A0A087XDQ4_POEFO Loading...

Protein smoothened

AlphaFold DB , UniProt , Accession A0A087XDQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 811 aa.

						>A0A087XDQ4_POEFO|A0A087XDQ4
MSSQGRSPIVGMLCVWAAWLSGCRAVLAPNGTMFEDKCKKTSTCEVLKYNTCLGSPLPYTHTSLILAEDSSSQEEAFEKLTMWSGLRNAPRCWSVIQPLLCAVYMPKCENGRVELPSKSLCVATRRPCSIVDRERGWPNFLKCDKFPVGCSNEVQKLKFNTSGQCEAPLVKTDIQSSWYKDVEGCGIQCDNPLFTEEEHNDMHAYIAYFGTITLLCTFFTLATFLADWKNSNRYPAVILFYINACFFVGSIGWLAQFLDGARKEIVCKSDNTMRLGEPSSSETLSCVTIFIIVYYSLMSGVIWFVMLTYAWHTSFKALGTTHQPLSGRTSYFHMVTWSIPFVLTVAILAIAEVDGDSVSGICFVGYKNYHYRAGFVLAPIGVVLVVGGYFLIRGVMTLFSIKSNHPGLLSEKAASKINETMLRLGIFGFLAFGFVFITFGCHFYDFFNQAEWERSFREYVLCEANVTIASQTNKPIPECTIKNRPSLMVEKINLFSMFGTGIAMSTWVWTKATFLIWKRTWFKIIGRSDNEPKRIKKSKMIAKAFAMRKELHKDPEKELSFSMHTVSHDGPVAGINFDLNEPSNDVSSAWALHVPKMVARRGAILPQDISVTPTGTPVPPPEERNRLWMVEADISPEMIKRKKKKKKRRKEVRKPDEVVENQTRLQREFGRSSVPRLPKLPCHPSLVANLREQQRQQSLEQGVLPGSLPDYEPCEERCSYLECQSGRNGYLMTRVDCPENLGLRPSCRPLTSNWQPSGSSMYPGEVEHADGLSERMAHVARVPAGRRAGYGPIHSRTNLMEAELMDADSDF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	34.5	Very low	237 Å²	237	140.3 Å²	140.3	100%	1.167	82%	0.824	S	S	*	*				0	117	0	-65.6	115.3	82.9	0	0	107.1
2	S	30.9	Very low	34.2	Very low	122 Å²	122	144.8 Å²	144.8	85%	0.853	84%	0.835	S	S	*	*				81.9	132.6	95.8	-160.9	0	0	0	0	111.6
3	S	33.4	Very low	34.1	Very low	98 Å²	98	146 Å²	146	69%	0.685	84%	0.836	S	S	*	*			cis	-144.7	138.8	8.8	168.9	0	0	0	0	107.6
4	Q	41.3	Very low	33.9	Very low	185 Å²	185	144.6 Å²	144.6	86%	0.864	84%	0.837	S	S	*	*				85.9	129.3	50	-156.2	-167.8	77	0	0	114.6
5	G	28.6	Very low	33.9	Very low	69 Å²	69	143 Å²	143	71%	0.711	83%	0.83	S	S	*	*			trans	131.5	131.2	170.8	0	0	0	0	0	113.8
6	R	31.6	Very low	33.7	Very low	245 Å²	245	150 Å²	150	93%	0.925	84%	0.838	S	S	*	*			cis	-175.3	151.9	-19.2	-120.1	176.9	-176.5	-171.7	1.1	105.7
7	S	33.6	Very low	33.6	Very low	114 Å²	114	147.1 Å²	147.1	80%	0.797	84%	0.838	S	S	*	*			trans	-109.4	-166.6	178.7	-144.3	0	0	0	0	109.3
8	P	51.4	Low	33.6	Very low	108 Å²	108	143.7 Å²	143.7	70%	0.701	83%	0.831	S	S	*	*			cis	-137.4	-164.2	-8	43	-24.3	0	0	0	114
9	I	32.5	Very low	33.4	Very low	155 Å²	155	148.3 Å²	148.3	80%	0.795	83%	0.833	S	S	*	*			trans	-166.7	133	136.8	-104.5	158.2	0	0	0	113.1
10	V	32.3	Very low	33.4	Very low	141 Å²	141	148.1 Å²	148.1	86%	0.855	83%	0.829	S	S	*	*			trans	29.9	133.1	155.1	-170.9	0	0	0	0	121.4
11	G	30.7	Very low	33.3	Very low	69 Å²	69	146.5 Å²	146.5	71%	0.711	83%	0.828	S	S	*	*			cis	162.1	175.3	-8.3	0	0	0	0	0	117.8
12	M	31.4	Very low	33.1	Very low	194 Å²	194	138.9 Å²	138.9	96%	0.956	81%	0.81	S	S	*	*			trans	72.1	150.5	167.1	-76.7	-164.2	168.7	0	0	122.5
13	L	32.4	Very low	33.4	Very low	161 Å²	161	139.8 Å²	139.8	84%	0.843	82%	0.815	S	S	*	*			trans	-129.5	154.4	-179	-53.8	97.2	0	0	0	111.5
14	C	31	Very low	33.3	Very low	127 Å²	127	146.2 Å²	146.2	86%	0.858	82%	0.824	S	S	*	*			trans	-154.3	123.4	143.2	-90	0	0	0	0	107.1
15	V	34	Very low	32.9	Very low	120 Å²	120	141.9 Å²	141.9	73%	0.727	82%	0.82	S	S	*	*			cis	88.4	91.8	49	178.5	0	0	0	0	113.2
16	W	31.4	Very low	33.3	Very low	255 Å²	255	145.1 Å²	145.1	97%	0.966	83%	0.826	S	S	*	*			trans	39.9	152.2	137.2	-80	44.7	0	0	0	123.4
17	A	31.9	Very low	33.5	Very low	101 Å²	101	141 Å²	141	84%	0.835	82%	0.821	S	S	*	*			trans	102.5	141.1	167.8	0	0	0	0	0	116.6
18	A	33.3	Very low	33.6	Very low	85 Å²	85	139.9 Å²	139.9	70%	0.702	82%	0.818	S	S	*	*			cis	-162.6	153.1	-18.6	0	0	0	0	0	113.4
19	W	30.3	Very low	33	Very low	232 Å²	232	140.6 Å²	140.6	88%	0.879	82%	0.823	S	S	*	*			trans	54.9	114.7	139.9	-77.6	44.9	0	0	0	123.5
20	L	32.4	Very low	33.2	Very low	143 Å²	143	139 Å²	139	75%	0.749	82%	0.816	S	S	*	*			trans	76.6	154.1	131.7	-89.2	173.7	0	0	0	124.1
21	S	31.2	Very low	33.7	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	80%	0.802	S	S	*	*			trans	70	110.6	162	-64.3	0	0	0	0	119.1
22	G	29.7	Very low	34.4	Very low	77 Å²	77	135.9 Å²	135.9	79%	0.794	80%	0.795	S	S	*	*			trans	176.3	55.8	174.8	0	0	0	0	0	116	R24	G22-R24 PolarHBondContact O-N 3.03Å
23	C	37.4	Very low	35	Very low	140 Å²	140	132.9 Å²	132.9	95%	0.946	78%	0.78	S	S	*	*			trans	-65.3	105.4	173.6	-74.2	0	0	0	0	111.7
24	R	31.1	Very low	35.7	Very low	233 Å²	233	132 Å²	132	88%	0.879	77%	0.769	S	S	*	*			trans	-127.7	109.2	153.8	-96.8	-173.3	170.2	-176.3	-2.8	109.6	G22 V26	G22-R24 PolarHBondContact O-N 3.03Å; R24-V26 PolarHBondContact O-N 3.06Å
25	A	32.3	Very low	36.8	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	75%	0.751	S	S	*	*			trans	-61.2	116.6	165	0	0	0	0	0	108.3	L27	A25-L27 PolarHBondContact O-N 3.18Å
26	V	37.3	Very low	38.1	Very low	138 Å²	138	129.4 Å²	129.4	84%	0.836	74%	0.74	S	S	*	*			trans	-71.5	100.8	167.1	177.9	0	0	0	0	106.4	R24 A28	R24-V26 PolarHBondContact O-N 3.06Å; V26-A28 PolarHBondContact O-N 3.13Å; V26-A28 VanDerWaalsContact O-N 3.13Å
27	L	36.5	Very low	40.2	Very low	159 Å²	159	124.1 Å²	124.1	83%	0.832	72%	0.724	S	S	*	*			trans	-56.7	116.9	171.4	-77.3	164.7	0	0	0	108.4	A25	A25-L27 PolarHBondContact O-N 3.18Å
