarHBondContact O-N 3.3Å
210	L	97.9	Very high	97	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.1	178.7	-60.2	180	0	0	0	109.6	M166 I188 L205 K206 P207 E208 L218 I220 L265	M166-L210 HydrophobicContact CB-CB 3.98Å; M166-L210 WeakPolarHBondContact CB-O 3.33Å; M166-L210 HydrophobicContact CE-CB 4.2Å; M166-L210 HydrophobicContact CE-CD1 3.73Å; M166-L210 PolarHBondContact N-O 3.46Å; M166-L210 HydrophobicContact SD-CD1 3.87Å; I188-L210 HydrophobicContact CD1-CD1 4.13Å; I188-L210 HydrophobicContact CD1-CD2 3.59Å; L205-L210 HydrophobicContact CD1-CD1 4.29Å; L205-L210 HydrophobicContact CD1-CD2 4.01Å; L205-L210 HydrophobicContact CD1-CG 4.45Å; K206-L210 WeakPolarHBondContact O-CG 3.28Å; P207-L210 PolarHBondContact O-N 2.93Å; E208-L210 VanDerWaalsContact C-N 3.32Å; L210-L218 HydrophobicContact CD1-CD1 4.48Å; L210-I220 HydrophobicContact CD2-CB 4.32Å; L210-I220 HydrophobicContact CD2-CD1 4.49Å; L210-I220 HydrophobicContact CD2-CG1 3.69Å; L210-I220 HydrophobicContact CD2-CG2 4.47Å; L210-L265 HydrophobicContact CD1-CD1 3.99Å; L210-L265 HydrophobicContact CD1-CD2 3.66Å; L210-L265 HydrophobicContact CD1-CG 4.48Å
211	L	97.1	Very high	96.9	Very high	21 Å²	21	16 Å²	16	11%	0.11	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	147.9	174.7	-57.8	176.6	0	0	0	110.3	I161 G164 E165 L218 K219 T221	I161-L211 HydrophobicContact CB-CB 3.96Å; I161-L211 HydrophobicContact CB-CD1 3.9Å; I161-L211 HydrophobicContact CG1-CB 4.47Å; I161-L211 HydrophobicContact CG1-CD1 4.16Å; I161-L211 HydrophobicContact CG2-CB 3.6Å; I161-L211 HydrophobicContact CG2-CD1 4.49Å; G164-L211 CarbonylContact O-C 3.54Å; G164-L211 WeakPolarHBondContact O-CA 3.38Å; E165-L211 HydrophobicContact CG-CD2 3.82Å; L211-L218 CarbonylContact O-C 3.59Å; L211-L218 VanDerWaalsContact O-CA 3.3Å; L211-L218 WeakPolarHBondContact O-CA 3.16Å; L211-K219 HydrophobicContact CB-CB 4.4Å; L211-K219 PolarHBondContact N-O 3.44Å; L211-K219 PolarHBondContact O-N 2.73Å; L211-T221 HydrophobicContact CD1-CG2 4.02Å; L211-T221 HydrophobicContact CG-CG2 3.97Å
212	I	97	Very high	96.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.5	173.6	-52.8	-169.8	0	0	0	108.5	I161 G163 G164 H169 Y217 L218 F352 P354	I161-I212 VanDerWaalsContact CG2-O 3.27Å; I161-I212 WeakPolarHBondContact CG2-O 3.47Å; G163-I212 CarbonylContact C-O 3.49Å; G163-I212 WeakPolarHBondContact CA-O 3.24Å; G163-I212 PolarHBondContact N-O 2.83Å; G164-I212 PolarHBondContact O-N 3.22Å; H169-I212 VanDerWaalsContact CD2-CD1 3.45Å; H169-I212 WeakPolarHBondContact CD2-CD1 3.41Å; I212-Y217 CarbonylContact C-O 3.59Å; I212-Y217 WeakPolarHBondContact CA-O 3.25Å; I212-L218 HydrophobicContact CG1-CD2 4.08Å; I212-F352 HydrophobicContact CD1-CD1 3.96Å; I212-F352 HydrophobicContact CD1-CE1 4.15Å; I212-F352 HydrophobicContact CG2-CD1 4.37Å; I212-P354 HydrophobicContact CG2-CG 4.23Å
213	D	95.2	Very high	96.5	Very high	15 Å²	15	17.7 Å²	17.7	8%	0.08	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-78.8	172	175.5	74.8	24.1	0	0	0	112.4	I161 T215 G216 Y217 K346 P354	I161-D213 HydrophobicContact CG2-CB 4.02Å; D213-T215 VanDerWaalsContact CG-OG1 3.31Å; D213-T215 PolarHBondContact O-N 3.04Å; D213-T215 VanDerWaalsContact O-N 3.09Å; D213-T215 VanDerWaalsContact OD1-CA 3.27Å; D213-T215 WeakPolarHBondContact OD1-CA 3.45Å; D213-T215 WeakPolarHBondContact OD1-CB 3.18Å; D213-T215 PolarHBondContact OD1-N 3.09Å; D213-T215 PolarHBondContact OD1-OG1 3.02Å; D213-T215 PolarHBondContact OD2-OG1 2.78Å; D213-G216 PolarHBondContact O-N 3.46Å; D213-G216 PolarHBondContact OD1-N 3.04Å; D213-G216 VanDerWaalsContact OD1-N 3.09Å; D213-Y217 PolarHBondContact N-O 3.47Å; D213-Y217 PolarHBondContact OD1-N 3.49Å; D213-K346 IonicContact OD2-NZ 3.61Å; D213-K346 PolarHBondContact OD2-NZ 2.93Å; D213-P354 WeakPolarHBondContact O-CD 3.49Å; D213-P354 WeakPolarHBondContact O-CG 3.45Å
214	S	94	Very high	96.2	Very high	71 Å²	71	17.5 Å²	17.5	50%	0.497	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.1	-179.6	54.8	0	0	0	0	114.3
215	T	95.2	Very high	96	Very high	68 Å²	68	17.6 Å²	17.6	42%	0.417	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.4	175	68.8	0	0	0	0	112.7	D213 Y217 A350 L353	D213-T215 VanDerWaalsContact CG-OG1 3.31Å; D213-T215 PolarHBondContact O-N 3.04Å; D213-T215 VanDerWaalsContact O-N 3.09Å; D213-T215 VanDerWaalsContact OD1-CA 3.27Å; D213-T215 WeakPolarHBondContact OD1-CA 3.45Å; D213-T215 WeakPolarHBondContact OD1-CB 3.18Å; D213-T215 PolarHBondContact OD1-N 3.09Å; D213-T215 PolarHBondContact OD1-OG1 3.02Å; D213-T215 PolarHBondContact OD2-OG1 2.78Å; T215-Y217 VanDerWaalsContact C-N 3.33Å; T215-A350 VanDerWaalsContact O-CB 3.27Å; T215-A350 WeakPolarHBondContact O-CB 3.11Å; T215-L353 VanDerWaalsContact C-CD2 3.42Å; T215-L353 VanDerWaalsContact O-CD2 3.25Å; T215-L353 WeakPolarHBondContact O-CD2 3.4Å
216	G	96.9	Very high	95.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	83.6	4	179	0	0	0	0	0	114.7	Y184 D213 F352	Y184-G216 WeakPolarHBondContact CE1-O 3.3Å; D213-G216 PolarHBondContact O-N 3.46Å; D213-G216 PolarHBondContact OD1-N 3.04Å; D213-G216 VanDerWaalsContact OD1-N 3.09Å; G216-F352 WeakPolarHBondContact CA-O 3.13Å
217	Y	98.3	Very high	95.7	Very high	5 Å²	5	19.4 Å²	19.4	2%	0.02	11%	0.11	C	C	.	.			trans	-87.5	160.9	176.8	-83	-97	0	0	0	111.7	F140 F183 Q187 I212 D213 T215 K346 K347 I348	F140-Y217 HydrophobicContact CD1-CD1 4.35Å; F140-Y217 AromaticContact CE1-CD1 3.62Å; F140-Y217 HydrophobicContact CE1-CD1 3.62Å; F140-Y217 HydrophobicContact CE1-CE1 4.16Å; F140-Y217 HydrophobicContact CZ-CD1 4.39Å; F183-Y217 AromaticContact CE2-CE1 3.87Å; F183-Y217 HydrophobicContact CE2-CE1 3.87Å; F183-Y217 HydrophobicContact CE2-CE2 4.3Å; F183-Y217 AromaticContact CE2-CZ 3.73Å; F183-Y217 AromaticContact CZ-CD1 3.91Å; F183-Y217 HydrophobicContact CZ-CD1 3.91Å; F183-Y217 HydrophobicContact CZ-CD2 4.07Å; F183-Y217 AromaticContact CZ-CE1 3.68Å; F183-Y217 HydrophobicContact CZ-CE1 3.68Å; F183-Y217 AromaticContact CZ-CE2 3.85Å; F183-Y217 HydrophobicContact CZ-CE2 3.85Å; F183-Y217 HydrophobicContact CZ-CG 4.1Å; F183-Y217 AromaticContact CZ-CZ 3.64Å; Q187-Y217 HydrophobicContact CG-CD1 4.27Å; Q187-Y217 VanDerWaalsContact OE1-CD1 3.29Å; I212-Y217 CarbonylContact C-O 3.59Å; I212-Y217 WeakPolarHBondContact CA-O 3.25Å; D213-Y217 PolarHBondContact N-O 3.47Å; D213-Y217 PolarHBondContact OD1-N 3.49Å; T215-Y217 VanDerWaalsContact C-N 3.33Å; Y217-K346 HydrophobicContact CD1-CB 4.47Å; Y217-K346 HydrophobicContact CD1-CD 4.25Å; Y217-K346 HydrophobicContact CD1-CG 3.86Å; Y217-K346 HydrophobicContact CD2-CB 4.26Å; Y217-K346 HydrophobicContact CD2-CD 4.2Å; Y217-K346 HydrophobicContact CD2-CG 4.24Å; Y217-K346 HydrophobicContact CE1-CB 4.12Å; Y217-K346 HydrophobicContact CE1-CG 3.88Å; Y217-K346 HydrophobicContact CE2-CB 3.89Å; Y217-K346 HydrophobicContact CE2-CG 4.27Å; Y217-K346 HydrophobicContact CG-CD 3.98Å; Y217-K346 HydrophobicContact CG-CG 4.04Å; Y217-K346 VanDerWaalsContact CZ-CA 3.44Å; Y217-K346 VanDerWaalsContact OH-C 3.23Å; Y217-K346 VanDerWaalsContact OH-CA 3.26Å; Y217-K346 WeakPolarHBondContact OH-CA 3.2Å; Y217-K347 PolarHBondContact OH-N 2.72Å; Y217-I348 PolarHBondContact OH-N 3.46Å; Y217-I348 PolarHBondContact OH-O 2.73Å
218	L	98.4	Very high	95.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	150.6	-178.4	-61.8	-176.8	0	0	0	112.9	F140 M166 Y184 Q187 I188 L210 L211 I212	F140-L218 WeakPolarHBondContact CA-O 3.27Å; M166-L218 HydrophobicContact CE-CD1 3.7Å; M166-L218 HydrophobicContact CE-CD2 3.41Å; M166-L218 VanDerWaalsContact CE-CD2 3.41Å; M166-L218 HydrophobicContact CE-CG 4.19Å; Y184-L218 HydrophobicContact CD1-CD1 3.81Å; Y184-L218 HydrophobicContact CD1-CD2 3.62Å; Y184-L218 HydrophobicContact CD1-CG 3.56Å; Y184-L218 HydrophobicContact CE1-CD2 3.81Å; Y184-L218 HydrophobicContact CE1-CG 4.14Å; Y184-L218 HydrophobicContact CG-CD1 4.04Å; Y184-L218 HydrophobicContact CG-CD2 4.23Å; Y184-L218 HydrophobicContact CG-CG 4.27Å; Q187-L218 HydrophobicContact CB-CD1 4.39Å; I188-L218 HydrophobicContact CD1-CD1 3.84Å; I188-L218 HydrophobicContact CG1-CD1 4.21Å; L210-L218 HydrophobicContact CD1-CD1 4.48Å; L211-L218 CarbonylContact O-C 3.59Å; L211-L218 VanDerWaalsContact O-CA 3.3Å; L211-L218 WeakPolarHBondContact O-CA 3.16Å; I212-L218 HydrophobicContact CG1-CD2 4.08Å
219	K	98.3	Very high	95.5	Very high	12 Å²	12	21 Å²	21	5%	0.052	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	110.4	165.4	-73.8	-78.4	-174	168.8	0	108.4	P139 F140 L141 E159 I161 L211 T221	P139-K219 WeakPolarHBondContact O-CE 3.41Å; P139-K219 PolarHBondContact O-NZ 3.41Å; F140-K219 CarbonylContact O-C 3.48Å; F140-K219 WeakPolarHBondContact O-CA 3.43Å; L141-K219 WeakPolarHBondContact O-CD 2.97Å; L141-K219 PolarHBondContact O-NZ 2.77Å; E159-K219 WeakPolarHBondContact OE1-CE 3.27Å; E159-K219 IonicContact OE1-NZ 3.02Å; E159-K219 PolarHBondContact OE1-NZ 2.82Å; E159-K219 IonicContact OE2-NZ 2.92Å; E159-K219 PolarHBondContact OE2-NZ 3.4Å; I161-K219 HydrophobicContact CD1-CB 4.17Å; I161-K219 HydrophobicContact CD1-CD 4.2Å; I161-K219 HydrophobicContact CD1-CG 3.64Å; I161-K219 HydrophobicContact CG1-CB 3.88Å; I161-K219 HydrophobicContact CG1-CG 3.94Å; I161-K219 HydrophobicContact CG2-CB 4.34Å; I161-K219 HydrophobicContact CG2-CG 4.42Å; L211-K219 HydrophobicContact CB-CB 4.4Å; L211-K219 PolarHBondContact N-O 3.44Å; L211-K219 PolarHBondContact O-N 2.73Å; K219-T221 PolarHBondContact O-N 2.64Å
220	I	98.3	Very high	95.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.8	172	-54	-177.2	0	0	0	107.7	F140 L141 V142 I188 A191 Y202 L210 F223	F140-I220 WeakPolarHBondContact O-CG1 3.39Å; F140-I220 PolarHBondContact O-N 3.41Å; L141-I220 HydrophobicContact CD2-CB 3.74Å; L141-I220 HydrophobicContact CD2-CD1 3.74Å; L141-I220 HydrophobicContact CD2-CG1 3.98Å; L141-I220 HydrophobicContact CD2-CG2 4.47Å; V142-I220 WeakPolarHBondContact CB-O 3.26Å; V142-I220 PolarHBondContact N-O 3.42Å; I188-I220 HydrophobicContact CD1-CD1 3.76Å; I188-I220 HydrophobicContact CD1-CG1 3.94Å; A191-I220 HydrophobicContact CB-CD1 3.61Å; Y202-I220 HydrophobicContact CD2-CG2 4.33Å; Y202-I220 HydrophobicContact CE1-CG2 3.98Å; Y202-I220 HydrophobicContact CE2-CG2 3.65Å; Y202-I220 VanDerWaalsContact CZ-CG2 3.46Å; L210-I220 HydrophobicContact CD2-CB 4.32Å; L210-I220 HydrophobicContact CD2-CD1 4.49Å; L210-I220 HydrophobicContact CD2-CG1 3.69Å; L210-I220 HydrophobicContact CD2-CG2 4.47Å; I220-F223 HydrophobicContact CG2-CE2 4.37Å
221	T	95.6	Very high	95	Very high	27 Å²	27	31 Å²	31	17%	0.166	17%	0.172	C	C	.	.			trans	-115.3	-176.2	176.4	-168.7	0	0	0	0	110.5	Y202 N209 L211 K219	Y202-T221 PolarHBondContact OH-O 3.04Å; N209-T221 WeakPolarHBondContact O-CG2 3.44Å; N209-T221 PolarHBondContact O-N 3.3Å; L211-T221 HydrophobicContact CD1-CG2 4.02Å; L211-T221 HydrophobicContact CG-CG2 3.97Å; K219-T221 PolarHBondContact O-N 2.64Å
222	D	91.9	Very high	94.8	Very high	41 Å²	41	37.8 Å²	37.8	22%	0.219	20%	0.196	C	C	.	.			trans	51.3	90.4	177.3	-159.7	-8.4	0	0	0	114.8	K110 Y202 G224	K110-D222 IonicContact NZ-OD1 2.54Å; Y202-D222 VanDerWaalsContact CE2-O 3.24Å; Y202-D222 WeakPolarHBondContact CE2-O 3.22Å; Y202-D222 PolarHBondContact OH-O 2.71Å; D222-G224 VanDerWaalsContact C-N 3.34Å; D222-G224 PolarHBondContact OD1-N 2.74Å; D222-G224 VanDerWaalsContact OD1-N 3.15Å
223	F	94.6	Very high	94.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.			trans	-98.7	19.6	178.7	-78.7	-109.4	0	0	0	111.7	E129 I132 L133 I136 L141 L195 Y202 I220 F225 A226	E129-F223 HydrophobicContact CG-CB 4.1Å; I132-F223 HydrophobicContact CG2-CD1 3.79Å; I132-F223 HydrophobicContact CG2-CE1 4.32Å; L133-F223 HydrophobicContact CD1-CB 4.44Å; L133-F223 HydrophobicContact CD2-CB 4.14Å; L133-F223 HydrophobicContact CD2-CD2 3.5Å; L133-F223 HydrophobicContact CD2-CE2 4.01Å; L133-F223 HydrophobicContact CD2-CG 3.86Å; L133-F223 HydrophobicContact CG-CB 4.04Å; L133-F223 HydrophobicContact CG-CD2 4.34Å; L133-F223 HydrophobicContact CG-CG 4.25Å; I136-F223 HydrophobicContact CD1-CD1 4.19Å; I136-F223 HydrophobicContact CD1-CE1 3.52Å; I136-F223 HydrophobicContact CD1-CE2 4.15Å; I136-F223 HydrophobicContact CD1-CZ 3.48Å; I136-F223 VanDerWaalsContact CD1-CZ 3.48Å; L141-F223 HydrophobicContact CB-CZ 4.41Å; L141-F223 HydrophobicContact CD1-CZ 4.24Å; L141-F223 HydrophobicContact CD2-CZ 4Å; L141-F223 HydrophobicContact CG-CZ 4.43Å; L195-F223 HydrophobicContact CD1-CE1 4.21Å; L195-F223 HydrophobicContact CD2-CE1 4.07Å; Y202-F223 HydrophobicContact CD2-CD1 4.17Å; Y202-F223 HydrophobicContact CD2-CE1 4.1Å; Y202-F223 HydrophobicContact CD2-CZ 4.42Å; Y202-F223 HydrophobicContact CE2-CD1 4.37Å; Y202-F223 HydrophobicContact CE2-CD2 4.24Å; Y202-F223 HydrophobicContact CE2-CE1 4.41Å; Y202-F223 HydrophobicContact CE2-CE2 4.3Å; Y202-F223 HydrophobicContact CE2-CG 4.29Å; Y202-F223 HydrophobicContact CE2-CZ 4.39Å; I220-F223 HydrophobicContact CG2-CE2 4.37Å; F223-F225 PolarHBondContact O-N 3.46Å; F223-F225 VanDerWaalsContact O-N 3.11Å; F223-A226 HydrophobicContact CB-CB 3.92Å; F223-A226 HydrophobicContact CD1-CB 3.57Å; F223-A226 HydrophobicContact CG-CB 4.18Å; F223-A226 WeakPolarHBondContact O-CB 3.39Å; F223-A226 PolarHBondContact O-N 2.83Å
224	G	91.2	Very high	94.6	Very high	11 Å²	11	44.8 Å²	44.8	11%	0.113	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.3	-177.1	0	0	0	0	0	114.4	D222	D222-G224 VanDerWaalsContact C-N 3.34Å; D222-G224 PolarHBondContact OD1-N 2.74Å; D222-G224 VanDerWaalsContact OD1-N 3.15Å
225	F	91.9	Very high	94.5	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.022	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	0.9	172.8	-64.4	-33.7	0	0	0	114	N10 Q12 Y202 R203 D204 F223 K227 C237 G238	N10-F225 HydrophobicContact CB-CE1 4.04Å; N10-F225 HydrophobicContact CB-CE2 4.03Å; N10-F225 HydrophobicContact CB-CZ 3.34Å; N10-F225 WeakPolarHBondContact ND2-CE2 3.3Å; N10-F225 WeakPolarHBondContact ND2-CZ 3.28Å; N10-F225 WeakPolarHBondContact OD1-CE2 3.33Å; N10-F225 WeakPolarHBondContact OD1-CZ 3.49Å; Q12-F225 HydrophobicContact CG-CE1 4.15Å; Q12-F225 HydrophobicContact CG-CZ 4.42Å; Y202-F225 CarbonylContact O-C 3.45Å; R203-F225 HydrophobicContact CB-CB 4.18Å; R203-F225 PolarHBondContact NE-O 2.92Å; R203-F225 PolarHBondContact NH2-O 2.79Å; D204-F225 HydrophobicContact CB-CD2 3.82Å; F223-F225 PolarHBondContact O-N 3.46Å; F223-F225 VanDerWaalsContact O-N 3.11Å; F225-K227 PolarHBondContact O-N 2.91Å; F225-C237 HydrophobicContact CD1-CB 3.94Å; F225-C237 HydrophobicContact CD2-CB 4.13Å; F225-C237 HydrophobicContact CE1-CB 3.8Å; F225-C237 HydrophobicContact CE2-CB 4.03Å; F225-C237 HydrophobicContact CG-CB 4.07Å; F225-C237 HydrophobicContact CZ-CB 3.79Å; F225-G238 VanDerWaalsContact CE2-N 3.27Å
226	A	95.1	Very high	94.3	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.033	21%	0.205	C	C	.	.			trans	-64.6	140.6	177.3	0	0	0	0	0	110.4	I132 I201 F223	I132-A226 VanDerWaalsContact CD1-C 3.45Å; I132-A226 HydrophobicContact CD1-CB 3.62Å; I132-A226 VanDerWaalsContact CD1-O 3.3Å; I132-A226 WeakPolarHBondContact CD1-O 3.42Å; I132-A226 HydrophobicContact CG2-CB 4.45Å; I201-A226 CarbonylContact O-C 3.54Å; I201-A226 VanDerWaalsContact O-CA 3.23Å; I201-A226 WeakPolarHBondContact O-CA 3.34Å; F223-A226 HydrophobicContact CB-CB 3.92Å; F223-A226 HydrophobicContact CD1-CB 3.57Å; F223-A226 HydrophobicContact CG-CB 4.18Å; F223-A226 WeakPolarHBondContact O-CB 3.39Å; F223-A226 PolarHBondContact O-N 2.83Å
227	K	94.4	Very high	93.9	Very high	52 Å²	52	43 Å²	43	23%	0.226	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	138.3	179.8	-169.8	168.5	178.8	150.2	0	111.2	E124 I201 F225 V229	E124-K227 IonicContact OE1-NZ 3.63Å; I201-K227 PolarHBondContact N-O 3.37Å; I201-K227 PolarHBondContact O-N 3.17Å; F225-K227 PolarHBondContact O-N 2.91Å; K227-V229 HydrophobicContact CB-CG2 4.06Å; K227-V229 HydrophobicContact CD-CG2 4.04Å; K227-V229 HydrophobicContact CG-CG2 3.68Å