28	A	35.2	Very low	42.7	Very low	89 Å²	89	120.3 Å²	120.3	74%	0.736	69%	0.691	S	S	*	*			trans	-62.8	126	175.6	0	0	0	0	0	109.1	V26 N30	V26-A28 PolarHBondContact O-N 3.13Å; V26-A28 VanDerWaalsContact O-N 3.13Å; A28-N30 PolarHBondContact O-N 3.09Å; A28-N30 VanDerWaalsContact O-N 3.09Å
29	P	38.8	Very low	45.3	Very low	124 Å²	124	119.6 Å²	119.6	81%	0.805	67%	0.672	S	S	*	*			trans	-72.3	107	-177.6	27.7	-33.5	0	0	0	111.1
30	N	36.1	Very low	48	Very low	121 Å²	121	112.5 Å²	112.5	65%	0.647	65%	0.647	S	S	*	*			trans	33.7	83.9	159.6	-63.6	-6.6	0	0	0	117	A28 T32 M33	A28-N30 PolarHBondContact O-N 3.09Å; A28-N30 VanDerWaalsContact O-N 3.09Å; N30-T32 PolarHBondContact O-N 3.34Å; N30-T32 VanDerWaalsContact O-N 3.08Å; N30-M33 PolarHBondContact O-N 3.08Å
31	G	42.3	Very low	50.7	Low	54 Å²	54	110.8 Å²	110.8	56%	0.557	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-22.3	171.8	0	0	0	0	0	114.7	M33 F34 E35	G31-M33 VanDerWaalsContact C-N 3.26Å; G31-M33 PolarHBondContact O-N 3.32Å; G31-F34 PolarHBondContact O-N 3.38Å; G31-F34 VanDerWaalsContact O-N 3.14Å; G31-E35 PolarHBondContact O-N 3.22Å
32	T	46.6	Very low	53.4	Low	90 Å²	90	106.2 Å²	106.2	55%	0.552	61%	0.611	S	S	*	*	H	α-helix	trans	-55.9	-34.3	178.7	51	0	0	0	0	113.9	N30 F34	N30-T32 PolarHBondContact O-N 3.34Å; N30-T32 VanDerWaalsContact O-N 3.08Å; T32-F34 VanDerWaalsContact C-N 3.3Å; T32-F34 PolarHBondContact O-N 3.14Å
33	M	42.8	Very low	56.2	Low	131 Å²	131	107.9 Å²	107.9	65%	0.645	61%	0.605	S	S	*	*	H	α-helix	trans	-74.5	-15.1	-178.7	-76.3	-107.6	67.4	0	0	114.4	N30 G31	N30-M33 PolarHBondContact O-N 3.08Å; G31-M33 VanDerWaalsContact C-N 3.26Å; G31-M33 PolarHBondContact O-N 3.32Å
34	F	47.7	Very low	58.9	Low	142 Å²	142	103.2 Å²	103.2	62%	0.623	57%	0.574	S	S	*	*	H	α-helix	trans	-95.8	-37.1	173.7	-101.7	-90.7	0	0	0	112.3	G31 T32 D36 K37	G31-F34 PolarHBondContact O-N 3.38Å; G31-F34 VanDerWaalsContact O-N 3.14Å; T32-F34 VanDerWaalsContact C-N 3.3Å; T32-F34 PolarHBondContact O-N 3.14Å; F34-D36 PolarHBondContact O-N 2.95Å; F34-K37 PolarHBondContact O-N 3.18Å
35	E	53.8	Low	61.8	Low	103 Å²	103	95.9 Å²	95.9	48%	0.481	55%	0.55	S	S	.	.	H	α-helix	trans	-62.4	-37.6	-180	-79.6	-161.6	74.7	0	0	114.1	G31 K37 C38 K39	G31-E35 PolarHBondContact O-N 3.22Å; E35-K37 PolarHBondContact O-N 3.18Å; E35-C38 WeakPolarHBondContact O-CB 3.47Å; E35-C38 PolarHBondContact O-N 3.41Å; E35-K39 IonicContact OE1-NZ 2.65Å; E35-K39 PolarHBondContact OE1-NZ 2.68Å
36	D	61.9	Low	64.7	Low	90 Å²	90	96 Å²	96	48%	0.481	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.1	178.3	-88.4	-19.2	0	0	0	113.1	F34 R112	F34-D36 PolarHBondContact O-N 2.95Å; D36-R112 IonicContact OD1-CZ 2.65Å; D36-R112 IonicContact OD1-NH1 2.68Å; D36-R112 PolarHBondContact OD1-NH1 3.24Å; D36-R112 IonicContact OD1-NH2 3.24Å
37	K	76.4	Confident	67.4	Low	144 Å²	144	90.7 Å²	90.7	63%	0.626	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-13	172.5	-65.9	-176.8	-179.4	176.8	0	113.6	F34 E35	F34-K37 PolarHBondContact O-N 3.18Å; E35-K37 PolarHBondContact O-N 3.18Å
38	C	84.3	Confident	70	Confident	21 Å²	21	88.9 Å²	88.9	14%	0.142	49%	0.493	C	S	.	.	S	Bend	trans	-97.9	0.5	179.7	-62.3	0	0	0	0	113.1	E35 L115 C150	E35-C38 WeakPolarHBondContact O-CB 3.47Å; E35-C38 PolarHBondContact O-N 3.41Å; C38-L115 WeakPolarHBondContact O-CB 3.28Å; C38-L115 PolarHBondContact O-N 2.78Å; C38-C150 WeakPolarHBondContact CA-SG 3.46Å; C38-C150 HydrophobicContact CB-CB 3.75Å; C38-C150 WeakPolarHBondContact CB-SG 3.04Å; C38-C150 WeakPolarHBondContact SG-CA 3.39Å; C38-C150 WeakPolarHBondContact SG-CB 3Å; C38-C150 CovalentContact SG-SG 2.03Å; C38-C150 PolarHBondContact SG-SG 2.66Å
39	K	86.6	Confident	72.6	Confident	71 Å²	71	88.5 Å²	88.5	31%	0.309	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.7	-173.5	-70.7	166.5	-178.5	168.2	0	109.9	E35 R112 V113	E35-K39 IonicContact OE1-NZ 2.65Å; E35-K39 PolarHBondContact OE1-NZ 2.68Å; K39-R112 HydrophobicContact CB-CB 4.4Å; K39-V113 CarbonylContact C-O 3.29Å; K39-V113 VanDerWaalsContact CA-O 3.28Å; K39-V113 WeakPolarHBondContact CA-O 3.45Å
40	K	87.6	Confident	75	Confident	82 Å²	82	88.3 Å²	88.3	36%	0.357	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135.6	178.7	-178.7	-179	177.4	-173.3	0	109.4	S42 I65 L66 R112 V113 L115	K40-S42 PolarHBondContact O-N 3.46Å; K40-I65 HydrophobicContact CD-CG2 4.23Å; K40-I65 PolarHBondContact NZ-O 3.17Å; K40-L66 HydrophobicContact CD-CD2 4.13Å; K40-R112 CarbonylContact O-C 3.56Å; K40-R112 WeakPolarHBondContact O-CA 3.4Å; K40-V113 HydrophobicContact CB-CG1 3.88Å; K40-V113 PolarHBondContact N-O 2.03Å; K40-V113 WeakPolarHBondContact O-CG1 3.43Å; K40-V113 PolarHBondContact O-N 2.95Å; K40-L115 HydrophobicContact CB-CD1 4.34Å; K40-L115 HydrophobicContact CB-CD2 4.06Å; K40-L115 HydrophobicContact CB-CG 4.22Å; K40-L115 HydrophobicContact CD-CD2 4.39Å
41	T	88.6	Confident	77.6	Confident	108 Å²	108	85.1 Å²	85.1	66%	0.663	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	129.9	176.1	48.2	0	0	0	0	110.7	G111	T41-G111 WeakPolarHBondContact CA-O 3.29Å
42	S	88.9	Confident	79.9	Confident	20 Å²	20	82.6 Å²	82.6	14%	0.14	42%	0.424	C	S	.	.			trans	-160.1	160.5	-177.6	-158.4	0	0	0	0	112.5	K40 S63 I65 G111	K40-S42 PolarHBondContact O-N 3.46Å; S42-S63 WeakPolarHBondContact CB-OG 3.48Å; S42-S63 PolarHBondContact OG-OG 3.47Å; S42-I65 WeakPolarHBondContact OG-CB 3.4Å; S42-I65 WeakPolarHBondContact OG-CD1 3.48Å; S42-I65 WeakPolarHBondContact OG-CG2 3.16Å; S42-G111 PolarHBondContact N-O 2.67Å; S42-G111 CarbonylContact O-C 3.34Å; S42-G111 VanDerWaalsContact O-C 3.23Å; S42-G111 VanDerWaalsContact O-CA 3.28Å; S42-G111 WeakPolarHBondContact O-CA 3.47Å
43	T	89	Confident	81.9	Confident	111 Å²	111	79.7 Å²	79.7	68%	0.681	41%	0.405	S	S	*	.			trans	-71	128.7	164.6	44.2	0	0	0	0	109.9	S63	T43-S63 WeakPolarHBondContact O-CB 3.45Å; T43-S63 PolarHBondContact O-OG 2.86Å
44	C	92.2	Very high	83.9	Confident	43 Å²	43	76.3 Å²	76.3	29%	0.291	40%	0.404	S	S	.	.			trans	-93.4	132	173.3	-57.8	0	0	0	0	110.1	H61 T62 C108	C44-H61 HydrophobicContact CB-CB 4.37Å; C44-T62 WeakPolarHBondContact CA-O 3.36Å; C44-C108 WeakPolarHBondContact CA-SG 3.48Å; C44-C108 HydrophobicContact CB-CB 3.7Å; C44-C108 WeakPolarHBondContact CB-SG 3.09Å; C44-C108 WeakPolarHBondContact SG-CB 3.26Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 3.16Å
45	E	93.2	Very high	86	Confident	79 Å²	79	69.7 Å²	69.7	37%	0.369	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	153.6	174.1	-65.4	177.8	-165.2	0	0	110.4	H61 T62 Q73	E45-H61 CarbonylContact O-C 3.54Å; E45-H61 WeakPolarHBondContact O-CA 3.48Å; E45-T62 PolarHBondContact N-O 3.04Å; E45-T62 PolarHBondContact O-N 3.27Å; E45-Q73 PolarHBondContact OE2-NE2 2.63Å
46	V	92.9	Very high	87.7	Confident	97 Å²	97	69.3 Å²	69.3	59%	0.588	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.9	169.7	-176.8	0	0	0	0	109.3	K48 Q73	V46-K48 PolarHBondContact O-N 2.69Å; V46-Q73 PolarHBondContact O-NE2 3.45Å; V46-Q73 PolarHBondContact O-OE1 2.96Å
47	L	93.4	Very high	89.1	Confident	25 Å²	25	66 Å²	66	13%	0.131	36%	0.364	C	S	.	.			trans	-66.4	119.7	176.2	-85	164.8	0	0	0	111.7	L57 Y59 T60 T62 M105	L47-L57 HydrophobicContact CD1-CD1 3.88Å; L47-L57 HydrophobicContact CD2-CD1 4.23Å; L47-Y59 HydrophobicContact CD1-CD2 3.88Å; L47-Y59 HydrophobicContact CD1-CE2 4.14Å; L47-Y59 VanDerWaalsContact CD1-O 3.27Å; L47-Y59 WeakPolarHBondContact CD1-O 3.41Å; L47-T60 PolarHBondContact N-O 3.25Å; L47-T62 HydrophobicContact CD2-CG2 3.63Å; L47-T62 HydrophobicContact CG-CG2 3.96Å; L47-M105 HydrophobicContact CD2-CE 3.62Å
48	K	92	Very high	89.8	Confident	122 Å²	122	63.7 Å²	63.7	53%	0.53	36%	0.364	S	S	.	.	S	Bend	trans	-71.9	-31.1	168.9	-62.8	-179.9	-172.3	177.2	0	112.2	V46 Q73 E74	V46-K48 PolarHBondContact O-N 2.69Å; K48-Q73 HydrophobicContact CD-CB 4.17Å; K48-E74 VanDerWaalsContact CD-OE1 3.27Å; K48-E74 WeakPolarHBondContact CD-OE1 3.37Å; K48-E74 WeakPolarHBondContact CE-OE1 3.06Å; K48-E74 IonicContact NZ-OE1 3.69Å; K48-E74 PolarHBondContact NZ-OE1 3.07Å; K48-E74 IonicContact NZ-OE2 3.37Å; K48-E74 PolarHBondContact NZ-OE2 3.39Å
49	Y	89.7	Confident	90.1	Very high	80 Å²	80	63.9 Å²	63.9	31%	0.314	36%	0.361	S	S	.	.			trans	-117.9	121.6	179.6	-55.2	-77.6	0	0	0	110	T51 F77 M105	Y49-T51 VanDerWaalsContact C-N 3.3Å; Y49-T51 PolarHBondContact O-N 2.63Å; Y49-F77 HydrophobicContact CD1-CD2 4.18Å; Y49-F77 HydrophobicContact CD1-CE2 4.15Å; Y49-F77 HydrophobicContact CD2-CB 4.21Å; Y49-F77 AromaticContact CD2-CD2 3.87Å; Y49-F77 HydrophobicContact CD2-CD2 3.87Å; Y49-F77 HydrophobicContact CD2-CG 4.19Å; Y49-F77 HydrophobicContact CE1-CD2 4.47Å; Y49-F77 HydrophobicContact CE2-CB 3.91Å; Y49-F77 HydrophobicContact CE2-CD2 4.19Å; Y49-F77 HydrophobicContact CE2-CG 4.05Å; Y49-F77 AromaticContact CG-CD2 3.87Å; Y49-F77 HydrophobicContact CG-CD2 3.87Å; Y49-F77 HydrophobicContact CG-CE2 4.16Å; Y49-M105 WeakPolarHBondContact O-CE 3.29Å
50	N	89.3	Confident	90.3	Very high	121 Å²	121	65.1 Å²	65.1	65%	0.647	38%	0.375	S	S	*	.	S	Bend	trans	-84.8	1	-177.8	66.1	-6.9	0	0	0	114.3	L57	N50-L57 PolarHBondContact O-N 2.92Å
51	T	90.3	Very high	90.6	Very high	53 Å²	53	64.8 Å²	64.8	33%	0.325	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.6	-178.8	46.6	0	0	0	0	110.6	Y49 S55 P56	Y49-T51 VanDerWaalsContact C-N 3.3Å; Y49-T51 PolarHBondContact O-N 2.63Å; T51-S55 CarbonylContact C-O 3.55Å; T51-S55 VanDerWaalsContact CA-O 3.23Å; T51-S55 WeakPolarHBondContact CA-O 3.5Å; T51-P56 HydrophobicContact CG2-CB 4.41Å
52	C	90.5	Very high	90.8	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.007	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.5	169.9	-176.5	0	0	0	0	109.2	G54 S55 L57 C101 M105	C52-G54 PolarHBondContact O-N 2.84Å; C52-G54 VanDerWaalsContact O-N 3.15Å; C52-S55 PolarHBondContact N-O 2.89Å; C52-S55 PolarHBondContact O-N 2.83Å; C52-L57 HydrophobicContact CB-CD1 4.31Å; C52-L57 HydrophobicContact CB-CD2 3.87Å; C52-L57 HydrophobicContact CB-CG 4.3Å; C52-C101 HydrophobicContact CB-CB 3.93Å; C52-C101 WeakPolarHBondContact CB-SG 3.43Å; C52-C101 WeakPolarHBondContact SG-CA 3.2Å; C52-C101 WeakPolarHBondContact SG-CB 3.34Å; C52-C101 CovalentContact SG-SG 2.04Å; C52-C101 PolarHBondContact SG-SG 3.35Å; C52-M105 HydrophobicContact CB-SD 3.67Å