228	R	95	Very high	93.5	Very high	77 Å²	77	43.3 Å²	43.3	29%	0.291	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	116.5	170.6	-162.4	174.9	-178.9	-172.1	-2.2	109.7	W68 L198 D199 L200	W68-R228 HydrophobicContact CH2-CB 4.22Å; W68-R228 HydrophobicContact CZ2-CB 4.4Å; L198-R228 PolarHBondContact O-NE 3.13Å; D199-R228 HydrophobicContact CB-CG 4.1Å; D199-R228 CarbonylContact O-C 3.59Å; D199-R228 VanDerWaalsContact O-CA 3.27Å; D199-R228 WeakPolarHBondContact O-CA 3.46Å; L200-R228 HydrophobicContact CD2-CB 3.75Å; L200-R228 HydrophobicContact CD2-CG 4.13Å
229	V	92.4	Very high	93.2	Very high	21 Å²	21	44.2 Å²	44.2	13%	0.127	22%	0.217	C	C	.	.			trans	-142.3	113.5	-173.6	-175.8	0	0	0	0	110.1	D199 I201 K227 T233	D199-V229 PolarHBondContact O-N 3.23Å; I201-V229 HydrophobicContact CD1-CB 3.88Å; I201-V229 HydrophobicContact CD1-CG1 4.37Å; I201-V229 HydrophobicContact CD1-CG2 4.13Å; I201-V229 HydrophobicContact CG1-CB 4.47Å; K227-V229 HydrophobicContact CB-CG2 4.06Å; K227-V229 HydrophobicContact CD-CG2 4.04Å; K227-V229 HydrophobicContact CG-CG2 3.68Å; V229-T233 HydrophobicContact CG2-CG2 4.4Å
230	K	90.8	Very high	93	Very high	174 Å²	174	44.9 Å²	44.9	76%	0.757	22%	0.222	S	C	*	.	S	Bend	trans	-80.3	-25.8	171.8	-69	-177.4	178	179.5	0	113.4	D199	D199-K230 HydrophobicContact CB-CG 4.27Å
231	G	93	Very high	93	Very high	47 Å²	47	47.5 Å²	47.5	49%	0.485	24%	0.235	S	C	.	.	S	Bend	trans	-113.5	-117.7	-176.6	0	0	0	0	0	112.7
232	R	93.9	Very high	93.1	Very high	164 Å²	164	46.9 Å²	46.9	62%	0.619	23%	0.229	S	C	*	.			trans	-118.3	159.8	176.6	-68.7	178.6	178.3	-176.5	2.4	110.7	W234 G252 Y253	R232-W234 HydrophobicContact CB-CH2 4.17Å; R232-W234 HydrophobicContact CB-CZ2 4.23Å; R232-W234 WeakPolarHBondContact O-CZ3 3.47Å; R232-G252 WeakPolarHBondContact CD-O 3.39Å; R232-Y253 CarbonylContact C-O 3.4Å; R232-Y253 WeakPolarHBondContact CA-O 3.28Å
233	T	93.6	Very high	93.4	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.049	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-134.1	163.1	169.4	-167.3	0	0	0	0	109.7	V229 G252 Y253	V229-T233 HydrophobicContact CG2-CG2 4.4Å; T233-G252 CarbonylContact O-C 3.52Å; T233-G252 WeakPolarHBondContact O-CA 3.02Å; T233-Y253 HydrophobicContact CG2-CD1 4.5Å; T233-Y253 HydrophobicContact CG2-CD2 3.91Å; T233-Y253 HydrophobicContact CG2-CE1 4.01Å; T233-Y253 HydrophobicContact CG2-CE2 3.34Å; T233-Y253 HydrophobicContact CG2-CG 4.46Å; T233-Y253 VanDerWaalsContact CG2-CZ 3.4Å; T233-Y253 PolarHBondContact N-O 3.12Å; T233-Y253 WeakPolarHBondContact O-CD1 3.23Å; T233-Y253 WeakPolarHBondContact O-CE1 3.38Å; T233-Y253 PolarHBondContact O-N 3.06Å
234	W	94.8	Very high	93.5	Very high	154 Å²	154	45.3 Å²	45.3	58%	0.583	22%	0.221	S	C	*	.			trans	-126.5	-5.3	-170.4	-65.5	-99.3	0	0	0	113.8	R232 L236	R232-W234 HydrophobicContact CB-CH2 4.17Å; R232-W234 HydrophobicContact CB-CZ2 4.23Å; R232-W234 WeakPolarHBondContact O-CZ3 3.47Å; W234-L236 PolarHBondContact O-N 2.54Å
235	T	90.3	Very high	93.9	Very high	44 Å²	44	44.9 Å²	44.9	27%	0.27	22%	0.216	S	C	.	.			trans	-63.3	121.1	-176.5	-47.6	0	0	0	0	110.9	C237 Y253	T235-C237 HydrophobicContact CG2-CB 4.35Å; T235-C237 PolarHBondContact O-N 2.92Å; T235-Y253 WeakPolarHBondContact O-CE1 3.37Å; T235-Y253 PolarHBondContact O-OH 3Å
236	L	91.1	Very high	94.1	Very high	54 Å²	54	45 Å²	45	28%	0.283	22%	0.217	S	C	.	.			trans	-71.4	107	169	-172.1	90.4	0	0	0	108.8	W234 I247	W234-L236 PolarHBondContact O-N 2.54Å; L236-I247 HydrophobicContact CD1-CG2 3.81Å
237	C	89.7	Confident	94.2	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.014	22%	0.217	C	C	.	.			trans	-155.7	163.2	179.4	58.4	0	0	0	0	110.7	Q12 F225 T235 L243	Q12-C237 HydrophobicContact CG-CB 4.08Å; F225-C237 HydrophobicContact CD1-CB 3.94Å; F225-C237 HydrophobicContact CD2-CB 4.13Å; F225-C237 HydrophobicContact CE1-CB 3.8Å; F225-C237 HydrophobicContact CE2-CB 4.03Å; F225-C237 HydrophobicContact CG-CB 4.07Å; F225-C237 HydrophobicContact CZ-CB 3.79Å; T235-C237 HydrophobicContact CG2-CB 4.35Å; T235-C237 PolarHBondContact O-N 2.92Å; C237-L243 WeakPolarHBondContact O-CD2 3.33Å
238	G	89.6	Confident	94.3	Very high	13 Å²	13	44.2 Å²	44.2	13%	0.134	21%	0.214	C	C	.	.	S	Bend	trans	109.5	-176.9	-173.3	0	0	0	0	0	112.1	F225	F225-G238 VanDerWaalsContact CE2-N 3.27Å
239	T	91.1	Very high	94.3	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.11	22%	0.22	C	C	.	.			trans	-96.1	134.6	-176.4	-58.7	0	0	0	0	110.7	D204 K206 E241 Y242 L243	D204-T239 PolarHBondContact OD1-N 2.96Å; D204-T239 PolarHBondContact OD1-OG1 3.02Å; K206-T239 HydrophobicContact CD-CG2 4.16Å; K206-T239 VanDerWaalsContact CD-OG1 3.28Å; K206-T239 WeakPolarHBondContact CD-OG1 3.4Å; K206-T239 PolarHBondContact NZ-OG1 2.79Å; T239-E241 VanDerWaalsContact C-N 3.32Å; T239-E241 PolarHBondContact O-N 3.02Å; T239-E241 VanDerWaalsContact O-N 3.11Å; T239-Y242 PolarHBondContact O-N 2.67Å; T239-L243 PolarHBondContact O-N 3.32Å
240	P	95.8	Very high	94.3	Very high	26 Å²	26	47.8 Å²	47.8	17%	0.169	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-49.3	-43.4	-167.3	-32.2	37.1	0	0	0	116.1	Y242 P281 I284 Y285 I288	P240-Y242 PolarHBondContact O-N 3.15Å; P240-P281 HydrophobicContact CB-CB 4.43Å; P240-P281 HydrophobicContact CG-CB 4.44Å; P240-I284 HydrophobicContact CB-CD1 4.26Å; P240-Y285 HydrophobicContact CB-CE1 3.87Å; P240-I288 WeakPolarHBondContact O-CD1 3.42Å
241	E	97.1	Very high	94.4	Very high	55 Å²	55	45.5 Å²	45.5	26%	0.257	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-67.3	-23.6	-178.8	-66	85.5	165.7	0	0	113.3	T239 V264 P274 I284	T239-E241 VanDerWaalsContact C-N 3.32Å; T239-E241 PolarHBondContact O-N 3.02Å; T239-E241 VanDerWaalsContact O-N 3.11Å; E241-V264 WeakPolarHBondContact O-CG1 3.41Å; E241-P274 HydrophobicContact CB-CB 4.28Å; E241-P274 HydrophobicContact CB-CG 4.48Å; E241-P274 HydrophobicContact CG-CB 4.44Å; E241-P274 HydrophobicContact CG-CG 4.1Å; E241-I284 HydrophobicContact CG-CD1 4.19Å
242	Y	98.1	Very high	94.5	Very high	14 Å²	14	43.8 Å²	43.8	6%	0.055	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-102.6	-8.5	-173.9	-76.8	-94.6	0	0	0	113.5	L205 K206 P207 T239 P240 A244 A261 V264 L265 E268	L205-Y242 WeakPolarHBondContact O-CD1 3.07Å; L205-Y242 WeakPolarHBondContact O-CE1 3.28Å; K206-Y242 HydrophobicContact CB-CD2 4.08Å; K206-Y242 HydrophobicContact CB-CE2 3.91Å; P207-Y242 WeakPolarHBondContact CD-OH 3.24Å; T239-Y242 PolarHBondContact O-N 2.67Å; P240-Y242 PolarHBondContact O-N 3.15Å; Y242-A244 PolarHBondContact O-N 2.92Å; Y242-A261 HydrophobicContact CD1-CB 4.14Å; Y242-V264 HydrophobicContact CD1-CB 3.66Å; Y242-V264 HydrophobicContact CD1-CG1 3.55Å; Y242-V264 HydrophobicContact CD2-CG1 4.09Å; Y242-V264 HydrophobicContact CE1-CB 3.73Å; Y242-V264 HydrophobicContact CE1-CG1 3.47Å; Y242-V264 VanDerWaalsContact CE1-CG1 3.47Å; Y242-V264 HydrophobicContact CE2-CG1 3.97Å; Y242-V264 HydrophobicContact CG-CB 4.35Å; Y242-V264 HydrophobicContact CG-CG1 3.87Å; Y242-L265 HydrophobicContact CE1-CB 4Å; Y242-E268 PolarHBondContact OH-OE2 2.59Å
243	L	97.6	Very high	94.6	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.037	19%	0.189	C	C	.	.			trans	-62.6	134.6	179.9	-65.2	-173.5	0	0	0	111.5	C237 T239 I247 I248 W260 Y285	C237-L243 WeakPolarHBondContact O-CD2 3.33Å; T239-L243 PolarHBondContact O-N 3.32Å; L243-I247 HydrophobicContact CD2-CD1 4.35Å; L243-I247 HydrophobicContact CD2-CG2 4.17Å; L243-I248 HydrophobicContact CB-CD1 4.05Å; L243-I248 HydrophobicContact CB-CG1 4Å; L243-I248 HydrophobicContact CD1-CG1 4.17Å; L243-W260 PolarHBondContact O-NE1 3.47Å; L243-W260 VanDerWaalsContact O-NE1 3.08Å; L243-Y285 HydrophobicContact CD1-CE1 3.74Å
244	A	97.9	Very high	94.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	20%	0.198	C	C	.	.			trans	-74.7	150.5	171.6	0	0	0	0	0	111	Y242 E246 I247 I248 V257 W260	Y242-A244 PolarHBondContact O-N 2.92Å; A244-E246 VanDerWaalsContact CB-CD 3.48Å; A244-E246 HydrophobicContact CB-CG 4.29Å; A244-E246 WeakPolarHBondContact CB-OE1 3.12Å; A244-E246 PolarHBondContact O-N 3.45Å; A244-E246 VanDerWaalsContact O-N 3.17Å; A244-I247 HydrophobicContact CB-CD1 4.34Å; A244-I247 HydrophobicContact CB-CG1 4.44Å; A244-I247 WeakPolarHBondContact O-CB 3.35Å; A244-I247 PolarHBondContact O-N 2.95Å; A244-I248 PolarHBondContact O-N 3.29Å; A244-V257 HydrophobicContact CB-CB 4Å; A244-V257 HydrophobicContact CB-CG1 3.82Å; A244-W260 HydrophobicContact CB-CB 4.02Å; A244-W260 HydrophobicContact CB-CD2 4.33Å; A244-W260 HydrophobicContact CB-CG 3.84Å
245	P	97.8	Very high	94.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-55.2	-37	-179	-24	31	0	0	0	113.3	I247 I248 L249 W260 I288 V313	P245-I247 VanDerWaalsContact C-N 3.33Å; P245-I247 PolarHBondContact O-N 3.39Å; P245-I248 PolarHBondContact O-N 3.44Å; P245-L249 WeakPolarHBondContact O-CB 3.46Å; P245-L249 WeakPolarHBondContact O-CG 3.44Å; P245-L249 PolarHBondContact O-N 2.98Å; P245-W260 HydrophobicContact CG-CE3 4.2Å; P245-W260 HydrophobicContact CG-CH2 3.5Å; P245-W260 VanDerWaalsContact CG-CH2 3.5Å; P245-W260 HydrophobicContact CG-CZ2 3.97Å; P245-W260 HydrophobicContact CG-CZ3 3.62Å; P245-I288 HydrophobicContact CB-CG2 4.31Å; P245-I288 HydrophobicContact CG-CG2 3.82Å; P245-V313 HydrophobicContact CB-CG1 4.21Å; P245-V313 HydrophobicContact CG-CG1 4.31Å; P245-V313 HydrophobicContact CG-CG2 4.09Å
246	E	97.5	Very high	95.2	Very high	7 Å²	7	32.5 Å²	32.5	3%	0.033	18%	0.175	C	C	.	.	H	α-helix	trans	-66.2	-30.9	178.3	61.1	-87.8	-157	0	0	113.7	A244 S250 K251 V257 L315 R318	A244-E246 VanDerWaalsContact CB-CD 3.48Å; A244-E246 HydrophobicContact CB-CG 4.29Å; A244-E246 WeakPolarHBondContact CB-OE1 3.12Å; A244-E246 PolarHBondContact O-N 3.45Å; A244-E246 VanDerWaalsContact O-N 3.17Å; E246-S250 PolarHBondContact O-N 2.9Å; E246-K251 HydrophobicContact CB-CB 4.09Å; E246-K251 PolarHBondContact O-N 3.2Å; E246-V257 HydrophobicContact CG-CG1 4.12Å; E246-V257 WeakPolarHBondContact OE1-CG1 3.38Å; E246-L315 WeakPolarHBondContact OE1-CD2 3.14Å; E246-R318 IonicContact OE1-CZ 3.48Å; E246-R318 IonicContact OE1-NH1 2.67Å; E246-R318 PolarHBondContact OE1-NH1 3.43Å; E246-R318 IonicContact OE1-NH2 3.44Å; E246-R318 PolarHBondContact OE1-NH2 3.31Å; E246-R318 IonicContact OE2-CZ 3.69Å; E246-R318 IonicContact OE2-NH1 3.59Å; E246-R318 IonicContact OE2-NH2 2.87Å; E246-R318 PolarHBondContact OE2-NH2 3.07Å
247	I	96.9	Very high	95.5	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-67.9	-48.6	173.8	-63.7	172.8	0	0	0	109.3	L236 L243 A244 P245 L249 S250 Y253 V257	L236-I247 HydrophobicContact CD1-CG2 3.81Å; L243-I247 HydrophobicContact CD2-CD1 4.35Å; L243-I247 HydrophobicContact CD2-CG2 4.17Å; A244-I247 HydrophobicContact CB-CD1 4.34Å; A244-I247 HydrophobicContact CB-CG1 4.44Å; A244-I247 WeakPolarHBondContact O-CB 3.35Å; A244-I247 PolarHBondContact O-N 2.95Å; P245-I247 VanDerWaalsContact C-N 3.33Å; P245-I247 PolarHBondContact O-N 3.39Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 3.5Å; I247-S250 PolarHBondContact O-N 2.98Å; I247-Y253 HydrophobicContact CD1-CD2 4.46Å; I247-Y253 HydrophobicContact CD1-CE2 4.35Å; I247-Y253 HydrophobicContact CG1-CD1 3.7Å; I247-Y253 HydrophobicContact CG1-CD2 4.19Å; I247-Y253 HydrophobicContact CG1-CE1 3.87Å; I247-Y253 HydrophobicContact CG1-CE2 4.35Å; I247-Y253 HydrophobicContact CG1-CG 3.86Å; I247-V257 HydrophobicContact CD1-CB 3.9Å; I247-V257 HydrophobicContact CD1-CG1 3.75Å; I247-V257 HydrophobicContact CD1-CG2 4.31Å; I247-V257 HydrophobicContact CG1-CG1 3.88Å
248	I	96	Very high	96	Very high	32 Å²	32	30.1 Å²	30.1	16%	0.164	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-42.5	179.8	-66.6	161.5	0	0	0	111	L243 A244 P245 S250 Y285 I288 V289	L243-I248 HydrophobicContact CB-CD1 4.05Å; L243-I248 HydrophobicContact CB-CG1 4Å; L243-I248 HydrophobicContact CD1-CG1 4.17Å; A244-I248 PolarHBondContact O-N 3.29Å; P245-I248 PolarHBondContact O-N 3.44Å; I248-S250 PolarHBondContact O-N 2.78Å; I248-Y285 HydrophobicContact CD1-CD1 3.85Å; I248-Y285 HydrophobicContact CD1-CG 4.28Å; I248-Y285 HydrophobicContact CG1-CD1 3.98Å; I248-Y285 HydrophobicContact CG1-CG 4.27Å; I248-Y285 HydrophobicContact CG2-CG 4.2Å; I248-I288 HydrophobicContact CD1-CB 3.77Å; I248-I288 HydrophobicContact CD1-CD1 3.82Å; I248-I288 HydrophobicContact CD1-CG1 4.4Å; I248-I288 HydrophobicContact CD1-CG2 3.47Å; I248-I288 VanDerWaalsContact CD1-CG2 3.47Å; I248-V289 HydrophobicContact CB-CG2 4.3Å; I248-V289 HydrophobicContact CG2-CG2 3.76Å
249	L	94.9	Very high	96.4	Very high	80 Å²	80	29.8 Å²	29.8	42%	0.419	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	6.6	178.2	-64.9	173.2	0	0	0	113.2	P245 I247 K251 V289	P245-L249 WeakPolarHBondContact O-CB 3.46Å; P245-L249 WeakPolarHBondContact O-CG 3.44Å; P245-L249 PolarHBondContact O-N 2.98Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 3.5Å; L249-K251 HydrophobicContact CB-CD 4.32Å; L249-K251 HydrophobicContact CB-CG 4.14Å; L249-K251 PolarHBondContact O-N 3.03Å; L249-K251 VanDerWaalsContact O-N 3.13Å; L249-V289 HydrophobicContact CD1-CG1 4.41Å; L249-V289 HydrophobicContact CD2-CG1 4.11Å; L249-V289 HydrophobicContact CD2-CG2 4.1Å; L249-V289 HydrophobicContact CG-CG2 4.13Å
250	S	94	Very high	96.8	Very high	93 Å²	93	28.9 Å²	28.9	65%	0.65	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	33.7	-179.1	-57	0	0	0	0	113.2	E246 I247 I248	E246-S250 PolarHBondContact O-N 2.9Å; I247-S250 PolarHBondContact O-N 2.98Å; I248-S250 PolarHBondContact O-N 2.78Å
251	K	93	Very high	96.9	Very high	126 Å²	126	28 Å²	28	55%	0.548	15%	0.146	S	C	.	.			trans	-86.4	131.5	171.6	-64.3	179.6	-179.6	177.9	0	107.4	E246 L249 Y253	E246-K251 HydrophobicContact CB-CB 4.09Å; E246-K251 PolarHBondContact O-N 3.2Å; L249-K251 HydrophobicContact CB-CD 4.32Å; L249-K251 HydrophobicContact CB-CG 4.14Å; L249-K251 PolarHBondContact O-N 3.03Å; L249-K251 VanDerWaalsContact O-N 3.13Å; K251-Y253 PolarHBondContact O-N 3.3Å
252	G	93.3	Very high	97	Very high	11 Å²	11	25.3 Å²	25.3	11%	0.113	13%	0.134	C	C	.	.			trans	-52	126.3	173.9	0	0	0	0	0	110.2	R232 T233	R232-G252 WeakPolarHBondContact CD-O 3.39Å; T233-G252 CarbonylContact O-C 3.52Å; T233-G252 WeakPolarHBondContact O-CA 3.02Å
253	Y	96.2	Very high	97	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.016	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-121.2	164.4	-168.8	65	-93.8	0	0	0	111.8	R203 R232 T233 T235 I247 K251 V257	R203-Y253 WeakPolarHBondContact CD-OH 3.39Å; R203-Y253 HydrophobicContact CG-CE2 4.48Å; R203-Y253 PolarHBondContact NH1-OH 3.34Å; R232-Y253 CarbonylContact C-O 3.4Å; R232-Y253 WeakPolarHBondContact CA-O 3.28Å; T233-Y253 HydrophobicContact CG2-CD1 4.5Å; T233-Y253 HydrophobicContact CG2-CD2 3.91Å; T233-Y253 HydrophobicContact CG2-CE1 4.01Å; T233-Y253 HydrophobicContact CG2-CE2 3.34Å; T233-Y253 HydrophobicContact CG2-CG 4.46Å; T233-Y253 VanDerWaalsContact CG2-CZ 3.4Å; T233-Y253 PolarHBondContact N-O 3.12Å; T233-Y253 WeakPolarHBondContact O-CD1 3.23Å; T233-Y253 WeakPolarHBondContact O-CE1 3.38Å; T233-Y253 PolarHBondContact O-N 3.06Å; T235-Y253 WeakPolarHBondContact O-CE1 3.37Å; T235-Y253 PolarHBondContact O-OH 3Å; I247-Y253 HydrophobicContact CD1-CD2 4.46Å; I247-Y253 HydrophobicContact CD1-CE2 4.35Å; I247-Y253 HydrophobicContact CG1-CD1 3.7Å; I247-Y253 HydrophobicContact CG1-CD2 4.19Å; I247-Y253 HydrophobicContact CG1-CE1 3.87Å; I247-Y253 HydrophobicContact CG1-CE2 4.35Å; I247-Y253 HydrophobicContact CG1-CG 3.86Å; K251-Y253 PolarHBondContact O-N 3.3Å; Y253-V257 HydrophobicContact CD2-CB 4.41Å; Y253-V257 HydrophobicContact CD2-CG1 3.58Å; Y253-V257 HydrophobicContact CD2-CG2 3.97Å; Y253-V257 HydrophobicContact CE2-CG1 4.44Å; Y253-V257 HydrophobicContact CE2-CG2 4.21Å; Y253-V257 HydrophobicContact CG-CG1 3.91Å
254	N	96.1	Very high	97.1	Very high	44 Å²	44	24.3 Å²	24.3	24%	0.235	13%	0.129	C	C	.	.			trans	-131.7	-164.3	-178.7	69.8	2.9	0	0	0	110.1	A256 V257 N321	N254-A256 PolarHBondContact O-N 2.98Å; N254-A256 WeakPolarHBondContact OD1-CB 3.48Å; N254-A256 PolarHBondContact OD1-N 2.96Å; N254-V257 WeakPolarHBondContact O-CG2 3.34Å; N254-V257 PolarHBondContact O-N 3.15Å; N254-N321 PolarHBondContact ND2-OD1 2.97Å