53	L	88.6	Confident	91	Very high	30 Å²	30	58.9 Å²	58.9	16%	0.157	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	44.6	178.8	-56.1	179.9	0	0	0	113.5	S55 L80 W93 Q97 L100 F159	L53-S55 PolarHBondContact O-N 3.48Å; L53-L80 HydrophobicContact CD1-CD2 4.3Å; L53-L80 HydrophobicContact CD2-CB 4.22Å; L53-L80 HydrophobicContact CD2-CD2 4.22Å; L53-L80 HydrophobicContact CG-CD2 4.28Å; L53-W93 HydrophobicContact CD1-CH2 3.9Å; L53-W93 HydrophobicContact CD1-CZ2 4.48Å; L53-W93 HydrophobicContact CD2-CH2 4.04Å; L53-W93 HydrophobicContact CG-CH2 4.41Å; L53-Q97 HydrophobicContact CD1-CB 4.18Å; L53-Q97 HydrophobicContact CD1-CG 3.99Å; L53-L100 HydrophobicContact CD1-CB 4.05Å; L53-L100 HydrophobicContact CD1-CD1 3.99Å; L53-F159 HydrophobicContact CB-CE1 4.48Å
54	G	85.9	Confident	91.1	Very high	60 Å²	60	54.7 Å²	54.7	62%	0.619	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-2.4	179.7	0	0	0	0	0	116	C52	C52-G54 PolarHBondContact O-N 2.84Å; C52-G54 VanDerWaalsContact O-N 3.15Å
55	S	90.1	Very high	91.1	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.021	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.7	-178.1	-54.8	0	0	0	0	111.6	T51 C52 L53 F159	T51-S55 CarbonylContact C-O 3.55Å; T51-S55 VanDerWaalsContact CA-O 3.23Å; T51-S55 WeakPolarHBondContact CA-O 3.5Å; C52-S55 PolarHBondContact N-O 2.89Å; C52-S55 PolarHBondContact O-N 2.83Å; L53-S55 PolarHBondContact O-N 3.48Å; S55-F159 WeakPolarHBondContact OG-CA 3.44Å; S55-F159 WeakPolarHBondContact OG-CD1 3.42Å
56	P	91.1	Very high	91	Very high	95 Å²	95	52.9 Å²	52.9	62%	0.617	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	139.4	178.4	29.8	-34.6	0	0	0	111.6	T51 L157	T51-P56 HydrophobicContact CG2-CB 4.41Å; P56-L157 VanDerWaalsContact O-CD2 3.29Å; P56-L157 WeakPolarHBondContact O-CD2 3.26Å
57	L	91.1	Very high	90.9	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.105	27%	0.273	C	S	.	.			trans	-88.8	133.8	179.3	-61.6	-179.7	0	0	0	111.1	L47 N50 C52 Y59 M105 L157	L47-L57 HydrophobicContact CD1-CD1 3.88Å; L47-L57 HydrophobicContact CD2-CD1 4.23Å; N50-L57 PolarHBondContact O-N 2.92Å; C52-L57 HydrophobicContact CB-CD1 4.31Å; C52-L57 HydrophobicContact CB-CD2 3.87Å; C52-L57 HydrophobicContact CB-CG 4.3Å; L57-Y59 HydrophobicContact CB-CE1 4.48Å; L57-Y59 HydrophobicContact CB-CE2 4.35Å; L57-Y59 HydrophobicContact CD1-CE2 4.03Å; L57-Y59 HydrophobicContact CD2-CE1 4.45Å; L57-Y59 PolarHBondContact O-N 2.87Å; L57-M105 HydrophobicContact CD1-CB 4.23Å; L57-M105 HydrophobicContact CD1-CE 3.77Å; L57-M105 HydrophobicContact CD1-SD 4.48Å; L57-L157 HydrophobicContact CD2-CD1 3.98Å
58	P	90.5	Very high	90.7	Very high	96 Å²	96	53.1 Å²	53.1	62%	0.623	30%	0.295	S	S	*	.	S	Bend	trans	-82.7	12.1	-180	33.4	-35.7	0	0	0	113.8
59	Y	89.8	Confident	90.6	Very high	24 Å²	24	49.7 Å²	49.7	9%	0.094	28%	0.282	C	S	.	.			trans	-134.7	157.9	-179	46.3	-92.6	0	0	0	110.7	L47 L57 H61 M105 K107	L47-Y59 HydrophobicContact CD1-CD2 3.88Å; L47-Y59 HydrophobicContact CD1-CE2 4.14Å; L47-Y59 VanDerWaalsContact CD1-O 3.27Å; L47-Y59 WeakPolarHBondContact CD1-O 3.41Å; L57-Y59 HydrophobicContact CB-CE1 4.48Å; L57-Y59 HydrophobicContact CB-CE2 4.35Å; L57-Y59 HydrophobicContact CD1-CE2 4.03Å; L57-Y59 HydrophobicContact CD2-CE1 4.45Å; L57-Y59 PolarHBondContact O-N 2.87Å; Y59-H61 WeakPolarHBondContact CD2-O 3.45Å; Y59-M105 WeakPolarHBondContact CE2-O 3.49Å; Y59-M105 PolarHBondContact OH-O 3.46Å; Y59-K107 HydrophobicContact CD1-CB 3.82Å; Y59-K107 HydrophobicContact CD1-CD 3.91Å; Y59-K107 HydrophobicContact CD1-CG 4.04Å; Y59-K107 HydrophobicContact CD2-CB 4.04Å; Y59-K107 HydrophobicContact CD2-CG 4.36Å; Y59-K107 HydrophobicContact CE1-CB 3.88Å; Y59-K107 HydrophobicContact CE2-CB 4.08Å; Y59-K107 HydrophobicContact CG-CB 3.91Å; Y59-K107 HydrophobicContact CG-CD 4.16Å; Y59-K107 HydrophobicContact CG-CG 3.92Å
60	T	92.1	Very high	90.7	Very high	98 Å²	98	46.4 Å²	46.4	60%	0.601	27%	0.271	S	S	*	.	S	Bend	trans	-105.5	-10.2	-173.1	50.2	0	0	0	0	114.3	L47	L47-T60 PolarHBondContact N-O 3.25Å
61	H	93.4	Very high	90.7	Very high	75 Å²	75	45.4 Å²	45.4	35%	0.347	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.4	-173.7	-67.9	78.3	0	0	0	112.3	C44 E45 Y59 C108	C44-H61 HydrophobicContact CB-CB 4.37Å; E45-H61 CarbonylContact O-C 3.54Å; E45-H61 WeakPolarHBondContact O-CA 3.48Å; Y59-H61 WeakPolarHBondContact CD2-O 3.45Å; H61-C108 WeakPolarHBondContact CB-O 3.26Å; H61-C108 PolarHBondContact O-N 2.79Å; H61-C108 VanDerWaalsContact O-N 3.11Å
62	T	93.6	Very high	90.9	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	174.5	-174.9	-171.1	0	0	0	0	112	C44 E45 L47 Q73 P106 C108	C44-T62 WeakPolarHBondContact CA-O 3.36Å; E45-T62 PolarHBondContact N-O 3.04Å; E45-T62 PolarHBondContact O-N 3.27Å; L47-T62 HydrophobicContact CD2-CG2 3.63Å; L47-T62 HydrophobicContact CG-CG2 3.96Å; T62-Q73 HydrophobicContact CG2-CG 4.39Å; T62-P106 WeakPolarHBondContact CA-O 3.23Å; T62-P106 PolarHBondContact OG1-O 2.95Å; T62-C108 WeakPolarHBondContact O-CB 3.37Å
63	S	92.3	Very high	90.9	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.021	27%	0.274	C	S	.	.			trans	-153.4	139.5	168.8	-163.3	0	0	0	0	111.5	S42 T43 P106	S42-S63 WeakPolarHBondContact CB-OG 3.48Å; S42-S63 PolarHBondContact OG-OG 3.47Å; T43-S63 WeakPolarHBondContact O-CB 3.45Å; T43-S63 PolarHBondContact O-OG 2.86Å; S63-P106 WeakPolarHBondContact O-CD 3.05Å; S63-P106 WeakPolarHBondContact O-CG 3.05Å
64	L	92.1	Very high	91.1	Very high	23 Å²	23	48 Å²	48	12%	0.12	29%	0.285	C	S	.	.			trans	-84.4	-5.3	-174.9	-62.5	169.1	0	0	0	114.1	L66 A67 S72 Q73 A76	L64-L66 PolarHBondContact O-N 3.05Å; L64-A67 PolarHBondContact O-N 3.34Å; L64-S72 VanDerWaalsContact CD1-C 3.48Å; L64-Q73 HydrophobicContact CD2-CG 4.45Å; L64-A76 HydrophobicContact CD2-CB 3.84Å
65	I	91.3	Very high	91.3	Very high	68 Å²	68	47.6 Å²	47.6	35%	0.349	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	4.3	-170.2	-153.2	175.2	0	0	0	116.2	K40 S42 V113	K40-I65 HydrophobicContact CD-CG2 4.23Å; K40-I65 PolarHBondContact NZ-O 3.17Å; S42-I65 WeakPolarHBondContact OG-CB 3.4Å; S42-I65 WeakPolarHBondContact OG-CD1 3.48Å; S42-I65 WeakPolarHBondContact OG-CG2 3.16Å; I65-V113 HydrophobicContact CG2-CG1 3.66Å
66	L	90.3	Very high	91.4	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.084	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-21.2	174.8	-52.6	-174	0	0	0	112.8	K40 L64 E68 V103 P106 V113 L115 F140	K40-L66 HydrophobicContact CD-CD2 4.13Å; L64-L66 PolarHBondContact O-N 3.05Å; L66-E68 PolarHBondContact O-N 2.87Å; L66-V103 HydrophobicContact CB-CG1 4.4Å; L66-P106 HydrophobicContact CD1-CB 4.04Å; L66-P106 HydrophobicContact CD1-CG 4Å; L66-P106 HydrophobicContact CG-CG 4.48Å; L66-V113 HydrophobicContact CD1-CG2 4.39Å; L66-V113 HydrophobicContact CD2-CG1 4.47Å; L66-L115 HydrophobicContact CD1-CD2 4.39Å; L66-L115 HydrophobicContact CD2-CD2 3.57Å; L66-F140 WeakPolarHBondContact O-CB 3.41Å; L66-F140 WeakPolarHBondContact O-CD2 3.28Å
67	A	91.1	Very high	91.4	Very high	3 Å²	3	46.7 Å²	46.7	3%	0.025	25%	0.254	C	S	.	.			trans	-95.8	84.3	177.4	0	0	0	0	0	109.5	L64 D69 S70 Y104	L64-A67 PolarHBondContact O-N 3.34Å; A67-D69 PolarHBondContact O-N 2.04Å; A67-S70 PolarHBondContact O-N 3.14Å; A67-Y104 HydrophobicContact CB-CD1 3.68Å; A67-Y104 HydrophobicContact CB-CE1 3.89Å; A67-Y104 HydrophobicContact CB-CG 4.43Å
68	E	89.9	Confident	91.2	Very high	124 Å²	124	50.1 Å²	50.1	58%	0.579	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-7.5	-178.5	-67.1	170.4	177.4	0	0	113.8	L66 F140 K145	L66-E68 PolarHBondContact O-N 2.87Å; E68-F140 HydrophobicContact CB-CB 4.02Å; E68-F140 HydrophobicContact CB-CD1 3.85Å; E68-F140 HydrophobicContact CB-CG 4.14Å; E68-F140 HydrophobicContact CG-CB 3.83Å; E68-F140 HydrophobicContact CG-CG 4.47Å; E68-F140 PolarHBondContact OE2-N 3.15Å; E68-K145 IonicContact OE1-NZ 3.69Å; E68-K145 PolarHBondContact OE1-NZ 3.11Å; E68-K145 IonicContact OE2-NZ 2.63Å; E68-K145 PolarHBondContact OE2-NZ 3.15Å
69	D	89.9	Confident	91.2	Very high	50 Å²	50	47.7 Å²	47.7	27%	0.267	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	2.5	177.3	70.1	-15.9	0	0	0	114.3	A67 K79 Y104 F140	A67-D69 PolarHBondContact O-N 2.04Å; D69-K79 WeakPolarHBondContact O-CE 3.49Å; D69-K79 PolarHBondContact O-NZ 3Å; D69-Y104 VanDerWaalsContact OD1-CE1 3.24Å; D69-Y104 WeakPolarHBondContact OD1-CE1 3.44Å; D69-Y104 PolarHBondContact OD2-OH 3.36Å; D69-F140 HydrophobicContact CB-CE1 3.83Å; D69-F140 HydrophobicContact CB-CZ 4.01Å; D69-F140 WeakPolarHBondContact OD2-CZ 3.32Å
70	S	91.6	Very high	91.2	Very high	11 Å²	11	46.8 Å²	46.8	8%	0.077	25%	0.246	C	C	.	.			trans	-135	113.5	-167.8	-58.5	0	0	0	0	112.7	A67 K79 Y104	A67-S70 PolarHBondContact O-N 3.14Å; S70-K79 WeakPolarHBondContact OG-CG 3.28Å; S70-Y104 WeakPolarHBondContact OG-CE1 3.27Å
71	S	90.3	Very high	90.9	Very high	100 Å²	100	43.8 Å²	43.8	70%	0.699	23%	0.228	S	C	*	.	S	Bend	trans	-88.8	-17.9	-178.3	64.3	0	0	0	0	114.6	E75	S71-E75 WeakPolarHBondContact CB-OE2 3.36Å; S71-E75 PolarHBondContact N-OE2 3.05Å; S71-E75 PolarHBondContact OG-OE2 3.16Å
72	S	93.3	Very high	90.5	Very high	41 Å²	41	44.4 Å²	44.4	29%	0.287	23%	0.232	S	C	.	.	S	Bend	trans	-143.2	161.4	-177	59.6	0	0	0	0	111.6	L64 E74 E75 A76	L64-S72 VanDerWaalsContact CD1-C 3.48Å; S72-E74 VanDerWaalsContact C-N 3.27Å; S72-E74 PolarHBondContact O-N 3.27Å; S72-E75 PolarHBondContact O-N 2.68Å; S72-E75 VanDerWaalsContact OG-CB 3.29Å; S72-E75 WeakPolarHBondContact OG-CB 3.38Å; S72-E75 PolarHBondContact OG-N 3.37Å; S72-E75 VanDerWaalsContact OG-N 3.12Å; S72-A76 WeakPolarHBondContact O-CB 3.09Å; S72-A76 PolarHBondContact O-N 3.34Å