255	K	97.5	Very high	97.1	Very high	86 Å²	86	24.3 Å²	24.3	37%	0.374	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-13.2	178	64.1	179	174	-175.7	0	116.4	H196 I201 V257 D258	H196-K255 HydrophobicContact CB-CD 3.82Å; H196-K255 PolarHBondContact CE1-O 3.43Å; I201-K255 HydrophobicContact CG1-CB 4.14Å; K255-V257 PolarHBondContact O-N 2.89Å; K255-D258 PolarHBondContact O-N 2.84Å
256	A	98.1	Very high	97.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-18.7	176.5	0	0	0	0	0	114.1	N254 W259 W260 L315 R318 N321	N254-A256 PolarHBondContact O-N 2.98Å; N254-A256 WeakPolarHBondContact OD1-CB 3.48Å; N254-A256 PolarHBondContact OD1-N 2.96Å; A256-W259 PolarHBondContact O-N 2.77Å; A256-W260 PolarHBondContact O-N 2.93Å; A256-L315 HydrophobicContact CB-CD2 3.89Å; A256-R318 PolarHBondContact O-NH1 3.05Å; A256-N321 HydrophobicContact CB-CB 3.84Å
257	V	98.3	Very high	97.2	Very high	5 Å²	5	24.1 Å²	24.1	3%	0.03	13%	0.128	C	C	.	.	H	α-helix	trans	-69.6	-33.6	176.4	-56.4	0	0	0	0	112	I201 R203 A244 E246 I247 Y253 N254 K255 W259 W260 A261	I201-V257 HydrophobicContact CG2-CG2 3.93Å; R203-V257 HydrophobicContact CG-CG2 4.46Å; A244-V257 HydrophobicContact CB-CB 4Å; A244-V257 HydrophobicContact CB-CG1 3.82Å; E246-V257 HydrophobicContact CG-CG1 4.12Å; E246-V257 WeakPolarHBondContact OE1-CG1 3.38Å; I247-V257 HydrophobicContact CD1-CB 3.9Å; I247-V257 HydrophobicContact CD1-CG1 3.75Å; I247-V257 HydrophobicContact CD1-CG2 4.31Å; I247-V257 HydrophobicContact CG1-CG1 3.88Å; Y253-V257 HydrophobicContact CD2-CB 4.41Å; Y253-V257 HydrophobicContact CD2-CG1 3.58Å; Y253-V257 HydrophobicContact CD2-CG2 3.97Å; Y253-V257 HydrophobicContact CE2-CG1 4.44Å; Y253-V257 HydrophobicContact CE2-CG2 4.21Å; Y253-V257 HydrophobicContact CG-CG1 3.91Å; N254-V257 WeakPolarHBondContact O-CG2 3.34Å; N254-V257 PolarHBondContact O-N 3.15Å; K255-V257 PolarHBondContact O-N 2.89Å; V257-W259 VanDerWaalsContact C-N 3.34Å; V257-W260 WeakPolarHBondContact O-CB 3.41Å; V257-W260 PolarHBondContact O-N 3.5Å; V257-A261 PolarHBondContact O-N 3.47Å
258	D	98.7	Very high	97.3	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-39.7	175.9	-73.7	-18.5	0	0	0	110.3	F192 H196 I201 Y202 R203 K255 W260 A261 L262	F192-D258 HydrophobicContact CD2-CB 3.93Å; F192-D258 HydrophobicContact CE1-CB 4.29Å; F192-D258 HydrophobicContact CE2-CB 3.64Å; F192-D258 VanDerWaalsContact CE2-O 3.25Å; F192-D258 WeakPolarHBondContact CE2-O 3.39Å; F192-D258 HydrophobicContact CG-CB 4.38Å; F192-D258 HydrophobicContact CZ-CB 3.8Å; H196-D258 IonicContact CD2-OD2 2.8Å; H196-D258 IonicContact CE1-OD2 2.71Å; H196-D258 IonicContact NE2-OD2 3.36Å; H196-D258 PolarHBondContact NE2-OD2 2.94Å; I201-D258 VanDerWaalsContact CG2-OD2 3.31Å; I201-D258 WeakPolarHBondContact CG2-OD2 3.24Å; Y202-D258 PolarHBondContact N-OD1 3.05Å; Y202-D258 PolarHBondContact N-OD2 3.2Å; R203-D258 PolarHBondContact N-OD1 2.71Å; K255-D258 PolarHBondContact O-N 2.84Å; D258-W260 PolarHBondContact O-N 3.26Å; D258-A261 PolarHBondContact O-N 3.41Å; D258-L262 PolarHBondContact O-N 2.81Å
259	W	98.8	Very high	97.5	Very high	5 Å²	5	22.5 Å²	22.5	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-33.1	176	-61.1	122.7	0	0	0	113.2	V189 F192 H196 A256 V257 L262 G263 L310 G320 V326 I329	V189-W259 HydrophobicContact CG2-CZ3 4.31Å; F192-W259 HydrophobicContact CB-CH2 3.57Å; F192-W259 HydrophobicContact CB-CZ2 4.03Å; F192-W259 HydrophobicContact CB-CZ3 3.93Å; F192-W259 HydrophobicContact CD2-CE3 4.06Å; F192-W259 HydrophobicContact CD2-CH2 4.42Å; F192-W259 AromaticContact CD2-CZ3 3.95Å; F192-W259 HydrophobicContact CD2-CZ3 3.95Å; F192-W259 HydrophobicContact CG-CZ3 4.48Å; H196-W259 AromaticContact CE1-CE2 3.64Å; H196-W259 AromaticContact CE1-CZ2 3.89Å; H196-W259 AromaticContact CE1-NE1 3.45Å; H196-W259 PolarHBondContact CE1-NE1 2.92Å; H196-W259 AromaticContact ND1-CE2 3.63Å; H196-W259 AromaticContact ND1-CZ2 3.61Å; H196-W259 AromaticContact ND1-NE1 3.37Å; H196-W259 PolarHBondContact ND1-NE1 3.39Å; A256-W259 PolarHBondContact O-N 2.77Å; V257-W259 VanDerWaalsContact C-N 3.34Å; W259-L262 HydrophobicContact CE3-CD2 3.73Å; W259-L262 HydrophobicContact CZ3-CD2 3.88Å; W259-G263 PolarHBondContact O-N 2.87Å; W259-L310 HydrophobicContact CB-CD2 4.38Å; W259-G320 PolarHBondContact NE1-O 3.16Å; W259-V326 HydrophobicContact CH2-CB 4.24Å; W259-V326 HydrophobicContact CH2-CG2 3.55Å; W259-V326 HydrophobicContact CZ2-CB 4.17Å; W259-V326 HydrophobicContact CZ2-CG2 3.98Å; W259-V326 HydrophobicContact CZ3-CG2 4.33Å; W259-I329 HydrophobicContact CD2-CD1 3.67Å; W259-I329 HydrophobicContact CE3-CD1 3.26Å; W259-I329 HydrophobicContact CG-CD1 4.31Å; W259-I329 HydrophobicContact CH2-CD1 4.27Å; W259-I329 HydrophobicContact CZ3-CD1 3.59Å
260	W	98.7	Very high	97.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.8	-49.7	168.7	171.3	-81.8	0	0	0	110.9	L243 A244 P245 A256 V257 D258 L262 G263 V264 F276 I288 L311 V313	L243-W260 PolarHBondContact O-NE1 3.47Å; L243-W260 VanDerWaalsContact O-NE1 3.08Å; A244-W260 HydrophobicContact CB-CB 4.02Å; A244-W260 HydrophobicContact CB-CD2 4.33Å; A244-W260 HydrophobicContact CB-CG 3.84Å; P245-W260 HydrophobicContact CG-CE3 4.2Å; P245-W260 HydrophobicContact CG-CH2 3.5Å; P245-W260 VanDerWaalsContact CG-CH2 3.5Å; P245-W260 HydrophobicContact CG-CZ2 3.97Å; P245-W260 HydrophobicContact CG-CZ3 3.62Å; A256-W260 PolarHBondContact O-N 2.93Å; V257-W260 WeakPolarHBondContact O-CB 3.41Å; V257-W260 PolarHBondContact O-N 3.5Å; D258-W260 PolarHBondContact O-N 3.26Å; W260-L262 PolarHBondContact O-N 3.21Å; W260-G263 WeakPolarHBondContact O-CA 3.4Å; W260-G263 PolarHBondContact O-N 3.24Å; W260-V264 PolarHBondContact O-N 2.91Å; W260-F276 HydrophobicContact CH2-CE2 4.13Å; W260-F276 HydrophobicContact CH2-CZ 4.23Å; W260-F276 HydrophobicContact CZ2-CD2 4.43Å; W260-F276 AromaticContact CZ2-CE2 3.57Å; W260-F276 HydrophobicContact CZ2-CE2 3.57Å; W260-F276 HydrophobicContact CZ2-CZ 4.12Å; W260-I288 HydrophobicContact CH2-CG2 4.34Å; W260-I288 HydrophobicContact CZ2-CG2 3.77Å; W260-L311 HydrophobicContact CD2-CD2 4.11Å; W260-L311 HydrophobicContact CE3-CD2 4.44Å; W260-L311 HydrophobicContact CH2-CB 4.47Å; W260-L311 HydrophobicContact CZ2-CD2 4.29Å; W260-L311 HydrophobicContact CZ3-CB 4.3Å; W260-V313 HydrophobicContact CZ3-CG2 4.41Å
261	A	98.8	Very high	97.8	Very high	6 Å²	6	14.8 Å²	14.8	5%	0.05	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-34.8	179.4	0	0	0	0	0	112	L205 Y242 V257 D258 G263 V264 L265	L205-A261 HydrophobicContact CB-CB 3.98Å; L205-A261 HydrophobicContact CD2-CB 4.24Å; Y242-A261 HydrophobicContact CD1-CB 4.14Å; V257-A261 PolarHBondContact O-N 3.47Å; D258-A261 PolarHBondContact O-N 3.41Å; A261-G263 VanDerWaalsContact C-N 3.32Å; A261-G263 PolarHBondContact O-N 3.41Å; A261-V264 WeakPolarHBondContact O-CB 3.37Å; A261-V264 PolarHBondContact O-N 3.35Å; A261-L265 WeakPolarHBondContact O-CB 3.28Å; A261-L265 PolarHBondContact O-N 3.45Å
262	L	98.9	Very high	98.1	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.2	-42.5	170.3	174.8	65.6	0	0	0	111.5	I188 V189 F192 L205 D258 W259 W260 V264 L265 I266 L310	I188-L262 HydrophobicContact CB-CD1 4.03Å; I188-L262 HydrophobicContact CG2-CD1 3.86Å; V189-L262 HydrophobicContact CG2-CD2 3.57Å; F192-L262 HydrophobicContact CE2-CB 4.28Å; L205-L262 HydrophobicContact CD2-CB 4.35Å; D258-L262 PolarHBondContact O-N 2.81Å; W259-L262 HydrophobicContact CE3-CD2 3.73Å; W259-L262 HydrophobicContact CZ3-CD2 3.88Å; W260-L262 PolarHBondContact O-N 3.21Å; L262-V264 VanDerWaalsContact C-N 3.33Å; L262-V264 PolarHBondContact O-N 3.43Å; L262-L265 PolarHBondContact O-N 3.5Å; L262-I266 HydrophobicContact CD1-CD1 3.86Å; L262-I266 HydrophobicContact CD1-CG1 4.02Å; L262-I266 HydrophobicContact CD2-CD1 4.44Å; L262-I266 HydrophobicContact CG-CD1 3.82Å; L262-I266 HydrophobicContact CG-CG1 4.37Å; L262-I266 VanDerWaalsContact O-CG1 3.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.27Å; L262-I266 PolarHBondContact O-N 3.13Å; L262-L310 HydrophobicContact CD2-CD1 4.33Å; L262-L310 HydrophobicContact CG-CD1 4.31Å
263	G	98.8	Very high	98.3	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.3	-42	174.1	0	0	0	0	0	112.5	W259 W260 A261 Y267 L307	W259-G263 PolarHBondContact O-N 2.87Å; W260-G263 WeakPolarHBondContact O-CA 3.4Å; W260-G263 PolarHBondContact O-N 3.24Å; A261-G263 VanDerWaalsContact C-N 3.32Å; A261-G263 PolarHBondContact O-N 3.41Å; G263-Y267 WeakPolarHBondContact O-CB 3.3Å; G263-Y267 PolarHBondContact O-N 3.26Å; G263-L307 WeakPolarHBondContact O-CD2 3.42Å
264	V	98.8	Very high	98.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.2	-46.5	175.9	-179.5	0	0	0	0	110.2	E241 Y242 W260 A261 L262 Y267 E268 P275 L311	E241-V264 WeakPolarHBondContact O-CG1 3.41Å; Y242-V264 HydrophobicContact CD1-CB 3.66Å; Y242-V264 HydrophobicContact CD1-CG1 3.55Å; Y242-V264 HydrophobicContact CD2-CG1 4.09Å; Y242-V264 HydrophobicContact CE1-CB 3.73Å; Y242-V264 HydrophobicContact CE1-CG1 3.47Å; Y242-V264 VanDerWaalsContact CE1-CG1 3.47Å; Y242-V264 HydrophobicContact CE2-CG1 3.97Å; Y242-V264 HydrophobicContact CG-CB 4.35Å; Y242-V264 HydrophobicContact CG-CG1 3.87Å; W260-V264 PolarHBondContact O-N 2.91Å; A261-V264 WeakPolarHBondContact O-CB 3.37Å; A261-V264 PolarHBondContact O-N 3.35Å; L262-V264 VanDerWaalsContact C-N 3.33Å; L262-V264 PolarHBondContact O-N 3.43Å; V264-Y267 PolarHBondContact O-N 2.76Å; V264-E268 WeakPolarHBondContact O-CB 3.27Å; V264-E268 PolarHBondContact O-N 2.8Å; V264-P275 HydrophobicContact CB-CG 4.35Å; V264-P275 HydrophobicContact CG1-CG 4.05Å; V264-P275 HydrophobicContact CG2-CG 4.21Å; V264-L311 HydrophobicContact CG2-CD2 3.65Å
265	L	98.8	Very high	98.5	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.3	-48.4	179.3	-177.1	68.2	0	0	0	112	M166 I188 L205 P207 L210 Y242 A261 L262 Y267 E268 M269	M166-L265 HydrophobicContact SD-CD1 4.45Å; I188-L265 HydrophobicContact CG1-CD2 3.99Å; L205-L265 HydrophobicContact CD1-CD2 4.05Å; L205-L265 HydrophobicContact CD2-CB 4.09Å; L205-L265 HydrophobicContact CD2-CD2 3.84Å; L205-L265 HydrophobicContact CG-CD2 4.05Å; P207-L265 HydrophobicContact CG-CD1 3.8Å; L210-L265 HydrophobicContact CD1-CD1 3.99Å; L210-L265 HydrophobicContact CD1-CD2 3.66Å; L210-L265 HydrophobicContact CD1-CG 4.48Å; Y242-L265 HydrophobicContact CE1-CB 4Å; A261-L265 WeakPolarHBondContact O-CB 3.28Å; A261-L265 PolarHBondContact O-N 3.45Å; L262-L265 PolarHBondContact O-N 3.5Å; L265-Y267 VanDerWaalsContact C-N 3.32Å; L265-Y267 PolarHBondContact O-N 2.72Å; L265-E268 PolarHBondContact O-N 3.36Å; L265-M269 HydrophobicContact CD1-CG 4.46Å; L265-M269 HydrophobicContact CD2-CE 4.42Å; L265-M269 HydrophobicContact CG-CE 4.07Å; L265-M269 HydrophobicContact CG-CG 4.5Å; L265-M269 HydrophobicContact CG-SD 4.44Å; L265-M269 WeakPolarHBondContact O-CB 3.44Å; L265-M269 WeakPolarHBondContact O-CG 3.38Å; L265-M269 PolarHBondContact O-N 3.3Å
266	I	98.9	Very high	98.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61	-43.9	178.8	-67.9	169.8	0	0	0	110.4	A185 L262 M269 A270 L303 L306 L307 L310 W334	A185-I266 HydrophobicContact CB-CD1 3.85Å; A185-I266 HydrophobicContact CB-CG1 3.69Å; L262-I266 HydrophobicContact CD1-CD1 3.86Å; L262-I266 HydrophobicContact CD1-CG1 4.02Å; L262-I266 HydrophobicContact CD2-CD1 4.44Å; L262-I266 HydrophobicContact CG-CD1 3.82Å; L262-I266 HydrophobicContact CG-CG1 4.37Å; L262-I266 VanDerWaalsContact O-CG1 3.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.27Å; L262-I266 PolarHBondContact O-N 3.13Å; I266-M269 HydrophobicContact CG1-CE 4.25Å; I266-A270 WeakPolarHBondContact O-CB 3.44Å; I266-A270 PolarHBondContact O-N 3.23Å; I266-A270 VanDerWaalsContact O-N 3.12Å; I266-L303 HydrophobicContact CG2-CD1 3.51Å; I266-L306 HydrophobicContact CD1-CD2 4.19Å; I266-L307 HydrophobicContact CB-CD2 4Å; I266-L307 HydrophobicContact CG2-CD2 3.94Å; I266-L310 HydrophobicContact CD1-CD1 4.05Å; I266-W334 HydrophobicContact CD1-CZ3 4.31Å; I266-W334 HydrophobicContact CG2-CH2 3.86Å; I266-W334 HydrophobicContact CG2-CZ2 4.33Å; I266-W334 HydrophobicContact CG2-CZ3 4.29Å
267	Y	98.8	Very high	98.4	Very high	5 Å²	5	13.3 Å²	13.3	2%	0.02	7%	0.065	C	C	.	.	H	α-helix	trans	-58.7	-50.6	175.4	-176.7	-68.3	0	0	0	110.2	G263 V264 L265 M269 A270 A271 Y273 P275 V293 K294 F295 F299 L307	G263-Y267 WeakPolarHBondContact O-CB 3.3Å; G263-Y267 PolarHBondContact O-N 3.26Å; V264-Y267 PolarHBondContact O-N 2.76Å; L265-Y267 VanDerWaalsContact C-N 3.32Å; L265-Y267 PolarHBondContact O-N 2.72Å; Y267-M269 PolarHBondContact O-N 2.83Å; Y267-A270 PolarHBondContact O-N 3.09Å; Y267-A271 HydrophobicContact CD1-CB 3.84Å; Y267-A271 HydrophobicContact CE1-CB 3.57Å; Y267-A271 WeakPolarHBondContact O-CB 3.31Å; Y267-A271 PolarHBondContact O-N 3.45Å; Y267-Y273 VanDerWaalsContact CD1-O 3.26Å; Y267-Y273 WeakPolarHBondContact CD1-O 3.38Å; Y267-Y273 HydrophobicContact CE1-CD2 4.05Å; Y267-Y273 AromaticContact CE1-CE2 3.81Å; Y267-Y273 HydrophobicContact CE1-CE2 3.81Å; Y267-Y273 VanDerWaalsContact CE1-O 3.26Å; Y267-Y273 WeakPolarHBondContact CE1-O 3.33Å; Y267-Y273 WeakPolarHBondContact OH-CE2 3.38Å; Y267-P275 HydrophobicContact CD1-CB 3.87Å; Y267-P275 VanDerWaalsContact CD1-CD 3.49Å; Y267-P275 HydrophobicContact CD1-CG 4.19Å; Y267-P275 HydrophobicContact CD2-CB 3.75Å; Y267-P275 HydrophobicContact CD2-CG 4.44Å; Y267-P275 HydrophobicContact CE1-CB 4.04Å; Y267-P275 HydrophobicContact CE2-CB 3.9Å; Y267-P275 HydrophobicContact CG-CB 3.75Å; Y267-P275 HydrophobicContact CG-CG 4.04Å; Y267-V293 HydrophobicContact CD2-CG1 4.16Å; Y267-V293 HydrophobicContact CE2-CG1 3.81Å; Y267-K294 WeakPolarHBondContact CE2-O 3.44Å; Y267-K294 PolarHBondContact OH-O 3.32Å; Y267-F295 HydrophobicContact CD2-CD1 4.22Å; Y267-F295 HydrophobicContact CD2-CE1 4.27Å; Y267-F295 AromaticContact CE2-CD1 3.98Å; Y267-F295 HydrophobicContact CE2-CD1 3.98Å; Y267-F295 HydrophobicContact CE2-CE1 4.34Å; Y267-F299 AromaticContact CD2-CE2 3.94Å; Y267-F299 HydrophobicContact CD2-CE2 3.94Å; Y267-F299 HydrophobicContact CD2-CZ 4.43Å; Y267-F299 HydrophobicContact CE2-CE2 4.16Å; Y267-F299 HydrophobicContact CG-CE2 4.39Å; Y267-F299 HydrophobicContact CG-CZ 4.5Å; Y267-L307 HydrophobicContact CD2-CD1 4.04Å
268	E	98.7	Very high	98.3	Very high	6 Å²	6	14.2 Å²	14.2	3%	0.028	7%	0.074	C	C	.	.	H	α-helix	trans	-62.8	-42.9	-176.5	-173.7	170.3	176.2	0	0	112.1	L170 R171 Y242 V264 L265 A270 G272 Y273	L170-E268 HydrophobicContact CD2-CG 4.05Å; R171-E268 IonicContact CZ-OE1 3.74Å; R171-E268 IonicContact NH2-OE1 2.71Å; R171-E268 PolarHBondContact NH2-OE1 3.21Å; Y242-E268 PolarHBondContact OH-OE2 2.59Å; V264-E268 WeakPolarHBondContact O-CB 3.27Å; V264-E268 PolarHBondContact O-N 2.8Å; L265-E268 PolarHBondContact O-N 3.36Å; E268-A270 PolarHBondContact O-N 2.96Å; E268-G272 VanDerWaalsContact O-CA 3.28Å; E268-G272 WeakPolarHBondContact O-CA 3.42Å; E268-G272 PolarHBondContact O-N 2.93Å; E268-Y273 WeakPolarHBondContact CA-O 3.49Å
269	M	98.7	Very high	98.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58	-47.4	174.7	-73.2	-170.4	-63.4	0	0	111.8	M166 F176 S181 Y184 A185 L265 I266 Y267	M166-M269 HydrophobicContact CE-SD 4.15Å; M166-M269 HydrophobicContact SD-CG 4.17Å; M166-M269 HydrophobicContact SD-SD 3.82Å; F176-M269 HydrophobicContact CD2-CB 3.93Å; F176-M269 HydrophobicContact CD2-CG 3.89Å; F176-M269 HydrophobicContact CD2-SD 4.06Å; F176-M269 HydrophobicContact CE2-CG 4.21Å; F176-M269 HydrophobicContact CE2-SD 4.32Å; F176-M269 PolarHBondContact N-O 2.83Å; S181-M269 WeakPolarHBondContact O-CE 3.47Å; Y184-M269 HydrophobicContact CD2-SD 4.04Å; Y184-M269 HydrophobicContact CG-SD 4.46Å; A185-M269 HydrophobicContact CB-CE 4.3Å; L265-M269 HydrophobicContact CD1-CG 4.46Å; L265-M269 HydrophobicContact CD2-CE 4.42Å; L265-M269 HydrophobicContact CG-CE 4.07Å; L265-M269 HydrophobicContact CG-CG 4.5Å; L265-M269 HydrophobicContact CG-SD 4.44Å; L265-M269 WeakPolarHBondContact O-CB 3.44Å; L265-M269 WeakPolarHBondContact O-CG 3.38Å; L265-M269 PolarHBondContact O-N 3.3Å; I266-M269 HydrophobicContact CG1-CE 4.25Å; Y267-M269 PolarHBondContact O-N 2.83Å