73	Q	92	Very high	90.2	Very high	13 Å²	13	46.1 Å²	46.1	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-34.1	175.4	-66.8	-173.3	41.1	0	0	111.9	E45 V46 K48 T62 L64 F77	E45-Q73 PolarHBondContact OE2-NE2 2.63Å; V46-Q73 PolarHBondContact O-NE2 3.45Å; V46-Q73 PolarHBondContact O-OE1 2.96Å; K48-Q73 HydrophobicContact CD-CB 4.17Å; T62-Q73 HydrophobicContact CG2-CG 4.39Å; L64-Q73 HydrophobicContact CD2-CG 4.45Å; Q73-F77 WeakPolarHBondContact O-CB 3.46Å; Q73-F77 PolarHBondContact O-N 2.73Å
74	E	91.2	Very high	89.7	Confident	83 Å²	83	46.3 Å²	46.3	39%	0.388	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-47.9	172	-71.9	80.6	171.7	0	0	111.6	K48 S72 F77 E78	K48-E74 VanDerWaalsContact CD-OE1 3.27Å; K48-E74 WeakPolarHBondContact CD-OE1 3.37Å; K48-E74 WeakPolarHBondContact CE-OE1 3.06Å; K48-E74 IonicContact NZ-OE1 3.69Å; K48-E74 PolarHBondContact NZ-OE1 3.07Å; K48-E74 IonicContact NZ-OE2 3.37Å; K48-E74 PolarHBondContact NZ-OE2 3.39Å; S72-E74 VanDerWaalsContact C-N 3.27Å; S72-E74 PolarHBondContact O-N 3.27Å; E74-F77 PolarHBondContact O-N 2.7Å; E74-E78 PolarHBondContact O-N 3.29Å
75	E	91.3	Very high	89.2	Confident	53 Å²	53	45.8 Å²	45.8	25%	0.248	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-43.3	176.4	-179.8	169.5	-151.4	0	0	111.7	S71 S72 F77 E78 K79	S71-E75 WeakPolarHBondContact CB-OE2 3.36Å; S71-E75 PolarHBondContact N-OE2 3.05Å; S71-E75 PolarHBondContact OG-OE2 3.16Å; S72-E75 PolarHBondContact O-N 2.68Å; S72-E75 VanDerWaalsContact OG-CB 3.29Å; S72-E75 WeakPolarHBondContact OG-CB 3.38Å; S72-E75 PolarHBondContact OG-N 3.37Å; S72-E75 VanDerWaalsContact OG-N 3.12Å; E75-F77 VanDerWaalsContact C-N 3.26Å; E75-F77 PolarHBondContact O-N 2.92Å; E75-E78 PolarHBondContact O-N 3.49Å; E75-E78 VanDerWaalsContact O-N 3.09Å; E75-K79 HydrophobicContact CG-CD 4.34Å; E75-K79 WeakPolarHBondContact O-CG 3.1Å; E75-K79 PolarHBondContact O-N 3.3Å; E75-K79 WeakPolarHBondContact OE1-CE 3.3Å; E75-K79 IonicContact OE1-NZ 2.68Å; E75-K79 PolarHBondContact OE1-NZ 2.99Å
76	A	91.5	Very high	88.9	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-36.9	175	0	0	0	0	0	112.1	L64 S72 K79 L80 Y104	L64-A76 HydrophobicContact CD2-CB 3.84Å; S72-A76 WeakPolarHBondContact O-CB 3.09Å; S72-A76 PolarHBondContact O-N 3.34Å; A76-K79 PolarHBondContact O-N 3.19Å; A76-L80 WeakPolarHBondContact O-CB 3.5Å; A76-L80 WeakPolarHBondContact O-CG 3.34Å; A76-L80 PolarHBondContact O-N 3.26Å; A76-Y104 HydrophobicContact CB-CD1 4.05Å
77	F	90.2	Very high	88.7	Confident	76 Å²	76	46.5 Å²	46.5	33%	0.333	24%	0.238	S	C	.	.	H	α-helix	trans	-69.3	-37.1	173.9	-167.4	-89.7	0	0	0	112.2	Y49 Q73 E74 E75 L80 T81	Y49-F77 HydrophobicContact CD1-CD2 4.18Å; Y49-F77 HydrophobicContact CD1-CE2 4.15Å; Y49-F77 HydrophobicContact CD2-CB 4.21Å; Y49-F77 AromaticContact CD2-CD2 3.87Å; Y49-F77 HydrophobicContact CD2-CD2 3.87Å; Y49-F77 HydrophobicContact CD2-CG 4.19Å; Y49-F77 HydrophobicContact CE1-CD2 4.47Å; Y49-F77 HydrophobicContact CE2-CB 3.91Å; Y49-F77 HydrophobicContact CE2-CD2 4.19Å; Y49-F77 HydrophobicContact CE2-CG 4.05Å; Y49-F77 AromaticContact CG-CD2 3.87Å; Y49-F77 HydrophobicContact CG-CD2 3.87Å; Y49-F77 HydrophobicContact CG-CE2 4.16Å; Q73-F77 WeakPolarHBondContact O-CB 3.46Å; Q73-F77 PolarHBondContact O-N 2.73Å; E74-F77 PolarHBondContact O-N 2.7Å; E75-F77 VanDerWaalsContact C-N 3.26Å; E75-F77 PolarHBondContact O-N 2.92Å; F77-L80 PolarHBondContact O-N 3.42Å; F77-T81 WeakPolarHBondContact O-CB 3.47Å; F77-T81 PolarHBondContact O-N 3.29Å; F77-T81 PolarHBondContact O-OG1 3.37Å
78	E	88.2	Confident	88.2	Confident	91 Å²	91	47.6 Å²	47.6	43%	0.425	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-43.5	171.2	-159.6	-161.3	161.7	0	0	111.5	E74 E75 L80 T81 M82 K474	E74-E78 PolarHBondContact O-N 3.29Å; E75-E78 PolarHBondContact O-N 3.49Å; E75-E78 VanDerWaalsContact O-N 3.09Å; E78-L80 PolarHBondContact O-N 2.89Å; E78-T81 CarbonylContact O-C 3.56Å; E78-T81 WeakPolarHBondContact O-CB 3.4Å; E78-T81 PolarHBondContact O-N 2.69Å; E78-T81 VanDerWaalsContact O-N 3.13Å; E78-M82 PolarHBondContact O-N 2.86Å; E78-K474 IonicContact OE1-NZ 2.78Å; E78-K474 PolarHBondContact OE1-NZ 3.28Å
79	K	89.6	Confident	88	Confident	45 Å²	45	41.9 Å²	41.9	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-45.8	175.2	-54.2	-41.6	-171.6	-150.9	0	111.1	D69 S70 E75 A76 T81 M82 W83 Y104	D69-K79 WeakPolarHBondContact O-CE 3.49Å; D69-K79 PolarHBondContact O-NZ 3Å; S70-K79 WeakPolarHBondContact OG-CG 3.28Å; E75-K79 HydrophobicContact CG-CD 4.34Å; E75-K79 WeakPolarHBondContact O-CG 3.1Å; E75-K79 PolarHBondContact O-N 3.3Å; E75-K79 WeakPolarHBondContact OE1-CE 3.3Å; E75-K79 IonicContact OE1-NZ 2.68Å; E75-K79 PolarHBondContact OE1-NZ 2.99Å; A76-K79 PolarHBondContact O-N 3.19Å; K79-T81 VanDerWaalsContact C-N 3.25Å; K79-T81 PolarHBondContact O-N 2.84Å; K79-M82 WeakPolarHBondContact O-CB 3.48Å; K79-M82 PolarHBondContact O-N 2.95Å; K79-M82 VanDerWaalsContact O-N 3.11Å; K79-W83 PolarHBondContact O-N 3.13Å; K79-Y104 HydrophobicContact CB-CD1 4.23Å; K79-Y104 HydrophobicContact CB-CE1 3.49Å; K79-Y104 VanDerWaalsContact CB-CE1 3.49Å; K79-Y104 HydrophobicContact CG-CE1 3.81Å
80	L	90.1	Very high	87.9	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-37.7	174.8	-78.4	171.3	0	0	0	112.2	L53 A76 F77 E78 W83 S84 L100 Y104 M105	L53-L80 HydrophobicContact CD1-CD2 4.3Å; L53-L80 HydrophobicContact CD2-CB 4.22Å; L53-L80 HydrophobicContact CD2-CD2 4.22Å; L53-L80 HydrophobicContact CG-CD2 4.28Å; A76-L80 WeakPolarHBondContact O-CB 3.5Å; A76-L80 WeakPolarHBondContact O-CG 3.34Å; A76-L80 PolarHBondContact O-N 3.26Å; F77-L80 PolarHBondContact O-N 3.42Å; E78-L80 PolarHBondContact O-N 2.89Å; L80-W83 PolarHBondContact O-N 2.99Å; L80-S84 PolarHBondContact O-N 3.14Å; L80-S84 VanDerWaalsContact O-N 3.12Å; L80-L100 HydrophobicContact CD2-CB 3.82Å; L80-Y104 HydrophobicContact CD1-CG 4.49Å; L80-Y104 HydrophobicContact CD2-CD2 3.73Å; L80-Y104 HydrophobicContact CD2-CG 4.03Å; L80-Y104 HydrophobicContact CG-CD2 4.1Å; L80-Y104 HydrophobicContact CG-CG 3.94Å; L80-M105 HydrophobicContact CD1-CG 3.93Å; L80-M105 HydrophobicContact CD1-SD 3.64Å
81	T	85.9	Confident	87.8	Confident	36 Å²	36	45 Å²	45	22%	0.221	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-40.4	174.6	-54.2	0	0	0	0	111.3	F77 E78 K79 S84 T472	F77-T81 WeakPolarHBondContact O-CB 3.47Å; F77-T81 PolarHBondContact O-N 3.29Å; F77-T81 PolarHBondContact O-OG1 3.37Å; E78-T81 CarbonylContact O-C 3.56Å; E78-T81 WeakPolarHBondContact O-CB 3.4Å; E78-T81 PolarHBondContact O-N 2.69Å; E78-T81 VanDerWaalsContact O-N 3.13Å; K79-T81 VanDerWaalsContact C-N 3.25Å; K79-T81 PolarHBondContact O-N 2.84Å; T81-S84 VanDerWaalsContact O-CB 3.26Å; T81-S84 WeakPolarHBondContact O-CB 3.44Å; T81-S84 PolarHBondContact O-N 2.63Å; T81-S84 VanDerWaalsContact O-N 3.15Å; T81-S84 PolarHBondContact O-OG 2.95Å; T81-T472 HydrophobicContact CG2-CG2 3.86Å
82	M	84.3	Confident	87.8	Confident	88 Å²	88	40.3 Å²	40.3	43%	0.433	19%	0.194	S	C	.	.	H	α-helix	trans	-64.6	-39.9	173.5	-173	-179.6	-179	0	0	112.6	E78 K79 S84 G85	E78-M82 PolarHBondContact O-N 2.86Å; K79-M82 WeakPolarHBondContact O-CB 3.48Å; K79-M82 PolarHBondContact O-N 2.95Å; K79-M82 VanDerWaalsContact O-N 3.11Å; M82-S84 PolarHBondContact O-N 3.09Å; M82-G85 PolarHBondContact O-N 3.18Å
83	W	87.3	Confident	87.7	Confident	36 Å²	36	38.5 Å²	38.5	14%	0.136	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-21.1	173.4	-77.5	112.8	0	0	0	113.1	K79 L80 G85 L86 I96 L100 Y104 V131 P138 L141	K79-W83 PolarHBondContact O-N 3.13Å; L80-W83 PolarHBondContact O-N 2.99Å; W83-G85 PolarHBondContact O-N 3.44Å; W83-G85 VanDerWaalsContact O-N 3.14Å; W83-L86 HydrophobicContact CE3-CD1 3.68Å; W83-L86 HydrophobicContact CZ3-CD1 3.97Å; W83-L86 PolarHBondContact O-N 3.24Å; W83-L86 VanDerWaalsContact O-N 3.11Å; W83-I96 HydrophobicContact CE3-CD1 4.47Å; W83-I96 HydrophobicContact CZ3-CD1 4.47Å; W83-L100 HydrophobicContact CB-CD1 3.77Å; W83-L100 HydrophobicContact CB-CD2 4.17Å; W83-L100 HydrophobicContact CD2-CD2 3.86Å; W83-L100 HydrophobicContact CE3-CD2 4.5Å; W83-L100 HydrophobicContact CG-CD1 4.19Å; W83-L100 HydrophobicContact CG-CD2 3.68Å; W83-Y104 AromaticContact CD1-CE2 3.69Å; W83-Y104 AromaticContact CD1-CZ 3.91Å; W83-Y104 AromaticContact NE1-CE2 3.56Å; W83-Y104 AromaticContact NE1-CZ 3.57Å; W83-Y104 PolarHBondContact NE1-OH 3.15Å; W83-V131 HydrophobicContact CH2-CG1 3.89Å; W83-V131 HydrophobicContact CZ3-CG1 3.84Å; W83-V131 HydrophobicContact CZ3-CG2 4.15Å; W83-P138 HydrophobicContact CZ2-CG 4.28Å; W83-L141 HydrophobicContact CH2-CD1 4.05Å; W83-L141 HydrophobicContact CZ2-CD1 3.56Å
84	S	83.6	Confident	87.5	Confident	7 Å²	7	41.2 Å²	41.2	5%	0.049	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-64.5	-15.4	179.1	84.9	0	0	0	0	114.4	L80 T81 M82 L86 R87	L80-S84 PolarHBondContact O-N 3.14Å; L80-S84 VanDerWaalsContact O-N 3.12Å; T81-S84 VanDerWaalsContact O-CB 3.26Å; T81-S84 WeakPolarHBondContact O-CB 3.44Å; T81-S84 PolarHBondContact O-N 2.63Å; T81-S84 VanDerWaalsContact O-N 3.15Å; T81-S84 PolarHBondContact O-OG 2.95Å; M82-S84 PolarHBondContact O-N 3.09Å; S84-L86 PolarHBondContact O-N 3.2Å; S84-R87 WeakPolarHBondContact O-CB 3.31Å; S84-R87 PolarHBondContact O-N 3.05Å
85	G	80.7	Confident	87.5	Confident	12 Å²	12	39.3 Å²	39.3	12%	0.124	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-60.8	-17.7	170	0	0	0	0	0	114.6	M82 W83 R87	M82-G85 PolarHBondContact O-N 3.18Å; W83-G85 PolarHBondContact O-N 3.44Å; W83-G85 VanDerWaalsContact O-N 3.14Å; G85-R87 PolarHBondContact O-N 2.04Å
86	L	84.6	Confident	87.6	Confident	24 Å²	24	36.9 Å²	36.9	13%	0.126	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-72.1	-4.2	171.6	-68.1	175.4	0	0	0	113.6	W83 S84 N88 A89 W93 I96 I130 V131	W83-L86 HydrophobicContact CE3-CD1 3.68Å; W83-L86 HydrophobicContact CZ3-CD1 3.97Å; W83-L86 PolarHBondContact O-N 3.24Å; W83-L86 VanDerWaalsContact O-N 3.11Å; S84-L86 PolarHBondContact O-N 3.2Å; L86-N88 PolarHBondContact O-N 2.84Å; L86-N88 VanDerWaalsContact O-N 3.15Å; L86-A89 PolarHBondContact O-N 3.19Å; L86-W93 HydrophobicContact CB-CE3 3.97Å; L86-W93 HydrophobicContact CB-CZ3 4.44Å; L86-I96 HydrophobicContact CD1-CD1 3.53Å; L86-I96 HydrophobicContact CD1-CG2 4.33Å; L86-I130 HydrophobicContact CD2-CG2 4.04Å; L86-V131 HydrophobicContact CD1-CG2 3.72Å; L86-V131 HydrophobicContact CD2-CG2 4Å