270	A	98.6	Very high	97.9	Very high	3 Å²	3	27.2 Å²	27.2	3%	0.025	14%	0.14	C	C	.	.	H	α-helix	trans	-80.2	-25.5	-175.1	0	0	0	0	0	114.1	I266 Y267 E268 H298 F299 L303	I266-A270 WeakPolarHBondContact O-CB 3.44Å; I266-A270 PolarHBondContact O-N 3.23Å; I266-A270 VanDerWaalsContact O-N 3.12Å; Y267-A270 PolarHBondContact O-N 3.09Å; E268-A270 PolarHBondContact O-N 2.96Å; A270-H298 PolarHBondContact O-NE2 3.24Å; A270-F299 HydrophobicContact CB-CD1 4.49Å; A270-F299 HydrophobicContact CB-CE1 3.61Å; A270-F299 HydrophobicContact CB-CZ 3.73Å; A270-L303 HydrophobicContact CB-CD2 3.86Å
271	A	98.4	Very high	97.7	Very high	9 Å²	9	30 Å²	30	7%	0.074	16%	0.158	C	C	.	.	H	α-helix	trans	-95.5	-32.8	-179.8	0	0	0	0	0	113.2	Y267 Y273 P296 F299	Y267-A271 HydrophobicContact CD1-CB 3.84Å; Y267-A271 HydrophobicContact CE1-CB 3.57Å; Y267-A271 WeakPolarHBondContact O-CB 3.31Å; Y267-A271 PolarHBondContact O-N 3.45Å; A271-Y273 HydrophobicContact CB-CD1 4.11Å; A271-Y273 HydrophobicContact CB-CD2 4.48Å; A271-Y273 HydrophobicContact CB-CE1 3.93Å; A271-Y273 HydrophobicContact CB-CE2 4.3Å; A271-Y273 HydrophobicContact CB-CG 4.39Å; A271-Y273 WeakPolarHBondContact O-CD1 3.39Å; A271-P296 HydrophobicContact CB-CG 4.01Å; A271-F299 HydrophobicContact CB-CE1 4.17Å; A271-F299 HydrophobicContact CB-CZ 3.87Å
272	G	97.8	Very high	97.5	Very high	10 Å²	10	34.2 Å²	34.2	10%	0.103	18%	0.179	C	C	.	.	S	Bend	trans	88.5	-0.4	-169.5	0	0	0	0	0	114.9	R171 G174 E268	R171-G272 PolarHBondContact NH1-O 3.26Å; G174-G272 WeakPolarHBondContact O-CA 3.27Å; E268-G272 VanDerWaalsContact O-CA 3.28Å; E268-G272 WeakPolarHBondContact O-CA 3.42Å; E268-G272 PolarHBondContact O-N 2.93Å
273	Y	97.5	Very high	97.4	Very high	90 Å²	90	37.8 Å²	37.8	35%	0.353	20%	0.195	S	C	.	.	S	Bend	trans	-151.3	150	179.6	58.5	-93	0	0	0	109.3	Y267 E268 A271 F277	Y267-Y273 VanDerWaalsContact CD1-O 3.26Å; Y267-Y273 WeakPolarHBondContact CD1-O 3.38Å; Y267-Y273 HydrophobicContact CE1-CD2 4.05Å; Y267-Y273 AromaticContact CE1-CE2 3.81Å; Y267-Y273 HydrophobicContact CE1-CE2 3.81Å; Y267-Y273 VanDerWaalsContact CE1-O 3.26Å; Y267-Y273 WeakPolarHBondContact CE1-O 3.33Å; Y267-Y273 WeakPolarHBondContact OH-CE2 3.38Å; E268-Y273 WeakPolarHBondContact CA-O 3.49Å; A271-Y273 HydrophobicContact CB-CD1 4.11Å; A271-Y273 HydrophobicContact CB-CD2 4.48Å; A271-Y273 HydrophobicContact CB-CE1 3.93Å; A271-Y273 HydrophobicContact CB-CE2 4.3Å; A271-Y273 HydrophobicContact CB-CG 4.39Å; A271-Y273 WeakPolarHBondContact O-CD1 3.39Å; Y273-F277 HydrophobicContact CD2-CD1 4.27Å; Y273-F277 AromaticContact CD2-CE1 3.72Å; Y273-F277 HydrophobicContact CD2-CE1 3.72Å; Y273-F277 HydrophobicContact CE2-CE1 4.17Å
274	P	97.9	Very high	97.3	Very high	10 Å²	10	38 Å²	38	7%	0.065	20%	0.197	C	C	.	.			trans	-70.3	157.5	-177.4	28.9	-35.5	0	0	0	112	E241 F276 F277	E241-P274 HydrophobicContact CB-CB 4.28Å; E241-P274 HydrophobicContact CB-CG 4.48Å; E241-P274 HydrophobicContact CG-CB 4.44Å; E241-P274 HydrophobicContact CG-CG 4.1Å; P274-F276 PolarHBondContact O-N 3.08Å; P274-F277 HydrophobicContact CG-CB 4.06Å; P274-F277 VanDerWaalsContact O-CD1 3.31Å; P274-F277 WeakPolarHBondContact O-CD1 3.49Å
275	P	98.2	Very high	97.2	Very high	15 Å²	15	40.9 Å²	40.9	10%	0.097	21%	0.208	C	C	.	.	S	Bend	trans	-64.3	-27	-179.4	23.7	-32	0	0	0	113.5	V264 Y267 V293 L311	V264-P275 HydrophobicContact CB-CG 4.35Å; V264-P275 HydrophobicContact CG1-CG 4.05Å; V264-P275 HydrophobicContact CG2-CG 4.21Å; Y267-P275 HydrophobicContact CD1-CB 3.87Å; Y267-P275 VanDerWaalsContact CD1-CD 3.49Å; Y267-P275 HydrophobicContact CD1-CG 4.19Å; Y267-P275 HydrophobicContact CD2-CB 3.75Å; Y267-P275 HydrophobicContact CD2-CG 4.44Å; Y267-P275 HydrophobicContact CE1-CB 4.04Å; Y267-P275 HydrophobicContact CE2-CB 3.9Å; Y267-P275 HydrophobicContact CG-CB 3.75Å; Y267-P275 HydrophobicContact CG-CG 4.04Å; P275-V293 HydrophobicContact CB-CG1 4.27Å; P275-L311 HydrophobicContact CB-CD1 4.2Å; P275-L311 HydrophobicContact CG-CD1 4.13Å
276	F	97.9	Very high	97.1	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.018	24%	0.236	C	C	.	.	S	Bend	trans	-129.7	112.4	179.1	-45	-75.4	0	0	0	108.7	W260 P274 I284 K287 I288 V293	W260-F276 HydrophobicContact CH2-CE2 4.13Å; W260-F276 HydrophobicContact CH2-CZ 4.23Å; W260-F276 HydrophobicContact CZ2-CD2 4.43Å; W260-F276 AromaticContact CZ2-CE2 3.57Å; W260-F276 HydrophobicContact CZ2-CE2 3.57Å; W260-F276 HydrophobicContact CZ2-CZ 4.12Å; P274-F276 PolarHBondContact O-N 3.08Å; F276-I284 HydrophobicContact CB-CG2 4.33Å; F276-K287 HydrophobicContact CB-CB 4.33Å; F276-K287 HydrophobicContact CD1-CB 4.04Å; F276-I288 HydrophobicContact CB-CG1 3.79Å; F276-I288 HydrophobicContact CD1-CG1 4.36Å; F276-I288 HydrophobicContact CD2-CG1 3.56Å; F276-I288 HydrophobicContact CE2-CG1 4.2Å; F276-I288 HydrophobicContact CG-CG1 3.65Å; F276-V293 HydrophobicContact CE1-CG2 3.94Å; F276-V293 HydrophobicContact CE2-CG2 4.43Å; F276-V293 HydrophobicContact CZ-CG2 3.52Å
277	F	95.8	Very high	97.1	Very high	110 Å²	110	51.3 Å²	51.3	48%	0.482	26%	0.255	S	S	.	.			trans	-140.3	150.6	175.6	59.2	-81.9	0	0	0	110.5	Y273 P274 K287	Y273-F277 HydrophobicContact CD2-CD1 4.27Å; Y273-F277 AromaticContact CD2-CE1 3.72Å; Y273-F277 HydrophobicContact CD2-CE1 3.72Å; Y273-F277 HydrophobicContact CE2-CE1 4.17Å; P274-F277 HydrophobicContact CG-CB 4.06Å; P274-F277 VanDerWaalsContact O-CD1 3.31Å; P274-F277 WeakPolarHBondContact O-CD1 3.49Å; F277-K287 PolarHBondContact O-NZ 2.84Å
278	A	96.4	Very high	97	Very high	25 Å²	25	51.1 Å²	51.1	21%	0.207	25%	0.254	C	S	.	.			trans	-164.6	170.5	174.7	0	0	0	0	0	108.8	Q280 Q283 I284	A278-Q280 VanDerWaalsContact C-N 3.33Å; A278-Q283 HydrophobicContact CB-CB 3.46Å; A278-Q283 VanDerWaalsContact CB-CB 3.46Å; A278-I284 HydrophobicContact CB-CG1 3.82Å
279	D	94.7	Very high	96.9	Very high	165 Å²	165	53.3 Å²	53.3	88%	0.882	27%	0.268	S	S	*	.	S	Bend	trans	-73.4	-27.6	-177.9	-60.9	-32.1	0	0	0	112.6
280	Q	94.5	Very high	96.7	Very high	113 Å²	113	56.4 Å²	56.4	53%	0.528	29%	0.29	S	S	.	.	S	Bend	trans	-119.2	138.1	-179.7	-63.2	-176.4	4.8	0	0	111.2	A278 I282 Q283 I284	A278-Q280 VanDerWaalsContact C-N 3.33Å; Q280-I282 HydrophobicContact CB-CG2 4.12Å; Q280-I282 PolarHBondContact O-N 2.85Å; Q280-I282 VanDerWaalsContact O-N 3.11Å; Q280-Q283 HydrophobicContact CB-CG 4.4Å; Q280-Q283 WeakPolarHBondContact O-CB 3.18Å; Q280-Q283 PolarHBondContact O-N 3.47Å; Q280-I284 PolarHBondContact O-N 2.91Å
281	P	94.1	Very high	96.4	Very high	60 Å²	60	57.4 Å²	57.4	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-52.5	-37	179.4	-30	35.6	0	0	0	114.3	P240 Q283 I284 Y285	P240-P281 HydrophobicContact CB-CB 4.43Å; P240-P281 HydrophobicContact CG-CB 4.44Å; P281-Q283 VanDerWaalsContact C-N 3.29Å; P281-Q283 PolarHBondContact O-N 3.36Å; P281-I284 WeakPolarHBondContact O-CB 3.36Å; P281-I284 PolarHBondContact O-N 2.88Å; P281-I284 VanDerWaalsContact O-N 3.08Å; P281-Y285 HydrophobicContact CB-CE1 4.49Å; P281-Y285 HydrophobicContact CB-CE2 4.18Å; P281-Y285 WeakPolarHBondContact O-CD1 3.47Å; P281-Y285 WeakPolarHBondContact O-CD2 3.34Å; P281-Y285 PolarHBondContact O-N 2.74Å
282	I	95.4	Very high	96.2	Very high	93 Å²	93	65.2 Å²	65.2	48%	0.477	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-38.5	179.1	-168.8	60.8	0	0	0	112.8	Q280 I284 Y285 E286	Q280-I282 HydrophobicContact CB-CG2 4.12Å; Q280-I282 PolarHBondContact O-N 2.85Å; Q280-I282 VanDerWaalsContact O-N 3.11Å; I282-I284 VanDerWaalsContact C-N 3.34Å; I282-Y285 HydrophobicContact CD1-CD2 4.36Å; I282-Y285 WeakPolarHBondContact O-CB 3.39Å; I282-Y285 PolarHBondContact O-N 2.91Å; I282-E286 WeakPolarHBondContact O-CG 3.17Å; I282-E286 PolarHBondContact O-N 2.87Å
283	Q	96.9	Very high	96.2	Very high	76 Å²	76	66.2 Å²	66.2	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-72	-31.3	177.9	-63.6	173	-14.6	0	0	111.5	A278 Q280 P281 K287	A278-Q283 HydrophobicContact CB-CB 3.46Å; A278-Q283 VanDerWaalsContact CB-CB 3.46Å; Q280-Q283 HydrophobicContact CB-CG 4.4Å; Q280-Q283 WeakPolarHBondContact O-CB 3.18Å; Q280-Q283 PolarHBondContact O-N 3.47Å; P281-Q283 VanDerWaalsContact C-N 3.29Å; P281-Q283 PolarHBondContact O-N 3.36Å; Q283-K287 WeakPolarHBondContact O-CG 3.47Å; Q283-K287 PolarHBondContact O-N 3.02Å
284	I	97.1	Very high	96.2	Very high	5 Å²	5	70.4 Å²	70.4	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-64.4	-46.4	172.2	-56.1	178.2	0	0	0	109.1	P240 E241 F276 A278 Q280 P281 I282 E286 K287 I288	P240-I284 HydrophobicContact CB-CD1 4.26Å; E241-I284 HydrophobicContact CG-CD1 4.19Å; F276-I284 HydrophobicContact CB-CG2 4.33Å; A278-I284 HydrophobicContact CB-CG1 3.82Å; Q280-I284 PolarHBondContact O-N 2.91Å; P281-I284 WeakPolarHBondContact O-CB 3.36Å; P281-I284 PolarHBondContact O-N 2.88Å; P281-I284 VanDerWaalsContact O-N 3.08Å; I282-I284 VanDerWaalsContact C-N 3.34Å; I284-E286 PolarHBondContact O-N 3.26Å; I284-K287 WeakPolarHBondContact O-CB 3.49Å; I284-K287 PolarHBondContact O-N 3.4Å; I284-K287 VanDerWaalsContact O-N 3.16Å; I284-I288 HydrophobicContact CG2-CD1 3.77Å; I284-I288 HydrophobicContact CG2-CG1 4.39Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 2.71Å
285	Y	96.8	Very high	96.2	Very high	59 Å²	59	72.4 Å²	72.4	23%	0.231	36%	0.364	C	S	.	.	H	α-helix	trans	-60.5	-44.2	179.2	-58.8	-19.9	0	0	0	112.6	P240 L243 I248 P281 I282 K287 I288 V289	P240-Y285 HydrophobicContact CB-CE1 3.87Å; L243-Y285 HydrophobicContact CD1-CE1 3.74Å; I248-Y285 HydrophobicContact CD1-CD1 3.85Å; I248-Y285 HydrophobicContact CD1-CG 4.28Å; I248-Y285 HydrophobicContact CG1-CD1 3.98Å; I248-Y285 HydrophobicContact CG1-CG 4.27Å; I248-Y285 HydrophobicContact CG2-CG 4.2Å; P281-Y285 HydrophobicContact CB-CE1 4.49Å; P281-Y285 HydrophobicContact CB-CE2 4.18Å; P281-Y285 WeakPolarHBondContact O-CD1 3.47Å; P281-Y285 WeakPolarHBondContact O-CD2 3.34Å; P281-Y285 PolarHBondContact O-N 2.74Å; I282-Y285 HydrophobicContact CD1-CD2 4.36Å; I282-Y285 WeakPolarHBondContact O-CB 3.39Å; I282-Y285 PolarHBondContact O-N 2.91Å; Y285-K287 VanDerWaalsContact C-N 3.32Å; Y285-K287 PolarHBondContact O-N 2.86Å; Y285-I288 PolarHBondContact O-N 3.23Å; Y285-V289 WeakPolarHBondContact O-CG2 3.3Å; Y285-V289 PolarHBondContact O-N 3.33Å
286	E	96.9	Very high	96.2	Very high	127 Å²	127	72.3 Å²	72.3	59%	0.593	36%	0.364	S	S	*	.	H	α-helix	trans	-57.8	-43.8	174.5	-72.3	172.3	174.3	0	0	112.1	I282 I284 S290	I282-E286 WeakPolarHBondContact O-CG 3.17Å; I282-E286 PolarHBondContact O-N 2.87Å; I284-E286 PolarHBondContact O-N 3.26Å; E286-S290 WeakPolarHBondContact O-CB 3.47Å; E286-S290 PolarHBondContact O-N 3.01Å
287	K	97.3	Very high	96.1	Very high	93 Å²	93	77.6 Å²	77.6	40%	0.404	40%	0.402	S	S	.	.	H	α-helix	trans	-65.1	-44.7	177.5	-71.8	176.8	-175.9	-176.5	0	111.8	F276 F277 Q283 I284 Y285 S290 G291	F276-K287 HydrophobicContact CB-CB 4.33Å; F276-K287 HydrophobicContact CD1-CB 4.04Å; F277-K287 PolarHBondContact O-NZ 2.84Å; Q283-K287 WeakPolarHBondContact O-CG 3.47Å; Q283-K287 PolarHBondContact O-N 3.02Å; I284-K287 WeakPolarHBondContact O-CB 3.49Å; I284-K287 PolarHBondContact O-N 3.4Å; I284-K287 VanDerWaalsContact O-N 3.16Å; Y285-K287 VanDerWaalsContact C-N 3.32Å; Y285-K287 PolarHBondContact O-N 2.86Å; K287-S290 WeakPolarHBondContact O-CB 3.5Å; K287-S290 PolarHBondContact O-N 3Å; K287-S290 PolarHBondContact O-OG 2.96Å; K287-G291 PolarHBondContact O-N 2.77Å
288	I	97.4	Very high	96.3	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-59.6	-50.7	177.9	-72.3	167.2	0	0	0	110.6	P240 P245 I248 W260 F276 I284 Y285 S290 G291	P240-I288 WeakPolarHBondContact O-CD1 3.42Å; P245-I288 HydrophobicContact CB-CG2 4.31Å; P245-I288 HydrophobicContact CG-CG2 3.82Å; I248-I288 HydrophobicContact CD1-CB 3.77Å; I248-I288 HydrophobicContact CD1-CD1 3.82Å; I248-I288 HydrophobicContact CD1-CG1 4.4Å; I248-I288 HydrophobicContact CD1-CG2 3.47Å; I248-I288 VanDerWaalsContact CD1-CG2 3.47Å; W260-I288 HydrophobicContact CH2-CG2 4.34Å; W260-I288 HydrophobicContact CZ2-CG2 3.77Å; F276-I288 HydrophobicContact CB-CG1 3.79Å; F276-I288 HydrophobicContact CD1-CG1 4.36Å; F276-I288 HydrophobicContact CD2-CG1 3.56Å; F276-I288 HydrophobicContact CE2-CG1 4.2Å; F276-I288 HydrophobicContact CG-CG1 3.65Å; I284-I288 HydrophobicContact CG2-CD1 3.77Å; I284-I288 HydrophobicContact CG2-CG1 4.39Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 2.71Å; Y285-I288 PolarHBondContact O-N 3.23Å; I288-S290 PolarHBondContact O-N 3.33Å; I288-G291 PolarHBondContact O-N 2.78Å
289	V	96.4	Very high	96.4	Very high	53 Å²	53	75.3 Å²	75.3	32%	0.321	39%	0.388	S	S	.	.	H	α-helix	trans	-63.9	-31.1	-179.3	173.5	0	0	0	0	111.6	I248 L249 Y285 G291	I248-V289 HydrophobicContact CB-CG2 4.3Å; I248-V289 HydrophobicContact CG2-CG2 3.76Å; L249-V289 HydrophobicContact CD1-CG1 4.41Å; L249-V289 HydrophobicContact CD2-CG1 4.11Å; L249-V289 HydrophobicContact CD2-CG2 4.1Å; L249-V289 HydrophobicContact CG-CG2 4.13Å; Y285-V289 WeakPolarHBondContact O-CG2 3.3Å; Y285-V289 PolarHBondContact O-N 3.33Å; V289-G291 PolarHBondContact O-N 2.81Å
290	S	95.4	Very high	96.6	Very high	64 Å²	64	68.9 Å²	68.9	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-23.7	174.3	85	0	0	0	0	113.9	E286 K287 I288 K292	E286-S290 WeakPolarHBondContact O-CB 3.47Å; E286-S290 PolarHBondContact O-N 3.01Å; K287-S290 WeakPolarHBondContact O-CB 3.5Å; K287-S290 PolarHBondContact O-N 3Å; K287-S290 PolarHBondContact O-OG 2.96Å; I288-S290 PolarHBondContact O-N 3.33Å; S290-K292 PolarHBondContact O-N 2.88Å; S290-K292 VanDerWaalsContact O-N 3.14Å; S290-K292 PolarHBondContact OG-N 2.84Å
291	G	92.5	Very high	96.7	Very high	25 Å²	25	69.3 Å²	69.3	26%	0.258	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	8	-179.7	0	0	0	0	0	115.5	K287 I288 V289 V293	K287-G291 PolarHBondContact O-N 2.77Å; I288-G291 PolarHBondContact O-N 2.78Å; V289-G291 PolarHBondContact O-N 2.81Å; G291-V293 PolarHBondContact O-N 2.75Å
292	K	94.4	Very high	97	Very high	173 Å²	173	70.5 Å²	70.5	75%	0.752	36%	0.362	S	S	*	.			trans	-86.2	91.9	-175.2	-68.7	-179.7	-177.9	175.4	0	111.6	S290	S290-K292 PolarHBondContact O-N 2.88Å; S290-K292 VanDerWaalsContact O-N 3.14Å; S290-K292 PolarHBondContact OG-N 2.84Å
293	V	96.8	Very high	97.1	Very high	30 Å²	30	66.1 Å²	66.1	18%	0.182	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-87.2	129.2	176	-174.4	0	0	0	0	111	Y267 P275 F276 G291 F295 L311	Y267-V293 HydrophobicContact CD2-CG1 4.16Å; Y267-V293 HydrophobicContact CE2-CG1 3.81Å; P275-V293 HydrophobicContact CB-CG1 4.27Å; F276-V293 HydrophobicContact CE1-CG2 3.94Å; F276-V293 HydrophobicContact CE2-CG2 4.43Å; F276-V293 HydrophobicContact CZ-CG2 3.52Å; G291-V293 PolarHBondContact O-N 2.75Å; V293-F295 HydrophobicContact CB-CE1 4.49Å; V293-F295 HydrophobicContact CB-CE2 4.46Å; V293-F295 HydrophobicContact CB-CZ 4.11Å; V293-F295 HydrophobicContact CG1-CD1 4.09Å; V293-F295 HydrophobicContact CG1-CE1 3.58Å; V293-F295 HydrophobicContact CG1-CE2 4.25Å; V293-F295 HydrophobicContact CG1-CZ 3.68Å; V293-L311 HydrophobicContact CG1-CD1 4.27Å; V293-L311 HydrophobicContact CG2-CB 4.25Å; V293-L311 HydrophobicContact CG2-CD1 3.96Å
294	K	96.6	Very high	97.2	Very high	178 Å²	178	64.7 Å²	64.7	77%	0.774	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-101.1	129.2	168.7	-68.1	-177	-179.7	179.4	0	109.5	Y267	Y267-K294 WeakPolarHBondContact CE2-O 3.44Å; Y267-K294 PolarHBondContact OH-O 3.32Å
295	F	98.1	Very high	97.3	Very high	52 Å²	52	68 Å²	68	23%	0.228	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-99.9	138.9	-179.9	-60.7	-71.9	0	0	0	111.4	Y267 V293 F299 K304 L307 K308	Y267-F295 HydrophobicContact CD2-CD1 4.22Å; Y267-F295 HydrophobicContact CD2-CE1 4.27Å; Y267-F295 AromaticContact CE2-CD1 3.98Å; Y267-F295 HydrophobicContact CE2-CD1 3.98Å; Y267-F295 HydrophobicContact CE2-CE1 4.34Å; V293-F295 HydrophobicContact CB-CE1 4.49Å; V293-F295 HydrophobicContact CB-CE2 4.46Å; V293-F295 HydrophobicContact CB-CZ 4.11Å; V293-F295 HydrophobicContact CG1-CD1 4.09Å; V293-F295 HydrophobicContact CG1-CE1 3.58Å; V293-F295 HydrophobicContact CG1-CE2 4.25Å; V293-F295 HydrophobicContact CG1-CZ 3.68Å; F295-F299 HydrophobicContact CB-CD2 4.16Å; F295-F299 AromaticContact CD1-CD2 3.81Å; F295-F299 HydrophobicContact CD1-CD2 3.81Å; F295-F299 HydrophobicContact CD1-CE2 4.04Å; F295-F299 HydrophobicContact CG-CD2 4.41Å; F295-K304 HydrophobicContact CB-CD 4.24Å; F295-K304 HydrophobicContact CB-CG 3.95Å; F295-K304 HydrophobicContact CD1-CG 4.22Å; F295-K304 HydrophobicContact CD2-CB 4.46Å; F295-K304 HydrophobicContact CD2-CG 4.12Å; F295-K304 HydrophobicContact CG-CD 4.49Å; F295-K304 HydrophobicContact CG-CG 3.83Å; F295-L307 HydrophobicContact CD1-CD1 4.15Å; F295-L307 HydrophobicContact CE1-CB 3.67Å; F295-L307 HydrophobicContact CE1-CD1 3.78Å; F295-L307 HydrophobicContact CE1-CG 4.4Å; F295-L307 HydrophobicContact CZ-CB 4.12Å; F295-K308 HydrophobicContact CE2-CG 4.01Å; F295-K308 HydrophobicContact CZ-CG 4Å
296	P	98	Very high	97.4	Very high	13 Å²	13	65.2 Å²	65.2	8%	0.084	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-56.1	150.4	168.7	-23.7	33.1	0	0	0	112.6	A271 H298 F299	A271-P296 HydrophobicContact CB-CG 4.01Å; P296-H298 WeakPolarHBondContact CB-CE1 3.45Å; P296-H298 WeakPolarHBondContact CB-ND1 3.34Å; P296-H298 PolarHBondContact O-N 3.38Å; P296-F299 HydrophobicContact CB-CD1 3.95Å; P296-F299 HydrophobicContact CB-CE1 4.12Å; P296-F299 HydrophobicContact CB-CG 4.44Å; P296-F299 HydrophobicContact CG-CD1 3.92Å; P296-F299 HydrophobicContact CG-CE1 3.63Å; P296-F299 HydrophobicContact CG-CE2 4.35Å; P296-F299 HydrophobicContact CG-CG 4.41Å; P296-F299 HydrophobicContact CG-CZ 3.88Å; P296-F299 PolarHBondContact O-N 3.39Å
297	S	97.7	Very high	97.5	Very high	116 Å²	116	59.2 Å²	59.2	81%	0.811	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.3	-179.3	53.3	0	0	0	0	112.5	F299	S297-F299 VanDerWaalsContact C-N 3.28Å; S297-F299 PolarHBondContact O-N 2.94Å
298	H	98.1	Very high	97.5	Very high	80 Å²	80	60.4 Å²	60.4	37%	0.37	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.1	-179	63.7	-101.8	0	0	0	114.9	R175 A270 P296	R175-H298 PolarHBondContact NH1-CD2 2.86Å; R175-H298 PolarHBondContact NH1-CE1 3.48Å; R175-H298 PolarHBondContact NH1-ND1 2.9Å; R175-H298 PolarHBondContact NH1-NE2 3.1Å; A270-H298 PolarHBondContact O-NE2 3.24Å; P296-H298 WeakPolarHBondContact CB-CE1 3.45Å; P296-H298 WeakPolarHBondContact CB-ND1 3.34Å; P296-H298 PolarHBondContact O-N 3.38Å
299	F	98.6	Very high	97.6	Very high	6 Å²	6	62 Å²	62	3%	0.026	33%	0.325	C	S	.	.	S	Bend	trans	-69.3	133.4	175.6	-82.7	18.9	0	0	0	110.3	Y267 A270 A271 F295 P296 S297 L303 K304 L307	Y267-F299 AromaticContact CD2-CE2 3.94Å; Y267-F299 HydrophobicContact CD2-CE2 3.94Å; Y267-F299 HydrophobicContact CD2-CZ 4.43Å; Y267-F299 HydrophobicContact CE2-CE2 4.16Å; Y267-F299 HydrophobicContact CG-CE2 4.39Å; Y267-F299 HydrophobicContact CG-CZ 4.5Å; A270-F299 HydrophobicContact CB-CD1 4.49Å; A270-F299 HydrophobicContact CB-CE1 3.61Å; A270-F299 HydrophobicContact CB-CZ 3.73Å; A271-F299 HydrophobicContact CB-CE1 4.17Å; A271-F299 HydrophobicContact CB-CZ 3.87Å; F295-F299 HydrophobicContact CB-CD2 4.16Å; F295-F299 AromaticContact CD1-CD2 3.81Å; F295-F299 HydrophobicContact CD1-CD2 3.81Å; F295-F299 HydrophobicContact CD1-CE2 4.04Å; F295-F299 HydrophobicContact CG-CD2 4.41Å; P296-F299 HydrophobicContact CB-CD1 3.95Å; P296-F299 HydrophobicContact CB-CE1 4.12Å; P296-F299 HydrophobicContact CB-CG 4.44Å; P296-F299 HydrophobicContact CG-CD1 3.92Å; P296-F299 HydrophobicContact CG-CE1 3.63Å; P296-F299 HydrophobicContact CG-CE2 4.35Å; P296-F299 HydrophobicContact CG-CG 4.41Å; P296-F299 HydrophobicContact CG-CZ 3.88Å; P296-F299 PolarHBondContact O-N 3.39Å; S297-F299 VanDerWaalsContact C-N 3.28Å; S297-F299 PolarHBondContact O-N 2.94Å; F299-L303 HydrophobicContact CB-CD2 4.22Å; F299-L303 HydrophobicContact CD1-CD2 3.88Å; F299-L303 HydrophobicContact CD2-CD2 3.61Å; F299-L303 HydrophobicContact CD2-CG 4.01Å; F299-L303 HydrophobicContact CE1-CD2 4.09Å; F299-L303 HydrophobicContact CE2-CD2 3.84Å; F299-L303 HydrophobicContact CE2-CG 4.36Å; F299-L303 HydrophobicContact CG-CD2 3.64Å; F299-L303 HydrophobicContact CG-CG 4.36Å; F299-L303 HydrophobicContact CZ-CD2 4.07Å; F299-K304 HydrophobicContact CB-CD 4.34Å; F299-K304 HydrophobicContact CB-CG 3.93Å; F299-K304 HydrophobicContact CD2-CG 4.46Å; F299-K304 WeakPolarHBondContact O-CE 3.39Å; F299-K304 PolarHBondContact O-NZ 2.92Å; F299-L307 HydrophobicContact CD2-CD1 4.04Å; F299-L307 HydrophobicContact CE2-CD1 3.6Å
300	S	98.6	Very high	97.7	Very high	31 Å²	31	59.4 Å²	59.4	22%	0.217	31%	0.309	C	S	.	.			trans	-59.8	158.4	170.7	68.7	0	0	0	0	111.6	E178 E302 L303 K304	E178-S300 WeakPolarHBondContact OE1-CB 3.25Å; E178-S300 PolarHBondContact OE1-N 3.34Å; E178-S300 PolarHBondContact OE1-OG 3.27Å; E178-S300 WeakPolarHBondContact OE2-CB 3.17Å; E178-S300 PolarHBondContact OE2-OG 2.92Å; S300-E302 VanDerWaalsContact C-N 3.27Å; S300-E302 PolarHBondContact O-N 3.45Å; S300-L303 PolarHBondContact O-N 3.05Å; S300-L303 VanDerWaalsContact OG-CB 3.24Å; S300-L303 WeakPolarHBondContact OG-CB 3.5Å; S300-L303 PolarHBondContact OG-N 3.26Å; S300-K304 WeakPolarHBondContact O-CG 3.34Å; S300-K304 PolarHBondContact O-N 3.5Å; S300-K304 VanDerWaalsContact O-N 3.09Å
301	N	98.5	Very high	97.8	Very high	122 Å²	122	56.8 Å²	56.8	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-66.7	-36.5	177.2	-72	-31.8	0	0	0	110.7	K304 D305	N301-K304 PolarHBondContact O-N 3.25Å; N301-D305 WeakPolarHBondContact O-CB 3.19Å; N301-D305 PolarHBondContact O-N 3.5Å
302	E	98.6	Very high	98.1	Very high	85 Å²	85	58.1 Å²	58.1	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-44.3	176.1	-63.4	71.6	-159.9	0	0	110.9	S300 D305 L306 H332 K333 W334	S300-E302 VanDerWaalsContact C-N 3.27Å; S300-E302 PolarHBondContact O-N 3.45Å; E302-D305 PolarHBondContact O-N 2.86Å; E302-L306 PolarHBondContact O-N 3.48Å; E302-H332 PolarHBondContact O-CE1 2.65Å; E302-K333 HydrophobicContact CG-CB 4.04Å; E302-W334 HydrophobicContact CB-CB 4.01Å; E302-W334 HydrophobicContact CB-CG 4.48Å
303	L	98.8	Very high	98.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-46	176.7	178.1	58.4	0	0	0	111.4	E178 I266 A270 F299 S300 D305 L306 L307 W334	E178-L303 HydrophobicContact CG-CD2 3.96Å; I266-L303 HydrophobicContact CG2-CD1 3.51Å; A270-L303 HydrophobicContact CB-CD2 3.86Å; F299-L303 HydrophobicContact CB-CD2 4.22Å; F299-L303 HydrophobicContact CD1-CD2 3.88Å; F299-L303 HydrophobicContact CD2-CD2 3.61Å; F299-L303 HydrophobicContact CD2-CG 4.01Å; F299-L303 HydrophobicContact CE1-CD2 4.09Å; F299-L303 HydrophobicContact CE2-CD2 3.84Å; F299-L303 HydrophobicContact CE2-CG 4.36Å; F299-L303 HydrophobicContact CG-CD2 3.64Å; F299-L303 HydrophobicContact CG-CG 4.36Å; F299-L303 HydrophobicContact CZ-CD2 4.07Å; S300-L303 PolarHBondContact O-N 3.05Å; S300-L303 VanDerWaalsContact OG-CB 3.24Å; S300-L303 WeakPolarHBondContact OG-CB 3.5Å; S300-L303 PolarHBondContact OG-N 3.26Å; L303-D305 VanDerWaalsContact C-N 3.26Å; L303-D305 PolarHBondContact O-N 2.89Å; L303-L306 PolarHBondContact O-N 2.99Å; L303-L307 HydrophobicContact CD1-CD1 3.81Å; L303-L307 HydrophobicContact CD1-CG 3.89Å; L303-L307 HydrophobicContact CD2-CD1 4.48Å; L303-L307 HydrophobicContact CG-CD1 3.84Å; L303-L307 HydrophobicContact CG-CG 4.32Å; L303-L307 WeakPolarHBondContact O-CB 3.34Å; L303-L307 VanDerWaalsContact O-CG 3.29Å; L303-L307 WeakPolarHBondContact O-CG 3.42Å; L303-L307 PolarHBondContact O-N 2.86Å; L303-W334 HydrophobicContact CB-CG 4.45Å; L303-W334 HydrophobicContact CD1-CD2 4.18Å; L303-W334 HydrophobicContact CD1-CH2 4.45Å; L303-W334 HydrophobicContact CD1-CZ2 3.82Å
304	K	98.7	Very high	98.3	Very high	46 Å²	46	53.7 Å²	53.7	20%	0.2	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-41	177.3	-70.9	170	-175.1	156.2	0	111.3	F295 F299 S300 N301 K308	F295-K304 HydrophobicContact CB-CD 4.24Å; F295-K304 HydrophobicContact CB-CG 3.95Å; F295-K304 HydrophobicContact CD1-CG 4.22Å; F295-K304 HydrophobicContact CD2-CB 4.46Å; F295-K304 HydrophobicContact CD2-CG 4.12Å; F295-K304 HydrophobicContact CG-CD 4.49Å; F295-K304 HydrophobicContact CG-CG 3.83Å; F299-K304 HydrophobicContact CB-CD 4.34Å; F299-K304 HydrophobicContact CB-CG 3.93Å; F299-K304 HydrophobicContact CD2-CG 4.46Å; F299-K304 WeakPolarHBondContact O-CE 3.39Å; F299-K304 PolarHBondContact O-NZ 2.92Å; S300-K304 WeakPolarHBondContact O-CG 3.34Å; S300-K304 PolarHBondContact O-N 3.5Å; S300-K304 VanDerWaalsContact O-N 3.09Å; N301-K304 PolarHBondContact O-N 3.25Å; K304-K308 VanDerWaalsContact O-CG 3.22Å; K304-K308 WeakPolarHBondContact O-CG 3.34Å; K304-K308 PolarHBondContact O-N 2.91Å
305	D	98.7	Very high	98.2	Very high	76 Å²	76	47.7 Å²	47.7	41%	0.406	25%	0.251	S	S	.	.	H	α-helix	trans	-66.6	-46.3	179	-163.9	54.9	0	0	0	112	N301 E302 L303 L307 K308 N309 H332	N301-D305 WeakPolarHBondContact O-CB 3.19Å; N301-D305 PolarHBondContact O-N 3.5Å; E302-D305 PolarHBondContact O-N 2.86Å; L303-D305 VanDerWaalsContact C-N 3.26Å; L303-D305 PolarHBondContact O-N 2.89Å; D305-L307 PolarHBondContact O-N 3.44Å; D305-K308 PolarHBondContact O-N 3.16Å; D305-N309 PolarHBondContact O-N 3.46Å; D305-N309 PolarHBondContact O-ND2 3.19Å; D305-H332 IonicContact OD2-NE2 3.23Å; D305-H332 PolarHBondContact OD2-NE2 3.5Å
306	L	98.8	Very high	98.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.7	-50.4	174.3	179	60.3	0	0	0	111.3	I266 E302 L303 K308 N309 L310 Y319 H332 W334 F335	I266-L306 HydrophobicContact CD1-CD2 4.19Å; E302-L306 PolarHBondContact O-N 3.48Å; L303-L306 PolarHBondContact O-N 2.99Å; L306-K308 VanDerWaalsContact C-N 3.32Å; L306-K308 PolarHBondContact O-N 3.15Å; L306-N309 PolarHBondContact O-N 3.43Å; L306-L310 HydrophobicContact CD1-CD1 3.94Å; L306-L310 HydrophobicContact CD1-CG 4.19Å; L306-L310 HydrophobicContact CD2-CD1 4.41Å; L306-L310 HydrophobicContact CG-CD1 3.88Å; L306-L310 HydrophobicContact CG-CG 4.46Å; L306-L310 PolarHBondContact O-N 2.85Å; L306-Y319 HydrophobicContact CD1-CD2 4.38Å; L306-H332 HydrophobicContact CD1-CB 4.16Å; L306-H332 PolarHBondContact N-CE1 2.83Å; L306-W334 HydrophobicContact CB-CB 4.34Å; L306-W334 HydrophobicContact CD2-CB 4.14Å; L306-W334 HydrophobicContact CD2-CD2 3.95Å; L306-W334 HydrophobicContact CD2-CE3 3.41Å; L306-W334 VanDerWaalsContact CD2-CE3 3.41Å; L306-W334 HydrophobicContact CD2-CG 4.28Å; L306-W334 HydrophobicContact CD2-CZ3 4.06Å; L306-F335 HydrophobicContact CD2-CD2 4.19Å; L306-F335 HydrophobicContact CD2-CE2 3.72Å
307	L	98.8	Very high	98.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-34.8	-177.1	-70.4	176	0	0	0	112.4	G263 I266 Y267 F295 F299 L303 D305 N309 L310 L311	G263-L307 WeakPolarHBondContact O-CD2 3.42Å; I266-L307 HydrophobicContact CB-CD2 4Å; I266-L307 HydrophobicContact CG2-CD2 3.94Å; Y267-L307 HydrophobicContact CD2-CD1 4.04Å; F295-L307 HydrophobicContact CD1-CD1 4.15Å; F295-L307 HydrophobicContact CE1-CB 3.67Å; F295-L307 HydrophobicContact CE1-CD1 3.78Å; F295-L307 HydrophobicContact CE1-CG 4.4Å; F295-L307 HydrophobicContact CZ-CB 4.12Å; F299-L307 HydrophobicContact CD2-CD1 4.04Å; F299-L307 HydrophobicContact CE2-CD1 3.6Å; L303-L307 HydrophobicContact CD1-CD1 3.81Å; L303-L307 HydrophobicContact CD1-CG 3.89Å; L303-L307 HydrophobicContact CD2-CD1 4.48Å; L303-L307 HydrophobicContact CG-CD1 3.84Å; L303-L307 HydrophobicContact CG-CG 4.32Å; L303-L307 WeakPolarHBondContact O-CB 3.34Å; L303-L307 VanDerWaalsContact O-CG 3.29Å; L303-L307 WeakPolarHBondContact O-CG 3.42Å; L303-L307 PolarHBondContact O-N 2.86Å; D305-L307 PolarHBondContact O-N 3.44Å; L307-N309 PolarHBondContact O-N 2.87Å; L307-L310 PolarHBondContact O-N 3.29Å; L307-L311 WeakPolarHBondContact O-CA 3.12Å; L307-L311 VanDerWaalsContact O-CB 3.24Å; L307-L311 WeakPolarHBondContact O-CB 3.37Å; L307-L311 PolarHBondContact O-N 2.84Å
308	K	98.5	Very high	98.2	Very high	118 Å²	118	49.6 Å²	49.6	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-31.5	172.7	-76.7	169.4	-177.2	177	0	112.8	F295 K304 D305 L306	F295-K308 HydrophobicContact CE2-CG 4.01Å; F295-K308 HydrophobicContact CZ-CG 4Å; K304-K308 VanDerWaalsContact O-CG 3.22Å; K304-K308 WeakPolarHBondContact O-CG 3.34Å; K304-K308 PolarHBondContact O-N 2.91Å; D305-K308 PolarHBondContact O-N 3.16Å; L306-K308 VanDerWaalsContact C-N 3.32Å; L306-K308 PolarHBondContact O-N 3.15Å
309	N	98.6	Very high	98.2	Very high	33 Å²	33	47.9 Å²	47.9	18%	0.176	24%	0.243	C	C	.	.	H	α-helix	trans	-85.7	-26.2	179.7	-73	-68.4	0	0	0	113.2	D305 L306 L307 R318 Y319	D305-N309 PolarHBondContact O-N 3.46Å; D305-N309 PolarHBondContact O-ND2 3.19Å; L306-N309 PolarHBondContact O-N 3.43Å; L307-N309 PolarHBondContact O-N 2.87Å; N309-R318 WeakPolarHBondContact O-CA 3.32Å; N309-Y319 HydrophobicContact CB-CD1 3.57Å; N309-Y319 HydrophobicContact CB-CD2 3.72Å; N309-Y319 HydrophobicContact CB-CE1 3.62Å; N309-Y319 HydrophobicContact CB-CE2 3.78Å; N309-Y319 HydrophobicContact CB-CG 3.62Å; N309-Y319 VanDerWaalsContact CG-CE1 3.48Å; N309-Y319 PolarHBondContact O-N 3.35Å; N309-Y319 WeakPolarHBondContact OD1-CE1 3.29Å
310	L	98.7	Very high	98.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-84.6	-47.1	173.5	-68.8	173.3	0	0	0	112.5	W259 L262 I266 L306 L307 Q312 R318 I329	W259-L310 HydrophobicContact CB-CD2 4.38Å; L262-L310 HydrophobicContact CD2-CD1 4.33Å; L262-L310 HydrophobicContact CG-CD1 4.31Å; I266-L310 HydrophobicContact CD1-CD1 4.05Å; L306-L310 HydrophobicContact CD1-CD1 3.94Å; L306-L310 HydrophobicContact CD1-CG 4.19Å; L306-L310 HydrophobicContact CD2-CD1 4.41Å; L306-L310 HydrophobicContact CG-CD1 3.88Å; L306-L310 HydrophobicContact CG-CG 4.46Å; L306-L310 PolarHBondContact O-N 2.85Å; L307-L310 PolarHBondContact O-N 3.29Å; L310-Q312 PolarHBondContact O-N 2.49Å; L310-R318 WeakPolarHBondContact O-CD 3.31Å; L310-R318 WeakPolarHBondContact O-CG 3.36Å; L310-I329 HydrophobicContact CD2-CD1 3.76Å; L310-I329 HydrophobicContact CD2-CG1 4.08Å
311	L	98.6	Very high	98.1	Very high	9 Å²	9	48.6 Å²	48.6	5%	0.047	25%	0.246	C	C	.	.	S	Bend	trans	-81.5	41.7	176	-57.8	178.1	0	0	0	111.4	W260 V264 P275 V293 L307	W260-L311 HydrophobicContact CD2-CD2 4.11Å; W260-L311 HydrophobicContact CE3-CD2 4.44Å; W260-L311 HydrophobicContact CH2-CB 4.47Å; W260-L311 HydrophobicContact CZ2-CD2 4.29Å; W260-L311 HydrophobicContact CZ3-CB 4.3Å; V264-L311 HydrophobicContact CG2-CD2 3.65Å; P275-L311 HydrophobicContact CB-CD1 4.2Å; P275-L311 HydrophobicContact CG-CD1 4.13Å; V293-L311 HydrophobicContact CG1-CD1 4.27Å; V293-L311 HydrophobicContact CG2-CB 4.25Å; V293-L311 HydrophobicContact CG2-CD1 3.96Å; L307-L311 WeakPolarHBondContact O-CA 3.12Å; L307-L311 VanDerWaalsContact O-CB 3.24Å; L307-L311 WeakPolarHBondContact O-CB 3.37Å; L307-L311 PolarHBondContact O-N 2.84Å
312	Q	98.1	Very high	98.1	Very high	53 Å²	53	45.4 Å²	45.4	25%	0.248	23%	0.229	C	C	.	.			trans	-94.5	121	-177.9	176.5	54.1	-102.2	0	0	110.2	L310 D314 K317 R318	L310-Q312 PolarHBondContact O-N 2.49Å; Q312-D314 HydrophobicContact CG-CB 4.3Å; Q312-D314 VanDerWaalsContact CG-O 3.29Å; Q312-D314 WeakPolarHBondContact CG-O 3.24Å; Q312-K317 HydrophobicContact CG-CB 3.76Å; Q312-R318 HydrophobicContact CB-CB 4.03Å; Q312-R318 HydrophobicContact CB-CG 4.21Å; Q312-R318 HydrophobicContact CG-CB 4.32Å; Q312-R318 VanDerWaalsContact O-CZ 3.27Å; Q312-R318 PolarHBondContact O-NE 3.43Å; Q312-R318 PolarHBondContact O-NH2 3.04Å
313	V	97.6	Very high	98	Very high	57 Å²	57	51.4 Å²	51.4	35%	0.345	25%	0.254	S	S	.	.	S	Bend	trans	-68.1	-37.2	178.7	-179.7	0	0	0	0	111.2	P245 W260 L315	P245-V313 HydrophobicContact CB-CG1 4.21Å; P245-V313 HydrophobicContact CG-CG1 4.31Å; P245-V313 HydrophobicContact CG-CG2 4.09Å; W260-V313 HydrophobicContact CZ3-CG2 4.41Å; V313-L315 PolarHBondContact O-N 3.29Å
314	D	96.6	Very high	97.8	Very high	53 Å²	53	56.3 Å²	56.3	28%	0.283	28%	0.28	S	S	.	.	S	Bend	trans	-76.5	104.3	177.9	-175.2	-9.3	0	0	0	111.2	Q312 T316 K317 R318	Q312-D314 HydrophobicContact CG-CB 4.3Å; Q312-D314 VanDerWaalsContact CG-O 3.29Å; Q312-D314 WeakPolarHBondContact CG-O 3.24Å; D314-T316 VanDerWaalsContact CG-OG1 3.28Å; D314-T316 PolarHBondContact O-N 3.38Å; D314-T316 WeakPolarHBondContact OD1-CB 3.22Å; D314-T316 PolarHBondContact OD1-N 3.37Å; D314-T316 PolarHBondContact OD1-OG1 2.89Å; D314-T316 PolarHBondContact OD2-OG1 3.48Å; D314-K317 HydrophobicContact CB-CB 4.43Å; D314-K317 HydrophobicContact CB-CD 4.25Å; D314-K317 PolarHBondContact O-N 2.81Å; D314-K317 WeakPolarHBondContact OD2-CD 3.32Å; D314-K317 WeakPolarHBondContact OD2-CE 3.38Å; D314-K317 IonicContact OD2-NZ 2.81Å; D314-K317 PolarHBondContact OD2-NZ 3.39Å; D314-R318 PolarHBondContact O-N 2.87Å
315	L	96.1	Very high	97.7	Very high	51 Å²	51	55.1 Å²	55.1	27%	0.267	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.7	180	-71.4	176.4	0	0	0	113.9	E246 A256 V313 K317 N321	E246-L315 WeakPolarHBondContact OE1-CD2 3.14Å; A256-L315 HydrophobicContact CB-CD2 3.89Å; V313-L315 PolarHBondContact O-N 3.29Å; L315-K317 PolarHBondContact O-N 3.07Å; L315-N321 PolarHBondContact O-ND2 3.15Å
316	T	96.7	Very high	97.6	Very high	105 Å²	105	52.7 Å²	52.7	64%	0.644	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.8	178.7	71.5	0	0	0	0	113.4	D314 L322	D314-T316 VanDerWaalsContact CG-OG1 3.28Å; D314-T316 PolarHBondContact O-N 3.38Å; D314-T316 WeakPolarHBondContact OD1-CB 3.22Å; D314-T316 PolarHBondContact OD1-N 3.37Å; D314-T316 PolarHBondContact OD1-OG1 2.89Å; D314-T316 PolarHBondContact OD2-OG1 3.48Å; T316-L322 WeakPolarHBondContact O-CD2 3.41Å
317	K	98	Very high	97.6	Very high	116 Å²	116	54.3 Å²	54.3	50%	0.504	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-8.1	-179.2	-64.5	175	-171.2	144.3	0	113.1	Q312 D314 L315	Q312-K317 HydrophobicContact CG-CB 3.76Å; D314-K317 HydrophobicContact CB-CB 4.43Å; D314-K317 HydrophobicContact CB-CD 4.25Å; D314-K317 PolarHBondContact O-N 2.81Å; D314-K317 WeakPolarHBondContact OD2-CD 3.32Å; D314-K317 WeakPolarHBondContact OD2-CE 3.38Å; D314-K317 IonicContact OD2-NZ 2.81Å; D314-K317 PolarHBondContact OD2-NZ 3.39Å; L315-K317 PolarHBondContact O-N 3.07Å
318	R	98.6	Very high	97.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	-74.5	126.2	-178.6	-167.4	-176.6	-60.2	160.7	4.2	111.1	E246 A256 N309 L310 Q312 D314 N321 L322	E246-R318 IonicContact OE1-CZ 3.48Å; E246-R318 IonicContact OE1-NH1 2.67Å; E246-R318 PolarHBondContact OE1-NH1 3.43Å; E246-R318 IonicContact OE1-NH2 3.44Å; E246-R318 PolarHBondContact OE1-NH2 3.31Å; E246-R318 IonicContact OE2-CZ 3.69Å; E246-R318 IonicContact OE2-NH1 3.59Å; E246-R318 IonicContact OE2-NH2 2.87Å; E246-R318 PolarHBondContact OE2-NH2 3.07Å; A256-R318 PolarHBondContact O-NH1 3.05Å; N309-R318 WeakPolarHBondContact O-CA 3.32Å; L310-R318 WeakPolarHBondContact O-CD 3.31Å; L310-R318 WeakPolarHBondContact O-CG 3.36Å; Q312-R318 HydrophobicContact CB-CB 4.03Å; Q312-R318 HydrophobicContact CB-CG 4.21Å; Q312-R318 HydrophobicContact CG-CB 4.32Å; Q312-R318 VanDerWaalsContact O-CZ 3.27Å; Q312-R318 PolarHBondContact O-NE 3.43Å; Q312-R318 PolarHBondContact O-NH2 3.04Å; D314-R318 PolarHBondContact O-N 2.87Å; R318-N321 PolarHBondContact O-N 2.83Å; R318-L322 WeakPolarHBondContact O-CG 3.19Å
319	Y	98.6	Very high	97.6	Very high	44 Å²	44	50.1 Å²	50.1	17%	0.173	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	147.6	174.9	-80.6	15.3	0	0	0	111.7	L306 N309 N321 L322 D328 I329 H332	L306-Y319 HydrophobicContact CD1-CD2 4.38Å; N309-Y319 HydrophobicContact CB-CD1 3.57Å; N309-Y319 HydrophobicContact CB-CD2 3.72Å; N309-Y319 HydrophobicContact CB-CE1 3.62Å; N309-Y319 HydrophobicContact CB-CE2 3.78Å; N309-Y319 HydrophobicContact CB-CG 3.62Å; N309-Y319 VanDerWaalsContact CG-CE1 3.48Å; N309-Y319 PolarHBondContact O-N 3.35Å; N309-Y319 WeakPolarHBondContact OD1-CE1 3.29Å; Y319-N321 PolarHBondContact O-N 3.09Å; Y319-L322 HydrophobicContact CD1-CD1 3.94Å; Y319-L322 HydrophobicContact CE1-CD1 4.26Å; Y319-D328 HydrophobicContact CD1-CB 4.09Å; Y319-D328 HydrophobicContact CD2-CB 4.03Å; Y319-D328 WeakPolarHBondContact CD2-O 3.14Å; Y319-D328 HydrophobicContact CE1-CB 4.34Å; Y319-D328 HydrophobicContact CE2-CB 4.26Å; Y319-D328 VanDerWaalsContact CE2-O 3.24Å; Y319-D328 WeakPolarHBondContact CE2-O 3.13Å; Y319-D328 HydrophobicContact CG-CB 3.94Å; Y319-I329 HydrophobicContact CD2-CG1 4.31Å; Y319-H332 AromaticContact CE2-CD2 3.81Å
320	G	98	Very high	97.5	Very high	6 Å²	6	49.9 Å²	49.9	6%	0.062	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	-18.7	-171.5	0	0	0	0	0	114.3	W259 G325	W259-G320 PolarHBondContact NE1-O 3.16Å; G320-G325 WeakPolarHBondContact CA-O 3.34Å; G320-G325 PolarHBondContact N-O 2.74Å
321	N	97.5	Very high	97.5	Very high	47 Å²	47	56.2 Å²	56.2	25%	0.251	30%	0.296	S	S	.	.	S	Bend	trans	-112.1	3.8	177.4	-165	57.7	0	0	0	113.6	N254 A256 L315 R318 Y319	N254-N321 PolarHBondContact ND2-OD1 2.97Å; A256-N321 HydrophobicContact CB-CB 3.84Å; L315-N321 PolarHBondContact O-ND2 3.15Å; R318-N321 PolarHBondContact O-N 2.83Å; Y319-N321 PolarHBondContact O-N 3.09Å
322	L	97.1	Very high	97.5	Very high	54 Å²	54	56.4 Å²	56.4	28%	0.283	30%	0.296	S	S	.	.	S	Bend	trans	-87.6	178.1	176.3	-50.9	-172.6	0	0	0	111.3	T316 R318 Y319 N324 G325 D328	T316-L322 WeakPolarHBondContact O-CD2 3.41Å; R318-L322 WeakPolarHBondContact O-CG 3.19Å; Y319-L322 HydrophobicContact CD1-CD1 3.94Å; Y319-L322 HydrophobicContact CE1-CD1 4.26Å; L322-N324 VanDerWaalsContact C-N 3.26Å; L322-N324 PolarHBondContact O-N 3.18Å; L322-G325 WeakPolarHBondContact O-CA 3.46Å; L322-G325 PolarHBondContact O-N 3.14Å; L322-D328 WeakPolarHBondContact CB-OD2 3.19Å
323	K	96.4	Very high	97.5	Very high	212 Å²	212	62 Å²	62	92%	0.922	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37	-179.8	-173.9	179.9	177.5	-176.7	0	113.5	G325	K323-G325 VanDerWaalsContact C-N 3.26Å; K323-G325 PolarHBondContact O-N 3.29Å
324	N	95.7	Very high	97.6	Very high	103 Å²	103	59.5 Å²	59.5	55%	0.551	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.2	179	-55.9	-29.1	0	0	0	112.7	L322 V326 A327 D328	L322-N324 VanDerWaalsContact C-N 3.26Å; L322-N324 PolarHBondContact O-N 3.18Å; N324-V326 PolarHBondContact O-N 3.37Å; N324-A327 HydrophobicContact CB-CB 4.31Å; N324-A327 VanDerWaalsContact O-CB 3.29Å; N324-A327 WeakPolarHBondContact O-CB 3.06Å; N324-A327 PolarHBondContact O-N 2.98Å; N324-A327 VanDerWaalsContact O-N 3.15Å; N324-D328 WeakPolarHBondContact CB-OD1 3.21Å; N324-D328 PolarHBondContact ND2-OD1 3.11Å
325	G	96.3	Very high	97.7	Very high	20 Å²	20	57 Å²	57	21%	0.206	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-129.6	179.1	0	0	0	0	0	112.8	G320 L322 K323 A327 D328	G320-G325 WeakPolarHBondContact CA-O 3.34Å; G320-G325 PolarHBondContact N-O 2.74Å; L322-G325 WeakPolarHBondContact O-CA 3.46Å; L322-G325 PolarHBondContact O-N 3.14Å; K323-G325 VanDerWaalsContact C-N 3.26Å; K323-G325 PolarHBondContact O-N 3.29Å; G325-A327 PolarHBondContact O-N 2.91Å; G325-D328 PolarHBondContact O-N 3.39Å
326	V	97.1	Very high	97.7	Very high	25 Å²	25	57.9 Å²	57.9	15%	0.152	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20	-179.4	68.8	0	0	0	0	113.3	V189 E193 W259 N324 D328 I329 K330	V189-V326 HydrophobicContact CG1-CG2 3.71Å; E193-V326 HydrophobicContact CB-CG2 4.34Å; E193-V326 HydrophobicContact CG-CG1 3.96Å; E193-V326 WeakPolarHBondContact OE1-CG1 3.41Å; W259-V326 HydrophobicContact CH2-CB 4.24Å; W259-V326 HydrophobicContact CH2-CG2 3.55Å; W259-V326 HydrophobicContact CZ2-CB 4.17Å; W259-V326 HydrophobicContact CZ2-CG2 3.98Å; W259-V326 HydrophobicContact CZ3-CG2 4.33Å; N324-V326 PolarHBondContact O-N 3.37Å; V326-D328 PolarHBondContact O-N 2.85Å; V326-I329 WeakPolarHBondContact O-CA 3.38Å; V326-I329 WeakPolarHBondContact O-CB 3.49Å; V326-I329 PolarHBondContact O-N 2.83Å; V326-K330 HydrophobicContact CG2-CG 4.28Å; V326-K330 PolarHBondContact O-N 2.73Å
327	A	97.3	Very high	97.7	Very high	34 Å²	34	57.4 Å²	57.4	28%	0.281	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-30.2	-179.2	0	0	0	0	0	112.5	N324 G325 I329 K330 N331	N324-A327 HydrophobicContact CB-CB 4.31Å; N324-A327 VanDerWaalsContact O-CB 3.29Å; N324-A327 WeakPolarHBondContact O-CB 3.06Å; N324-A327 PolarHBondContact O-N 2.98Å; N324-A327 VanDerWaalsContact O-N 3.15Å; G325-A327 PolarHBondContact O-N 2.91Å; A327-I329 PolarHBondContact O-N 3.03Å; A327-K330 PolarHBondContact O-N 3.45Å; A327-N331 VanDerWaalsContact O-CB 3.28Å; A327-N331 WeakPolarHBondContact O-CB 3.36Å; A327-N331 PolarHBondContact O-N 2.68Å; A327-N331 PolarHBondContact O-ND2 3.36Å
328	D	98.2	Very high	97.7	Very high	31 Å²	31	53 Å²	53	17%	0.166	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-27.6	173.9	-68.8	-33	0	0	0	112	Y319 L322 N324 G325 V326	Y319-D328 HydrophobicContact CD1-CB 4.09Å; Y319-D328 HydrophobicContact CD2-CB 4.03Å; Y319-D328 WeakPolarHBondContact CD2-O 3.14Å; Y319-D328 HydrophobicContact CE1-CB 4.34Å; Y319-D328 HydrophobicContact CE2-CB 4.26Å; Y319-D328 VanDerWaalsContact CE2-O 3.24Å; Y319-D328 WeakPolarHBondContact CE2-O 3.13Å; Y319-D328 HydrophobicContact CG-CB 3.94Å; L322-D328 WeakPolarHBondContact CB-OD2 3.19Å; N324-D328 WeakPolarHBondContact CB-OD1 3.21Å; N324-D328 PolarHBondContact ND2-OD1 3.11Å; G325-D328 PolarHBondContact O-N 3.39Å; V326-D328 PolarHBondContact O-N 2.85Å
329	I	98.7	Very high	97.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-82.6	-50.9	174.4	-56	172.4	0	0	0	109.8	V189 W259 L310 Y319 V326 A327 N331 H332 F335	V189-I329 HydrophobicContact CG1-CG2 4.48Å; V189-I329 HydrophobicContact CG2-CG2 3.83Å; W259-I329 HydrophobicContact CD2-CD1 3.67Å; W259-I329 HydrophobicContact CE3-CD1 3.26Å; W259-I329 HydrophobicContact CG-CD1 4.31Å; W259-I329 HydrophobicContact CH2-CD1 4.27Å; W259-I329 HydrophobicContact CZ3-CD1 3.59Å; L310-I329 HydrophobicContact CD2-CD1 3.76Å; L310-I329 HydrophobicContact CD2-CG1 4.08Å; Y319-I329 HydrophobicContact CD2-CG1 4.31Å; V326-I329 WeakPolarHBondContact O-CA 3.38Å; V326-I329 WeakPolarHBondContact O-CB 3.49Å; V326-I329 PolarHBondContact O-N 2.83Å; A327-I329 PolarHBondContact O-N 3.03Å; I329-N331 VanDerWaalsContact C-N 3.3Å; I329-N331 PolarHBondContact O-N 3.27Å; I329-H332 VanDerWaalsContact O-CB 3.26Å; I329-H332 WeakPolarHBondContact O-CB 3.26Å; I329-H332 PolarHBondContact O-N 2.69Å; I329-H332 VanDerWaalsContact O-N 3.15Å; I329-F335 HydrophobicContact CG2-CD2 4.26Å; I329-F335 HydrophobicContact CG2-CE2 3.75Å; I329-F335 VanDerWaalsContact O-CD2 3.31Å; I329-F335 WeakPolarHBondContact O-CD2 3.4Å
330	K	98.3	Very high	97.5	Very high	28 Å²	28	56.9 Å²	56.9	12%	0.122	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-37.5	-175.5	-76.4	-173.7	169.6	177.2	0	113.7	V189 E193 V326 A327 W340	V189-K330 HydrophobicContact CG1-CG 3.95Å; E193-K330 IonicContact OE1-NZ 3.81Å; E193-K330 PolarHBondContact OE1-NZ 2.81Å; E193-K330 WeakPolarHBondContact OE2-CE 3.46Å; E193-K330 IonicContact OE2-NZ 2.84Å; E193-K330 PolarHBondContact OE2-NZ 2.87Å; V326-K330 HydrophobicContact CG2-CG 4.28Å; V326-K330 PolarHBondContact O-N 2.73Å; A327-K330 PolarHBondContact O-N 3.45Å; K330-W340 VanDerWaalsContact CA-CZ2 3.44Å; K330-W340 HydrophobicContact CB-CD2 4.45Å; K330-W340 HydrophobicContact CB-CZ2 3.81Å; K330-W340 HydrophobicContact CD-CD2 4.11Å; K330-W340 HydrophobicContact CD-CE3 4.44Å; K330-W340 HydrophobicContact CD-CG 4.39Å; K330-W340 HydrophobicContact CG-CD2 3.94Å; K330-W340 HydrophobicContact CG-CE3 4.22Å; K330-W340 HydrophobicContact CG-CH2 3.96Å; K330-W340 HydrophobicContact CG-CZ2 3.69Å; K330-W340 HydrophobicContact CG-CZ3 4.2Å; K330-W340 PolarHBondContact O-NE1 3.34Å
331	N	98	Very high	97.3	Very high	132 Å²	132	59 Å²	59	71%	0.706	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	1.3	-178.2	-62.1	-33.4	0	0	0	113.1	A327 I329	A327-N331 VanDerWaalsContact O-CB 3.28Å; A327-N331 WeakPolarHBondContact O-CB 3.36Å; A327-N331 PolarHBondContact O-N 2.68Å; A327-N331 PolarHBondContact O-ND2 3.36Å; I329-N331 VanDerWaalsContact C-N 3.3Å; I329-N331 PolarHBondContact O-N 3.27Å
332	H	98.7	Very high	97.2	Very high	13 Å²	13	57.2 Å²	57.2	6%	0.06	32%	0.318	C	S	.	.	S	Bend	trans	-64.6	142.5	178.4	-172.5	-90.6	0	0	0	110.9	E302 D305 L306 Y319 I329 W334 F335 G336	E302-H332 PolarHBondContact O-CE1 2.65Å; D305-H332 IonicContact OD2-NE2 3.23Å; D305-H332 PolarHBondContact OD2-NE2 3.5Å; L306-H332 HydrophobicContact CD1-CB 4.16Å; L306-H332 PolarHBondContact N-CE1 2.83Å; Y319-H332 AromaticContact CE2-CD2 3.81Å; I329-H332 VanDerWaalsContact O-CB 3.26Å; I329-H332 WeakPolarHBondContact O-CB 3.26Å; I329-H332 PolarHBondContact O-N 2.69Å; I329-H332 VanDerWaalsContact O-N 3.15Å; H332-W334 WeakPolarHBondContact ND1-CB 3.44Å; H332-W334 PolarHBondContact ND1-N 2.95Å; H332-W334 PolarHBondContact O-N 3.23Å; H332-F335 WeakPolarHBondContact O-CA 3.24Å; H332-F335 PolarHBondContact O-N 2.9Å; H332-G336 PolarHBondContact O-N 3.11Å
333	K	98.4	Very high	97.2	Very high	171 Å²	171	54.9 Å²	54.9	74%	0.743	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-54.5	-33.8	-176.4	-67.1	-177.7	-178.8	178.1	0	113.7	E302 F335 G336	E302-K333 HydrophobicContact CG-CB 4.04Å; K333-F335 PolarHBondContact O-N 3.26Å; K333-G336 PolarHBondContact O-N 2.99Å
334	W	98.7	Very high	97.1	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.015	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-61.3	-30.5	175.9	-168.9	74.6	0	0	0	112.7	E178 R182 A185 I266 E302 L303 L306 H332	E178-W334 HydrophobicContact CB-CZ2 4.36Å; E178-W334 PolarHBondContact OE2-NE1 2.8Å; R182-W334 HydrophobicContact CB-CE3 4.48Å; R182-W334 HydrophobicContact CB-CH2 3.61Å; R182-W334 HydrophobicContact CB-CZ2 3.96Å; R182-W334 HydrophobicContact CB-CZ3 3.88Å; R182-W334 WeakPolarHBondContact CD-O 3.38Å; R182-W334 HydrophobicContact CG-CE3 4.26Å; R182-W334 HydrophobicContact CG-CH2 4.24Å; R182-W334 HydrophobicContact CG-CZ3 3.99Å; R182-W334 PolarHBondContact NE-O 2.94Å; R182-W334 PolarHBondContact NH2-O 2.86Å; A185-W334 HydrophobicContact CB-CH2 4.38Å; A185-W334 HydrophobicContact CB-CZ3 4.11Å; I266-W334 HydrophobicContact CD1-CZ3 4.31Å; I266-W334 HydrophobicContact CG2-CH2 3.86Å; I266-W334 HydrophobicContact CG2-CZ2 4.33Å; I266-W334 HydrophobicContact CG2-CZ3 4.29Å; E302-W334 HydrophobicContact CB-CB 4.01Å; E302-W334 HydrophobicContact CB-CG 4.48Å; L303-W334 HydrophobicContact CB-CG 4.45Å; L303-W334 HydrophobicContact CD1-CD2 4.18Å; L303-W334 HydrophobicContact CD1-CH2 4.45Å; L303-W334 HydrophobicContact CD1-CZ2 3.82Å; L306-W334 HydrophobicContact CB-CB 4.34Å; L306-W334 HydrophobicContact CD2-CB 4.14Å; L306-W334 HydrophobicContact CD2-CD2 3.95Å; L306-W334 HydrophobicContact CD2-CE3 3.41Å; L306-W334 VanDerWaalsContact CD2-CE3 3.41Å; L306-W334 HydrophobicContact CD2-CG 4.28Å; L306-W334 HydrophobicContact CD2-CZ3 4.06Å; H332-W334 WeakPolarHBondContact ND1-CB 3.44Å; H332-W334 PolarHBondContact ND1-N 2.95Å; H332-W334 PolarHBondContact O-N 3.23Å
335	F	98.7	Very high	97	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-92.4	7.1	172.3	-74.7	-74	0	0	0	113.2	R182 A185 A186 V189 L306 I329 H332 K333 S337 T338 W340	R182-F335 HydrophobicContact CG-CD1 3.69Å; R182-F335 HydrophobicContact CG-CE1 3.89Å; A185-F335 HydrophobicContact CB-CE1 4.05Å; A185-F335 HydrophobicContact CB-CZ 3.83Å; A186-F335 HydrophobicContact CB-CE1 4.17Å; V189-F335 HydrophobicContact CG2-CZ 4.18Å; L306-F335 HydrophobicContact CD2-CD2 4.19Å; L306-F335 HydrophobicContact CD2-CE2 3.72Å; I329-F335 HydrophobicContact CG2-CD2 4.26Å; I329-F335 HydrophobicContact CG2-CE2 3.75Å; I329-F335 VanDerWaalsContact O-CD2 3.31Å; I329-F335 WeakPolarHBondContact O-CD2 3.4Å; H332-F335 WeakPolarHBondContact O-CA 3.24Å; H332-F335 PolarHBondContact O-N 2.9Å; K333-F335 PolarHBondContact O-N 3.26Å; F335-S337 PolarHBondContact O-N 3.37Å; F335-T338 HydrophobicContact CD1-CG2 4.37Å; F335-T338 WeakPolarHBondContact CD1-OG1 3.4Å; F335-T338 WeakPolarHBondContact O-CA 3.43Å; F335-T338 WeakPolarHBondContact O-CB 3.27Å; F335-T338 PolarHBondContact O-N 3.46Å; F335-T338 PolarHBondContact O-OG1 2.81Å; F335-W340 HydrophobicContact CB-CZ2 3.79Å; F335-W340 AromaticContact CD1-CH2 3.68Å; F335-W340 HydrophobicContact CD1-CH2 3.68Å; F335-W340 AromaticContact CD1-CZ2 3.77Å; F335-W340 HydrophobicContact CD1-CZ2 3.77Å; F335-W340 HydrophobicContact CD2-CH2 4.39Å; F335-W340 HydrophobicContact CD2-CZ2 4.32Å; F335-W340 AromaticContact CE1-CH2 3.86Å; F335-W340 HydrophobicContact CE1-CH2 3.86Å; F335-W340 HydrophobicContact CE1-CZ2 4.42Å; F335-W340 AromaticContact CG-CH2 3.97Å; F335-W340 HydrophobicContact CG-CH2 3.97Å; F335-W340 AromaticContact CG-CZ2 3.72Å; F335-W340 HydrophobicContact CG-CZ2 3.72Å; F335-W340 HydrophobicContact CZ-CH2 4.28Å
336	G	97.1	Very high	97	Very high	68 Å²	68	45.6 Å²	45.6	70%	0.701	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.3	-171.1	0	0	0	0	0	115.9	H332 K333	H332-G336 PolarHBondContact O-N 3.11Å; K333-G336 PolarHBondContact O-N 2.99Å
337	S	96	Very high	97	Very high	95 Å²	95	51.5 Å²	51.5	66%	0.664	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	8.8	174	72.1	0	0	0	0	114	F335	F335-S337 PolarHBondContact O-N 3.37Å
338	T	97.8	Very high	97	Very high	25 Å²	25	52.9 Å²	52.9	15%	0.153	28%	0.281	C	S	.	.			trans	-95.2	117.2	-172.1	-47.9	0	0	0	0	109.8	R182 A186 F335 W340 I343	R182-T338 WeakPolarHBondContact CD-OG1 3.44Å; A186-T338 HydrophobicContact CB-CG2 3.73Å; F335-T338 HydrophobicContact CD1-CG2 4.37Å; F335-T338 WeakPolarHBondContact CD1-OG1 3.4Å; F335-T338 WeakPolarHBondContact O-CA 3.43Å; F335-T338 WeakPolarHBondContact O-CB 3.27Å; F335-T338 PolarHBondContact O-N 3.46Å; F335-T338 PolarHBondContact O-OG1 2.81Å; T338-W340 HydrophobicContact CG2-CD2 4.2Å; T338-W340 HydrophobicContact CG2-CE3 4.37Å; T338-W340 HydrophobicContact CG2-CH2 4.4Å; T338-W340 HydrophobicContact CG2-CZ2 4.19Å; T338-W340 HydrophobicContact CG2-CZ3 4.49Å; T338-W340 PolarHBondContact O-N 3.49Å; T338-I343 HydrophobicContact CG2-CG1 4.14Å
339	D	96.6	Very high	96.9	Very high	87 Å²	87	60.1 Å²	60.1	47%	0.465	31%	0.314	S	S	.	.			trans	-85.8	101.9	166.9	-176.1	-23.6	0	0	0	109.2	I341 A342 I343	D339-I341 VanDerWaalsContact C-N 3.31Å; D339-I341 PolarHBondContact O-N 3.43Å; D339-I341 PolarHBondContact OD1-N 3.23Å; D339-I341 VanDerWaalsContact OD1-N 3.08Å; D339-A342 HydrophobicContact CB-CB 3.8Å; D339-A342 PolarHBondContact O-N 3.21Å; D339-A342 PolarHBondContact OD1-N 3.13Å; D339-I343 VanDerWaalsContact O-CG1 3.28Å; D339-I343 WeakPolarHBondContact O-CG1 3.48Å; D339-I343 PolarHBondContact O-N 3.36Å
340	W	96.2	Very high	96.8	Very high	37 Å²	37	60.7 Å²	60.7	14%	0.14	32%	0.319	C	S	.	.	H	α-helix	trans	-62.3	-36.4	-176.8	-64.7	101.8	0	0	0	113.2	A186 V189 L190 K330 F335 T338 Y344	A186-W340 HydrophobicContact CB-CE3 4.37Å; A186-W340 HydrophobicContact CB-CH2 4.15Å; A186-W340 HydrophobicContact CB-CZ3 3.75Å; A186-W340 WeakPolarHBondContact O-CZ3 3.3Å; V189-W340 HydrophobicContact CB-CH2 4.05Å; V189-W340 HydrophobicContact CB-CZ3 3.8Å; V189-W340 HydrophobicContact CG1-CH2 3.82Å; V189-W340 HydrophobicContact CG1-CZ3 3.66Å; V189-W340 HydrophobicContact CG2-CH2 4.33Å; L190-W340 HydrophobicContact CD1-CE3 4.2Å; L190-W340 HydrophobicContact CD2-CE3 3.98Å; L190-W340 HydrophobicContact CG-CE3 3.89Å; L190-W340 HydrophobicContact CG-CZ3 4.29Å; K330-W340 VanDerWaalsContact CA-CZ2 3.44Å; K330-W340 HydrophobicContact CB-CD2 4.45Å; K330-W340 HydrophobicContact CB-CZ2 3.81Å; K330-W340 HydrophobicContact CD-CD2 4.11Å; K330-W340 HydrophobicContact CD-CE3 4.44Å; K330-W340 HydrophobicContact CD-CG 4.39Å; K330-W340 HydrophobicContact CG-CD2 3.94Å; K330-W340 HydrophobicContact CG-CE3 4.22Å; K330-W340 HydrophobicContact CG-CH2 3.96Å; K330-W340 HydrophobicContact CG-CZ2 3.69Å; K330-W340 HydrophobicContact CG-CZ3 4.2Å; K330-W340 PolarHBondContact O-NE1 3.34Å; F335-W340 HydrophobicContact CB-CZ2 3.79Å; F335-W340 AromaticContact CD1-CH2 3.68Å; F335-W340 HydrophobicContact CD1-CH2 3.68Å; F335-W340 AromaticContact CD1-CZ2 3.77Å; F335-W340 HydrophobicContact CD1-CZ2 3.77Å; F335-W340 HydrophobicContact CD2-CH2 4.39Å; F335-W340 HydrophobicContact CD2-CZ2 4.32Å; F335-W340 AromaticContact CE1-CH2 3.86Å; F335-W340 HydrophobicContact CE1-CH2 3.86Å; F335-W340 HydrophobicContact CE1-CZ2 4.42Å; F335-W340 AromaticContact CG-CH2 3.97Å; F335-W340 HydrophobicContact CG-CH2 3.97Å; F335-W340 AromaticContact CG-CZ2 3.72Å; F335-W340 HydrophobicContact CG-CZ2 3.72Å; F335-W340 HydrophobicContact CZ-CH2 4.28Å; T338-W340 HydrophobicContact CG2-CD2 4.2Å; T338-W340 HydrophobicContact CG2-CE3 4.37Å; T338-W340 HydrophobicContact CG2-CH2 4.4Å; T338-W340 HydrophobicContact CG2-CZ2 4.19Å; T338-W340 HydrophobicContact CG2-CZ3 4.49Å; T338-W340 PolarHBondContact O-N 3.49Å; W340-Y344 WeakPolarHBondContact O-CB 3.45Å; W340-Y344 PolarHBondContact O-N 2.73Å
341	I	94.1	Very high	96.7	Very high	52 Å²	52	62.5 Å²	62.5	27%	0.267	33%	0.333	S	S	.	.	H	α-helix	trans	-74.4	-42.4	-179.8	-60.4	-59.1	0	0	0	109.7	F53 D339 I343 Y344 Q345	F53-I341 HydrophobicContact CB-CD1 4.12Å; D339-I341 VanDerWaalsContact C-N 3.31Å; D339-I341 PolarHBondContact O-N 3.43Å; D339-I341 PolarHBondContact OD1-N 3.23Å; D339-I341 VanDerWaalsContact OD1-N 3.08Å; I341-I343 VanDerWaalsContact C-N 3.33Å; I341-I343 PolarHBondContact O-N 3.27Å; I341-Y344 PolarHBondContact O-N 2.87Å; I341-Q345 HydrophobicContact CG2-CG 4.26Å; I341-Q345 WeakPolarHBondContact O-CB 3.34Å; I341-Q345 VanDerWaalsContact O-CG 3.3Å; I341-Q345 WeakPolarHBondContact O-CG 3.19Å; I341-Q345 PolarHBondContact O-N 3.33Å
342	A	95.3	Very high	96.6	Very high	9 Å²	9	58.1 Å²	58.1	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-35.8	175.2	0	0	0	0	0	112.4	D339 K346 K347 I348	D339-A342 HydrophobicContact CB-CB 3.8Å; D339-A342 PolarHBondContact O-N 3.21Å; D339-A342 PolarHBondContact OD1-N 3.13Å; A342-K346 PolarHBondContact O-N 2.86Å; A342-K347 HydrophobicContact CB-CB 4.23Å; A342-K347 PolarHBondContact O-N 2.85Å; A342-I348 HydrophobicContact CB-CD1 3.57Å; A342-I348 HydrophobicContact CB-CG1 3.84Å
343	I	97	Very high	96.4	Very high	5 Å²	5	62.7 Å²	62.7	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-54	171	-69.1	-72.3	0	0	0	109.7	F140 F183 A186 Q187 L190 T338 D339 I341 Q345 K346 I348	F140-I343 HydrophobicContact CE2-CG2 4.17Å; F140-I343 HydrophobicContact CZ-CG2 3.95Å; F140-I343 WeakPolarHBondContact CZ-O 3.16Å; F183-I343 HydrophobicContact CD2-CD1 3.67Å; F183-I343 HydrophobicContact CE2-CD1 3.9Å; A186-I343 HydrophobicContact CB-CG1 4.25Å; A186-I343 HydrophobicContact CB-CG2 4.27Å; Q187-I343 HydrophobicContact CG-CG2 3.73Å; L190-I343 HydrophobicContact CD1-CB 4.25Å; L190-I343 HydrophobicContact CD1-CG2 3.76Å; T338-I343 HydrophobicContact CG2-CG1 4.14Å; D339-I343 VanDerWaalsContact O-CG1 3.28Å; D339-I343 WeakPolarHBondContact O-CG1 3.48Å; D339-I343 PolarHBondContact O-N 3.36Å; I341-I343 VanDerWaalsContact C-N 3.33Å; I341-I343 PolarHBondContact O-N 3.27Å; I343-Q345 VanDerWaalsContact C-N 3.31Å; I343-Q345 PolarHBondContact O-N 3.27Å; I343-K346 WeakPolarHBondContact O-CA 3.12Å; I343-K346 PolarHBondContact O-N 3.31Å; I343-I348 HydrophobicContact CD1-CB 3.95Å; I343-I348 HydrophobicContact CD1-CG1 3.73Å; I343-I348 HydrophobicContact CD1-CG2 4.22Å; I343-I348 HydrophobicContact CG1-CG1 4.08Å
344	Y	95	Very high	96.2	Very high	9 Å²	9	55.1 Å²	55.1	4%	0.035	30%	0.301	C	S	.	.	H	α-helix	trans	-54	-44.9	179.5	170.3	-107.3	0	0	0	112.6	L46 V50 F53 F56 F138 P139 W340 I341 K346	L46-Y344 HydrophobicContact CD2-CE2 4.25Å; L46-Y344 WeakPolarHBondContact CD2-OH 3.41Å; V50-Y344 HydrophobicContact CB-CE1 4.03Å; V50-Y344 HydrophobicContact CG1-CE1 4.46Å; V50-Y344 HydrophobicContact CG2-CE1 3.81Å; F53-Y344 HydrophobicContact CD2-CD2 4.32Å; F53-Y344 HydrophobicContact CD2-CG 4.29Å; F53-Y344 AromaticContact CE2-CD2 3.71Å; F53-Y344 HydrophobicContact CE2-CD2 3.71Å; F53-Y344 HydrophobicContact CE2-CE2 4.01Å; F53-Y344 HydrophobicContact CE2-CG 4.1Å; F56-Y344 WeakPolarHBondContact CD2-OH 3.18Å; F56-Y344 HydrophobicContact CE1-CE2 4.31Å; F56-Y344 HydrophobicContact CE2-CE2 4.44Å; F56-Y344 WeakPolarHBondContact CE2-OH 3.45Å; F56-Y344 HydrophobicContact CZ-CE2 4.26Å; F138-Y344 HydrophobicContact CD2-CE2 4.43Å; F138-Y344 HydrophobicContact CE2-CD2 4.02Å; F138-Y344 AromaticContact CE2-CE2 3.7Å; F138-Y344 HydrophobicContact CE2-CE2 3.7Å; F138-Y344 AromaticContact CZ-CD2 3.99Å; F138-Y344 HydrophobicContact CZ-CD2 3.99Å; F138-Y344 HydrophobicContact CZ-CE2 4.15Å; P139-Y344 HydrophobicContact CG-CD2 3.98Å; P139-Y344 HydrophobicContact CG-CE2 3.62Å; W340-Y344 WeakPolarHBondContact O-CB 3.45Å; W340-Y344 PolarHBondContact O-N 2.73Å; I341-Y344 PolarHBondContact O-N 2.87Å; Y344-K346 PolarHBondContact O-N 3.43Å
345	Q	94.2	Very high	95.9	Very high	62 Å²	62	63.8 Å²	63.8	29%	0.29	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.6	179.2	-66.1	176.7	-6.2	0	0	113.7	I341 I343 K347	I341-Q345 HydrophobicContact CG2-CG 4.26Å; I341-Q345 WeakPolarHBondContact O-CB 3.34Å; I341-Q345 VanDerWaalsContact O-CG 3.3Å; I341-Q345 WeakPolarHBondContact O-CG 3.19Å; I341-Q345 PolarHBondContact O-N 3.33Å; I343-Q345 VanDerWaalsContact C-N 3.31Å; I343-Q345 PolarHBondContact O-N 3.27Å; Q345-K347 VanDerWaalsContact C-N 3.28Å; Q345-K347 HydrophobicContact CB-CD 4.03Å; Q345-K347 HydrophobicContact CB-CG 3.99Å; Q345-K347 PolarHBondContact O-N 3.46Å
346	K	96.4	Very high	95.5	Very high	69 Å²	69	65.7 Å²	65.7	30%	0.3	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	37.6	-175.8	-60.1	-168	174	-170.8	0	114.7	F140 D213 Y217 A342 I343 Y344	F140-K346 HydrophobicContact CE1-CG 4.19Å; D213-K346 IonicContact OD2-NZ 3.61Å; D213-K346 PolarHBondContact OD2-NZ 2.93Å; Y217-K346 HydrophobicContact CD1-CB 4.47Å; Y217-K346 HydrophobicContact CD1-CD 4.25Å; Y217-K346 HydrophobicContact CD1-CG 3.86Å; Y217-K346 HydrophobicContact CD2-CB 4.26Å; Y217-K346 HydrophobicContact CD2-CD 4.2Å; Y217-K346 HydrophobicContact CD2-CG 4.24Å; Y217-K346 HydrophobicContact CE1-CB 4.12Å; Y217-K346 HydrophobicContact CE1-CG 3.88Å; Y217-K346 HydrophobicContact CE2-CB 3.89Å; Y217-K346 HydrophobicContact CE2-CG 4.27Å; Y217-K346 HydrophobicContact CG-CD 3.98Å; Y217-K346 HydrophobicContact CG-CG 4.04Å; Y217-K346 VanDerWaalsContact CZ-CA 3.44Å; Y217-K346 VanDerWaalsContact OH-C 3.23Å; Y217-K346 VanDerWaalsContact OH-CA 3.26Å; Y217-K346 WeakPolarHBondContact OH-CA 3.2Å; A342-K346 PolarHBondContact O-N 2.86Å; I343-K346 WeakPolarHBondContact O-CA 3.12Å; I343-K346 PolarHBondContact O-N 3.31Å; Y344-K346 PolarHBondContact O-N 3.43Å
347	K	96.3	Very high	95.2	Very high	149 Å²	149	73.3 Å²	73.3	65%	0.648	36%	0.359	S	S	*	.			trans	-95.7	-4.2	-178.2	-70.2	-179.6	177.4	169.8	0	114.5	Y217 A342 Q345	Y217-K347 PolarHBondContact OH-N 2.72Å; A342-K347 HydrophobicContact CB-CB 4.23Å; A342-K347 PolarHBondContact O-N 2.85Å; Q345-K347 VanDerWaalsContact C-N 3.28Å; Q345-K347 HydrophobicContact CB-CD 4.03Å; Q345-K347 HydrophobicContact CB-CG 3.99Å; Q345-K347 PolarHBondContact O-N 3.46Å
348	I	96.6	Very high	94.9	Very high	63 Å²	63	70.2 Å²	70.2	32%	0.323	34%	0.342	S	S	.	.	S	Bend	trans	-90.7	133.3	178.4	-58.6	-58.8	0	0	0	108.7	F183 Y217 A342 I343 A350	F183-I348 HydrophobicContact CD2-CG2 3.94Å; F183-I348 HydrophobicContact CE2-CB 4.13Å; F183-I348 HydrophobicContact CE2-CG2 3.95Å; Y217-I348 PolarHBondContact OH-N 3.46Å; Y217-I348 PolarHBondContact OH-O 2.73Å; A342-I348 HydrophobicContact CB-CD1 3.57Å; A342-I348 HydrophobicContact CB-CG1 3.84Å; I343-I348 HydrophobicContact CD1-CB 3.95Å; I343-I348 HydrophobicContact CD1-CG1 3.73Å; I343-I348 HydrophobicContact CD1-CG2 4.22Å; I343-I348 HydrophobicContact CG1-CG1 4.08Å; I348-A350 PolarHBondContact O-N 3.49Å
349	E	96.7	Very high	94.5	Very high	182 Å²	182	73.9 Å²	73.9	85%	0.85	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-61.7	123.7	175	-173	178.9	177.9	0	0	110.3
350	A	97.5	Very high	94.3	Very high	13 Å²	13	70.9 Å²	70.9	11%	0.107	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-71.2	135.7	-179.3	0	0	0	0	0	110.7	F183 T215 I348 F352 L353	F183-A350 HydrophobicContact CE1-CB 4.03Å; F183-A350 HydrophobicContact CZ-CB 3.81Å; T215-A350 VanDerWaalsContact O-CB 3.27Å; T215-A350 WeakPolarHBondContact O-CB 3.11Å; I348-A350 PolarHBondContact O-N 3.49Å; A350-F352 PolarHBondContact O-N 3.35Å; A350-F352 VanDerWaalsContact O-N 3.14Å; A350-L353 HydrophobicContact CB-CD2 4.23Å
351	P	96.2	Very high	94.2	Very high	65 Å²	65	70.2 Å²	70.2	42%	0.422	36%	0.355	S	S	.	.	S	Bend	trans	-67.7	-13.8	-179.9	28.5	-36.5	0	0	0	113.7	H180 F183	H180-P351 HydrophobicContact CB-CB 4.13Å; H180-P351 HydrophobicContact CB-CG 4.23Å; H180-P351 WeakPolarHBondContact CD2-CG 3.46Å; F183-P351 HydrophobicContact CB-CG 4.26Å; F183-P351 HydrophobicContact CD1-CG 3.77Å; F183-P351 HydrophobicContact CE1-CG 4.37Å; F183-P351 HydrophobicContact CG-CG 4.12Å
352	F	94.8	Very high	94.1	Very high	41 Å²	41	68.3 Å²	68.3	18%	0.18	35%	0.347	C	S	.	.			trans	-146.2	128.1	177.8	168.7	-105.2	0	0	0	109.6	H169 I212 G216 A350 P354	H169-F352 AromaticContact CD2-CE1 3.87Å; H169-F352 AromaticContact CE1-CE1 3.83Å; H169-F352 AromaticContact CE1-CZ 3.76Å; H169-F352 AromaticContact ND1-CZ 3.87Å; H169-F352 AromaticContact NE2-CE1 3.69Å; I212-F352 HydrophobicContact CD1-CD1 3.96Å; I212-F352 HydrophobicContact CD1-CE1 4.15Å; I212-F352 HydrophobicContact CG2-CD1 4.37Å; G216-F352 WeakPolarHBondContact CA-O 3.13Å; A350-F352 PolarHBondContact O-N 3.35Å; A350-F352 VanDerWaalsContact O-N 3.14Å; F352-P354 HydrophobicContact CE1-CB 3.92Å; F352-P354 HydrophobicContact CZ-CB 4.1Å
353	L	95.3	Very high	94	Very high	109 Å²	109	71.2 Å²	71.2	57%	0.571	37%	0.367	S	S	*	.			trans	-110	119.4	170.8	-65.6	175.6	0	0	0	108.8	T215 A350	T215-L353 VanDerWaalsContact C-CD2 3.42Å; T215-L353 VanDerWaalsContact O-CD2 3.25Å; T215-L353 WeakPolarHBondContact O-CD2 3.4Å; A350-L353 HydrophobicContact CB-CD2 4.23Å
354	P	93.2	Very high	93.7	Very high	11 Å²	11	72.9 Å²	72.9	7%	0.071	38%	0.376	C	S	.	.			trans	-67.1	149.6	176.6	27.7	-32.3	0	0	0	110.6	I212 D213 F352 C356	I212-P354 HydrophobicContact CG2-CG 4.23Å; D213-P354 WeakPolarHBondContact O-CD 3.49Å; D213-P354 WeakPolarHBondContact O-CG 3.45Å; F352-P354 HydrophobicContact CE1-CB 3.92Å; F352-P354 HydrophobicContact CZ-CB 4.1Å; P354-C356 PolarHBondContact O-N 2.86Å
355	K	92.9	Very high	93.4	Very high	186 Å²	186	73.8 Å²	73.8	81%	0.809	38%	0.38	S	S	*	.			trans	-77	113.7	172.8	-67.9	-176.5	-179.9	-179.6	0	108	N364	K355-N364 PolarHBondContact O-ND2 3.44Å
356	C	90.4	Very high	93.1	Very high	43 Å²	43	74.8 Å²	74.8	29%	0.291	39%	0.388	S	S	.	.			trans	-126.9	121.8	175.3	-57.2	0	0	0	0	109.4	S162 P354 D361	S162-C356 PolarHBondContact OG-SG 3.05Å; S162-C356 VanDerWaalsContact OG-SG 3.34Å; P354-C356 PolarHBondContact O-N 2.86Å; C356-D361 WeakPolarHBondContact CA-OD2 3.47Å
357	R	89.9	Confident	92.9	Very high	228 Å²	228	78.2 Å²	78.2	86%	0.86	41%	0.409	S	S	*	.	S	Bend	trans	-84	-12.2	-177.4	-59.7	-179.8	-171.7	-174.1	3.5	113.6	D361	R357-D361 HydrophobicContact CB-CB 4.38Å; R357-D361 WeakPolarHBondContact CB-OD2 3.34Å; R357-D361 WeakPolarHBondContact CG-OD2 3.38Å; R357-D361 PolarHBondContact N-OD2 3.29Å
358	G	90.5	Very high	92.7	Very high	30 Å²	30	73.4 Å²	73.4	31%	0.309	39%	0.387	S	S	.	.	S	Bend	trans	171.5	176.8	-178.5	0	0	0	0	0	112.4	G360 D361	G358-G360 VanDerWaalsContact C-N 3.26Å; G358-G360 PolarHBondContact O-N 3.2Å; G358-D361 VanDerWaalsContact O-CB 3.31Å; G358-D361 WeakPolarHBondContact O-CB 3.35Å; G358-D361 PolarHBondContact O-N 3.28Å; G358-D361 VanDerWaalsContact O-N 3.13Å
359	P	89.8	Confident	92.4	Very high	102 Å²	102	78.4 Å²	78.4	66%	0.662	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.9	-173	26	-35.1	0	0	0	114.6	Y106 F160	Y106-P359 HydrophobicContact CD2-CB 3.93Å; Y106-P359 HydrophobicContact CD2-CG 4.17Å; Y106-P359 HydrophobicContact CE2-CB 4.23Å; Y106-P359 HydrophobicContact CE2-CG 3.95Å; F160-P359 WeakPolarHBondContact CD1-O 3.48Å
360	G	92.2	Very high	92.2	Very high	23 Å²	23	74.1 Å²	74.1	24%	0.237	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	16.1	174.7	0	0	0	0	0	113.7	L97 G358 A362	L97-G360 WeakPolarHBondContact CD2-O 2.9Å; G358-G360 VanDerWaalsContact C-N 3.26Å; G358-G360 PolarHBondContact O-N 3.2Å; G360-A362 PolarHBondContact O-N 3.26Å
361	D	93.6	Very high	91.8	Very high	23 Å²	23	78.8 Å²	78.8	12%	0.123	41%	0.409	C	S	.	.			trans	-73.5	115.8	179.9	-177	10.9	0	0	0	110.8	F160 C356 R357 G358 S363	F160-D361 WeakPolarHBondContact CE1-O 3.37Å; F160-D361 WeakPolarHBondContact CZ-O 3.42Å; C356-D361 WeakPolarHBondContact CA-OD2 3.47Å; R357-D361 HydrophobicContact CB-CB 4.38Å; R357-D361 WeakPolarHBondContact CB-OD2 3.34Å; R357-D361 WeakPolarHBondContact CG-OD2 3.38Å; R357-D361 PolarHBondContact N-OD2 3.29Å; G358-D361 VanDerWaalsContact O-CB 3.31Å; G358-D361 WeakPolarHBondContact O-CB 3.35Å; G358-D361 PolarHBondContact O-N 3.28Å; G358-D361 VanDerWaalsContact O-N 3.13Å; D361-S363 VanDerWaalsContact CG-OG 3.29Å; D361-S363 WeakPolarHBondContact OD1-CB 3.39Å; D361-S363 PolarHBondContact OD1-N 3.29Å; D361-S363 PolarHBondContact OD1-OG 3.39Å; D361-S363 PolarHBondContact OD2-OG 2.98Å
362	A	92.5	Very high	91.4	Very high	12 Å²	12	80.3 Å²	80.3	10%	0.099	42%	0.419	C	S	.	.			trans	-109.5	22.4	176.3	0	0	0	0	0	112.8	K85 L87 L97 F160 G360 N364 F365	K85-A362 HydrophobicContact CD-CB 4.49Å; L87-A362 HydrophobicContact CD2-CB 3.66Å; L97-A362 HydrophobicContact CD2-CB 4.15Å; F160-A362 HydrophobicContact CZ-CB 4.31Å; G360-A362 PolarHBondContact O-N 3.26Å; A362-N364 PolarHBondContact O-N 2.8Å; A362-F365 HydrophobicContact CB-CD2 4.28Å; A362-F365 PolarHBondContact O-N 3.05Å; A362-F365 VanDerWaalsContact O-N 3.11Å
363	S	93.1	Very high	91.3	Very high	70 Å²	70	80.6 Å²	80.6	49%	0.49	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.8	-179.2	60.8	0	0	0	0	114.8	D361 F365	D361-S363 VanDerWaalsContact CG-OG 3.29Å; D361-S363 WeakPolarHBondContact OD1-CB 3.39Å; D361-S363 PolarHBondContact OD1-N 3.29Å; D361-S363 PolarHBondContact OD1-OG 3.39Å; D361-S363 PolarHBondContact OD2-OG 2.98Å; S363-F365 VanDerWaalsContact C-N 3.29Å
364	N	91.6	Very high	91.1	Very high	41 Å²	41	85.3 Å²	85.3	22%	0.219	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	4.2	171.2	-61.4	-58.5	0	0	0	113.1	S162 G163 K355 A362	S162-N364 PolarHBondContact O-ND2 3.06Å; G163-N364 WeakPolarHBondContact O-CB 3.29Å; K355-N364 PolarHBondContact O-ND2 3.44Å; A362-N364 PolarHBondContact O-N 2.8Å
365	F	88.6	Confident	91.2	Very high	27 Å²	27	88.8 Å²	88.8	12%	0.118	45%	0.449	C	S	.	.	S	Bend	trans	-115.1	147.4	176.6	-64.6	-92.3	0	0	0	110.5	L87 F160 I161 A362 S363	L87-F365 HydrophobicContact CB-CD1 4.29Å; L87-F365 HydrophobicContact CD2-CB 4.23Å; L87-F365 HydrophobicContact CD2-CD1 4.35Å; L87-F365 HydrophobicContact CD2-CD2 3.93Å; L87-F365 HydrophobicContact CD2-CE2 4.39Å; L87-F365 HydrophobicContact CD2-CG 3.91Å; F160-F365 HydrophobicContact CE2-CD2 4.38Å; F160-F365 AromaticContact CE2-CE2 3.68Å; F160-F365 HydrophobicContact CE2-CE2 3.68Å; F160-F365 HydrophobicContact CE2-CZ 4.15Å; F160-F365 AromaticContact CZ-CE2 4Å; F160-F365 HydrophobicContact CZ-CE2 4Å; I161-F365 WeakPolarHBondContact O-CE2 3.47Å; I161-F365 WeakPolarHBondContact O-CZ 3.26Å; A362-F365 HydrophobicContact CB-CD2 4.28Å; A362-F365 PolarHBondContact O-N 3.05Å; A362-F365 VanDerWaalsContact O-N 3.11Å; S363-F365 VanDerWaalsContact C-N 3.29Å
366	D	88.1	Confident	91.3	Very high	84 Å²	84	81.4 Å²	81.4	45%	0.449	42%	0.421	S	S	.	.			trans	-63	161.3	176.6	-67.5	-29.8	0	0	0	112	K85 Y368	K85-D366 WeakPolarHBondContact CE-O 3.1Å; K85-D366 PolarHBondContact NZ-O 3.29Å; D366-Y368 HydrophobicContact CB-CE2 3.83Å; D366-Y368 WeakPolarHBondContact O-CD2 3.31Å
367	D	90.7	Very high	91.6	Very high	141 Å²	141	83.2 Å²	83.2	75%	0.754	45%	0.447	S	S	*	.			trans	-89	129.3	172.2	-67.6	-48.3	0	0	0	109.7	K85	K85-D367 VanDerWaalsContact CE-OD1 3.3Å; K85-D367 WeakPolarHBondContact CE-OD1 3.03Å; K85-D367 IonicContact NZ-OD1 3.65Å; K85-D367 PolarHBondContact NZ-OD1 3.33Å
368	Y	91.9	Very high	91.9	Very high	48 Å²	48	76.3 Å²	76.3	19%	0.188	43%	0.43	C	S	.	.			trans	-117.6	154.9	178.4	-68.2	-93.6	0	0	0	110.3	T86 L87 T89 D366 E370	T86-Y368 HydrophobicContact CG2-CD2 4.44Å; T86-Y368 HydrophobicContact CG2-CG 4.14Å; L87-Y368 WeakPolarHBondContact O-CE2 3.34Å; T89-Y368 HydrophobicContact CG2-CD1 3.81Å; T89-Y368 HydrophobicContact CG2-CE1 4.39Å; T89-Y368 HydrophobicContact CG2-CG 4.36Å; D366-Y368 HydrophobicContact CB-CE2 3.83Å; D366-Y368 WeakPolarHBondContact O-CD2 3.31Å; Y368-E370 PolarHBondContact O-N 2.73Å
369	E	91.3	Very high	92.2	Very high	168 Å²	168	80.2 Å²	80.2	79%	0.785	44%	0.44	S	S	*	.			trans	-67.5	125.2	173.8	-172.8	175.2	177.7	0	0	110.5	E371	E369-E371 PolarHBondContact O-N 3.39Å
370	E	92.2	Very high	92.5	Very high	91 Å²	91	78.1 Å²	78.1	43%	0.425	42%	0.421	S	S	.	.			trans	-80.8	117.1	177.7	-61.1	-60.9	164.4	0	0	110.5	K85 T86 Y368	K85-E370 WeakPolarHBondContact CA-OE1 3.37Å; T86-E370 PolarHBondContact N-OE1 3.1Å; T86-E370 PolarHBondContact N-OE2 3.41Å; T86-E370 PolarHBondContact OG1-OE2 3.48Å; Y368-E370 PolarHBondContact O-N 2.73Å
371	E	88.5	Confident	92.7	Very high	111 Å²	111	78.1 Å²	78.1	52%	0.519	42%	0.417	S	S	.	.			trans	-105.9	144.8	172.6	-39.8	177.4	156.2	0	0	111.5	R94 E369 L373	R94-E371 IonicContact CZ-OE2 3.77Å; R94-E371 PolarHBondContact NH1-O 2.71Å; R94-E371 VanDerWaalsContact NH2-CB 3.34Å; R94-E371 IonicContact NH2-OE2 2.63Å; R94-E371 PolarHBondContact NH2-OE2 3.45Å; E369-E371 PolarHBondContact O-N 3.39Å; E371-L373 PolarHBondContact O-N 3.05Å
372	P	89.3	Confident	92.8	Very high	97 Å²	97	78.9 Å²	78.9	63%	0.63	43%	0.427	S	S	*	.			trans	-65.3	131	176.3	26.5	-34	0	0	0	111.8	R374	P372-R374 PolarHBondContact O-N 3.12Å
373	L	91.5	Very high	93	Very high	48 Å²	48	87.6 Å²	87.6	25%	0.251	46%	0.462	S	S	.	.			trans	-74.9	113.3	173	-173.8	64	0	0	0	110	L78 I111 Y155 E371	L78-L373 HydrophobicContact CD1-CD2 4.28Å; L78-L373 HydrophobicContact CD2-CD2 3.84Å; I111-L373 HydrophobicContact CD1-CD2 4.22Å; I111-L373 HydrophobicContact CG2-CD1 3.81Å; Y155-L373 HydrophobicContact CE1-CD2 4.05Å; E371-L373 PolarHBondContact O-N 3.05Å
374	R	91.3	Very high	93.2	Very high	207 Å²	207	88.1 Å²	88.1	78%	0.781	46%	0.457	S	S	*	.			trans	-99.5	128.7	180	-62.1	-175.5	-177.1	-166.4	0.9	110.4	P372	P372-R374 PolarHBondContact O-N 3.12Å
375	I	95.4	Very high	93.4	Very high	84 Å²	84	86.2 Å²	86.2	43%	0.431	45%	0.447	S	S	.	.			trans	-110.8	121.2	175.6	-55.8	171.8	0	0	0	108	L78 D150 N151	L78-I375 HydrophobicContact CD2-CD1 3.74Å; D150-I375 HydrophobicContact CB-CG2 4.35Å; D150-I375 WeakPolarHBondContact OD2-CD1 3.42Å; D150-I375 WeakPolarHBondContact OD2-CG1 3.25Å; N151-I375 HydrophobicContact CB-CG2 4.02Å
376	S	95.3	Very high	93.7	Very high	32 Å²	32	87.9 Å²	87.9	22%	0.224	47%	0.465	C	S	.	.			trans	-61.5	143.3	175.7	169.9	0	0	0	0	111.3	N151 S152 T378 K380	N151-S376 WeakPolarHBondContact CB-O 3.43Å; N151-S376 PolarHBondContact ND2-O 2.76Å; S152-S376 WeakPolarHBondContact OG-CB 3.48Å; S152-S376 PolarHBondContact OG-N 2.96Å; S376-T378 WeakPolarHBondContact CB-O 3.46Å; S376-T378 PolarHBondContact O-N 3.33Å; S376-T378 PolarHBondContact OG-N 3.02Å; S376-T378 PolarHBondContact OG-O 2.85Å; S376-T378 PolarHBondContact OG-OG1 2.97Å; S376-T378 VanDerWaalsContact OG-OG1 3.11Å; S376-K380 WeakPolarHBondContact OG-CE 3.48Å
377	G	96.1	Very high	94	Very high	80 Å²	80	90.3 Å²	90.3	83%	0.825	47%	0.474	S	S	*	.	S	Bend	trans	-69.6	-9.7	169.9	0	0	0	0	0	114.2
378	T	96.1	Very high	94.2	Very high	83 Å²	83	83.6 Å²	83.6	51%	0.509	44%	0.438	S	S	.	.	S	Bend	trans	-122	140.3	176.2	49.8	0	0	0	0	110.9	S376 K380	S376-T378 WeakPolarHBondContact CB-O 3.46Å; S376-T378 PolarHBondContact O-N 3.33Å; S376-T378 PolarHBondContact OG-N 3.02Å; S376-T378 PolarHBondContact OG-O 2.85Å; S376-T378 PolarHBondContact OG-OG1 2.97Å; S376-T378 VanDerWaalsContact OG-OG1 3.11Å; T378-K380 PolarHBondContact O-N 3.07Å; T378-K380 PolarHBondContact OG1-NZ 3.26Å
379	E	97.1	Very high	94.3	Very high	112 Å²	112	85.4 Å²	85.4	52%	0.523	45%	0.45	S	S	.	.			trans	-65.9	127.6	179.2	-169.2	176.3	-154.2	0	0	111.4	A382	E379-A382 HydrophobicContact CG-CB 3.96Å; E379-A382 WeakPolarHBondContact OE2-CB 2.96Å
380	K	96.8	Very high	94.4	Very high	58 Å²	58	81 Å²	81	25%	0.252	43%	0.433	S	S	.	.			trans	-102.9	142.2	176	-53.4	-50.2	-172.2	-164.7	0	110	K114 Q115 N151 S376 T378 A382	K114-K380 WeakPolarHBondContact CD-O 3.41Å; K114-K380 PolarHBondContact NZ-O 2.91Å; Q115-K380 HydrophobicContact CG-CB 4.16Å; Q115-K380 HydrophobicContact CG-CG 4.31Å; N151-K380 VanDerWaalsContact O-CB 3.31Å; N151-K380 WeakPolarHBondContact O-CB 3.42Å; N151-K380 WeakPolarHBondContact O-CG 3.44Å; N151-K380 PolarHBondContact O-N 3.48Å; S376-K380 WeakPolarHBondContact OG-CE 3.48Å; T378-K380 PolarHBondContact O-N 3.07Å; T378-K380 PolarHBondContact OG1-NZ 3.26Å; K380-A382 VanDerWaalsContact C-N 3.25Å; K380-A382 PolarHBondContact O-N 2.99Å
381	C	96.1	Very high	94.6	Very high	24 Å²	24	80.4 Å²	80.4	16%	0.162	43%	0.433	C	S	.	.	S	Bend	trans	53	39.2	170.3	-51	0	0	0	0	113.7	K114 V118 K383 E384 F385	K114-C381 HydrophobicContact CB-CB 4.07Å; K114-C381 HydrophobicContact CD-CB 4.38Å; V118-C381 HydrophobicContact CG2-CB 4.09Å; C381-K383 VanDerWaalsContact C-N 3.34Å; C381-K383 PolarHBondContact O-N 2.84Å; C381-E384 WeakPolarHBondContact CA-OE2 3.41Å; C381-E384 HydrophobicContact CB-CB 4.34Å; C381-E384 PolarHBondContact O-N 2.86Å; C381-F385 HydrophobicContact CB-CD2 3.64Å; C381-F385 HydrophobicContact CB-CE2 3.68Å; C381-F385 WeakPolarHBondContact O-CD2 3.41Å; C381-F385 PolarHBondContact O-N 3.01Å
382	A	95.5	Very high	94.9	Very high	39 Å²	39	78.6 Å²	78.6	32%	0.322	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-41.5	-174.2	0	0	0	0	0	112.3	E379 K380 A386	E379-A382 HydrophobicContact CG-CB 3.96Å; E379-A382 WeakPolarHBondContact OE2-CB 2.96Å; K380-A382 VanDerWaalsContact C-N 3.25Å; K380-A382 PolarHBondContact O-N 2.99Å; A382-A386 WeakPolarHBondContact O-CA 3.45Å; A382-A386 PolarHBondContact O-N 2.91Å; A382-A386 VanDerWaalsContact O-N 3.13Å
383	K	96.1	Very high	95.3	Very high	195 Å²	195	77.5 Å²	77.5	85%	0.848	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-43.3	-179.4	-67.3	-173.1	177.6	-174.2	0	111.5	C381 F385 A386	C381-K383 VanDerWaalsContact C-N 3.34Å; C381-K383 PolarHBondContact O-N 2.84Å; K383-F385 VanDerWaalsContact C-N 3.27Å; K383-F385 PolarHBondContact O-N 3.28Å; K383-A386 PolarHBondContact O-N 3.19Å
384	E	97	Very high	95.5	Very high	81 Å²	81	79.5 Å²	79.5	38%	0.379	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.3	-176.9	-62.6	92.1	145.6	0	0	112.6	V118 V123 C381	V118-E384 HydrophobicContact CG2-CB 4.27Å; V118-E384 HydrophobicContact CG2-CG 4.17Å; V123-E384 HydrophobicContact CG1-CB 4.16Å; V123-E384 VanDerWaalsContact CG1-O 3.32Å; V123-E384 WeakPolarHBondContact CG1-O 3.36Å; V123-E384 HydrophobicContact CG2-CB 4.4Å; C381-E384 WeakPolarHBondContact CA-OE2 3.41Å; C381-E384 HydrophobicContact CB-CB 4.34Å; C381-E384 PolarHBondContact O-N 2.86Å
385	F	96.5	Very high	95.8	Very high	1 Å²	1	70.4 Å²	70.4	0%	0.004	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	27.2	-178.4	-57.9	-68	0	0	0	113	K114 V117 V118 V123 L127 K149 L154 C381 K383 E387 F388	K114-F385 HydrophobicContact CB-CD2 4.08Å; K114-F385 HydrophobicContact CB-CE2 3.74Å; K114-F385 HydrophobicContact CD-CD2 3.98Å; K114-F385 HydrophobicContact CD-CE2 4.49Å; K114-F385 HydrophobicContact CG-CD2 3.82Å; K114-F385 HydrophobicContact CG-CE2 3.91Å; V117-F385 HydrophobicContact CB-CZ 3.88Å; V117-F385 HydrophobicContact CG1-CE1 3.91Å; V117-F385 HydrophobicContact CG1-CZ 3.55Å; V118-F385 HydrophobicContact CG2-CE2 3.81Å; V118-F385 HydrophobicContact CG2-CZ 4.05Å; V123-F385 HydrophobicContact CB-CE1 4.34Å; V123-F385 HydrophobicContact CG1-CD1 4.35Å; V123-F385 HydrophobicContact CG1-CE1 3.93Å; V123-F385 HydrophobicContact CG1-CZ 4.42Å; V123-F385 HydrophobicContact CG2-CE1 4.25Å; V123-F385 HydrophobicContact CG2-CZ 3.98Å; L127-F385 HydrophobicContact CD2-CD1 4.34Å; K149-F385 PolarHBondContact NZ-O 3.11Å; L154-F385 HydrophobicContact CD1-CD1 3.55Å; L154-F385 HydrophobicContact CD1-CD2 4.39Å; L154-F385 HydrophobicContact CD1-CE1 3.56Å; L154-F385 HydrophobicContact CD1-CE2 4.4Å; L154-F385 HydrophobicContact CD1-CG 3.99Å; L154-F385 HydrophobicContact CD1-CZ 4Å; L154-F385 HydrophobicContact CD2-CB 3.98Å; L154-F385 HydrophobicContact CD2-CD1 4.28Å; L154-F385 HydrophobicContact CD2-CD2 4.39Å; L154-F385 HydrophobicContact CD2-CG 3.96Å; C381-F385 HydrophobicContact CB-CD2 3.64Å; C381-F385 HydrophobicContact CB-CE2 3.68Å; C381-F385 WeakPolarHBondContact O-CD2 3.41Å; C381-F385 PolarHBondContact O-N 3.01Å; K383-F385 VanDerWaalsContact C-N 3.27Å; K383-F385 PolarHBondContact O-N 3.28Å; F385-E387 VanDerWaalsContact C-N 3.27Å; F385-E387 PolarHBondContact O-N 3.36Å; F385-F388 HydrophobicContact CB-CB 4.15Å; F385-F388 WeakPolarHBondContact O-CB 3.43Å; F385-F388 PolarHBondContact O-N 3.27Å
386	A	95.4	Very high	95.9	Very high	61 Å²	61	69.3 Å²	69.3	50%	0.504	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-42.4	179.8	0	0	0	0	0	111.6	K149 A382 K383 F388	K149-A386 PolarHBondContact NZ-O 3.03Å; A382-A386 WeakPolarHBondContact O-CA 3.45Å; A382-A386 PolarHBondContact O-N 2.91Å; A382-A386 VanDerWaalsContact O-N 3.13Å; K383-A386 PolarHBondContact O-N 3.19Å; A386-F388 PolarHBondContact O-N 3.44Å
387	E	93	Very high	95.9	Very high	135 Å²	135	72.4 Å²	72.4	63%	0.631	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-7	-177.8	-60.7	-174.5	172.1	0	0	115.1	Q73 F385	Q73-E387 PolarHBondContact NE2-O 3.42Å; F385-E387 VanDerWaalsContact C-N 3.27Å; F385-E387 PolarHBondContact O-N 3.36Å
388	F	95.2	Very high	95.9	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.376	C	S	.	.			trans	-62.1	0	180	-171.6	-78.9	0	0	0	111.5	T126 L127 K130 F148 K149 L154 M156 F385 A386	T126-F388 HydrophobicContact CG2-CD2 4.43Å; T126-F388 HydrophobicContact CG2-CE2 4.08Å; L127-F388 HydrophobicContact CD2-CB 3.89Å; L127-F388 HydrophobicContact CD2-CD2 4.24Å; K130-F388 HydrophobicContact CB-CD2 4.26Å; K130-F388 HydrophobicContact CB-CE2 3.8Å; K130-F388 HydrophobicContact CB-CZ 4.27Å; K130-F388 WeakPolarHBondContact CD-OXT 3.11Å; K130-F388 WeakPolarHBondContact CE-OXT 3.45Å; K130-F388 HydrophobicContact CG-CD2 4.29Å; K130-F388 HydrophobicContact CG-CE1 4.36Å; K130-F388 HydrophobicContact CG-CE2 3.88Å; K130-F388 HydrophobicContact CG-CZ 3.92Å; K130-F388 PolarHBondContact NZ-OXT 3.03Å; F148-F388 WeakPolarHBondContact O-CE1 3.4Å; K149-F388 HydrophobicContact CB-CD1 4.39Å; K149-F388 HydrophobicContact CD-CB 4.21Å; K149-F388 HydrophobicContact CD-CD1 4.45Å; K149-F388 PolarHBondContact NZ-O 3.39Å; L154-F388 HydrophobicContact CB-CD1 4.44Å; L154-F388 HydrophobicContact CB-CD2 4.3Å; L154-F388 HydrophobicContact CB-CE1 3.98Å; L154-F388 HydrophobicContact CB-CE2 3.83Å; L154-F388 HydrophobicContact CB-CZ 3.66Å; L154-F388 HydrophobicContact CD1-CD2 3.84Å; L154-F388 HydrophobicContact CD1-CE2 3.9Å; L154-F388 HydrophobicContact CD1-CG 4.45Å; L154-F388 HydrophobicContact CD2-CB 4.24Å; L154-F388 HydrophobicContact CD2-CD1 3.98Å; L154-F388 HydrophobicContact CD2-CD2 4.04Å; L154-F388 HydrophobicContact CD2-CE1 4.37Å; L154-F388 HydrophobicContact CD2-CE2 4.42Å; L154-F388 HydrophobicContact CD2-CG 3.81Å; L154-F388 HydrophobicContact CG-CD2 4.27Å; L154-F388 HydrophobicContact CG-CE2 4.26Å; L154-F388 HydrophobicContact CG-CZ 4.48Å; M156-F388 HydrophobicContact CG-CZ 3.83Å; F385-F388 HydrophobicContact CB-CB 4.15Å; F385-F388 WeakPolarHBondContact O-CB 3.43Å; F385-F388 PolarHBondContact O-N 3.27Å; A386-F388 PolarHBondContact O-N 3.44Å

Retrieved 388 of 388 residues in 2169.3 ms (Link to these results)

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