87	R	85.8	Confident	87.6	Confident	75 Å²	75	36.9 Å²	36.9	28%	0.283	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-54.1	-29.5	171.5	-168.8	-176	-51.4	169.1	15.9	112.6	S84 G85 A89 W93 G163 Q164	S84-R87 WeakPolarHBondContact O-CB 3.31Å; S84-R87 PolarHBondContact O-N 3.05Å; G85-R87 PolarHBondContact O-N 2.04Å; R87-A89 PolarHBondContact O-N 3.45Å; R87-W93 HydrophobicContact CB-CD2 4.31Å; R87-W93 HydrophobicContact CB-CG 4.48Å; R87-G163 WeakPolarHBondContact O-CA 3.5Å; R87-Q164 PolarHBondContact O-N 3.45Å; R87-Q164 VanDerWaalsContact O-N 3.13Å; R87-Q164 VanDerWaalsContact O-O 3.07Å
88	N	80.6	Confident	87.7	Confident	26 Å²	26	34.1 Å²	34.1	14%	0.139	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-68.6	-9.4	179.3	-54.6	11.3	0	0	0	112.7	L86 Q164 T467	L86-N88 PolarHBondContact O-N 2.84Å; L86-N88 VanDerWaalsContact O-N 3.15Å; N88-Q164 CarbonylContact C-O 3.4Å; N88-Q164 VanDerWaalsContact CA-O 3.22Å; N88-Q164 WeakPolarHBondContact CA-O 3.43Å; N88-T467 PolarHBondContact ND2-OG1 3.39Å
89	A	86.6	Confident	87.9	Confident	4 Å²	4	29.9 Å²	29.9	3%	0.033	15%	0.153	C	C	.	.	S	Bend	trans	-121.9	84	175.6	0	0	0	0	0	109.8	L86 R87 R91 C92 W93 V182	L86-A89 PolarHBondContact O-N 3.19Å; R87-A89 PolarHBondContact O-N 3.45Å; A89-R91 VanDerWaalsContact C-N 3.34Å; A89-R91 PolarHBondContact O-N 2.95Å; A89-C92 HydrophobicContact CB-CB 4.02Å; A89-C92 WeakPolarHBondContact O-CA 3.37Å; A89-C92 WeakPolarHBondContact O-CB 3.33Å; A89-C92 PolarHBondContact O-N 2.93Å; A89-W93 PolarHBondContact O-N 2.81Å; A89-V182 HydrophobicContact CB-CG1 3.99Å
90	P	87.9	Confident	88.1	Confident	18 Å²	18	27.8 Å²	27.8	12%	0.117	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-32.1	-163.9	22.8	-33.4	0	0	0	114.8	S94 C185	P90-S94 PolarHBondContact O-N 3.27Å; P90-S94 PolarHBondContact O-OG 3.11Å; P90-C185 WeakPolarHBondContact CD-SG 3.21Å
91	R	88.8	Confident	88.2	Confident	110 Å²	110	27.5 Å²	27.5	42%	0.415	14%	0.142	S	C	.	.	H	α-helix	trans	-72.5	-32.8	175.7	-61.4	-72	-179.6	158.6	-3.5	112	A89 S94 P127 D173 E183	A89-R91 VanDerWaalsContact C-N 3.34Å; A89-R91 PolarHBondContact O-N 2.95Å; R91-S94 PolarHBondContact O-OG 3.35Å; R91-P127 HydrophobicContact CB-CB 4.37Å; R91-D173 IonicContact CZ-OD1 2.63Å; R91-D173 IonicContact NH2-OD1 2.69Å; R91-D173 PolarHBondContact NH2-OD1 3.46Å; R91-E183 HydrophobicContact CB-CB 3.85Å; R91-E183 VanDerWaalsContact CB-O 3.24Å; R91-E183 WeakPolarHBondContact CB-O 3.22Å; R91-E183 HydrophobicContact CG-CB 4.18Å; R91-E183 VanDerWaalsContact CG-O 3.23Å; R91-E183 WeakPolarHBondContact CG-O 3.19Å
92	C	90.4	Very high	88.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70.3	-49.8	170	171.2	0	0	0	0	111.1	A89 S94 V95 I96 P127 C128	A89-C92 HydrophobicContact CB-CB 4.02Å; A89-C92 WeakPolarHBondContact O-CA 3.37Å; A89-C92 WeakPolarHBondContact O-CB 3.33Å; A89-C92 PolarHBondContact O-N 2.93Å; C92-S94 VanDerWaalsContact C-N 3.35Å; C92-S94 PolarHBondContact O-N 3.29Å; C92-V95 VanDerWaalsContact O-CG2 3.28Å; C92-V95 WeakPolarHBondContact O-CG2 3.4Å; C92-V95 PolarHBondContact O-N 3.11Å; C92-V95 VanDerWaalsContact O-N 3.11Å; C92-I96 PolarHBondContact O-N 3.21Å; C92-P127 WeakPolarHBondContact CB-O 3.47Å; C92-C128 WeakPolarHBondContact CA-SG 3.42Å; C92-C128 HydrophobicContact CB-CB 4Å; C92-C128 WeakPolarHBondContact CB-SG 3.24Å; C92-C128 PolarHBondContact O-SG 3.47Å; C92-C128 VanDerWaalsContact SG-CA 3.52Å; C92-C128 WeakPolarHBondContact SG-CB 3.49Å; C92-C128 CovalentContact SG-SG 2.04Å; C92-C128 PolarHBondContact SG-SG 2.86Å
93	W	90.6	Very high	88.9	Confident	4 Å²	4	21.9 Å²	21.9	2%	0.015	11%	0.114	C	C	.	.	H	α-helix	trans	-54	-50	-174.2	-172.6	-119.5	0	0	0	112.4	L53 L86 R87 A89 V95 I96 Q97 L100 T161	L53-W93 HydrophobicContact CD1-CH2 3.9Å; L53-W93 HydrophobicContact CD1-CZ2 4.48Å; L53-W93 HydrophobicContact CD2-CH2 4.04Å; L53-W93 HydrophobicContact CG-CH2 4.41Å; L86-W93 HydrophobicContact CB-CE3 3.97Å; L86-W93 HydrophobicContact CB-CZ3 4.44Å; R87-W93 HydrophobicContact CB-CD2 4.31Å; R87-W93 HydrophobicContact CB-CG 4.48Å; A89-W93 PolarHBondContact O-N 2.81Å; W93-V95 PolarHBondContact O-N 2.79Å; W93-V95 VanDerWaalsContact O-N 3.17Å; W93-I96 HydrophobicContact CE3-CG2 3.95Å; W93-I96 HydrophobicContact CZ3-CG2 4.34Å; W93-I96 PolarHBondContact O-N 2.94Å; W93-Q97 HydrophobicContact CD2-CG 3.86Å; W93-Q97 VanDerWaalsContact CE2-CD 3.45Å; W93-Q97 HydrophobicContact CE3-CG 4.22Å; W93-Q97 HydrophobicContact CG-CG 4.38Å; W93-Q97 HydrophobicContact CH2-CG 4Å; W93-Q97 HydrophobicContact CZ2-CG 3.63Å; W93-Q97 HydrophobicContact CZ3-CG 4.28Å; W93-Q97 VanDerWaalsContact NE1-CD 3.27Å; W93-Q97 VanDerWaalsContact NE1-NE2 3.17Å; W93-Q97 VanDerWaalsContact O-CG 3.32Å; W93-Q97 WeakPolarHBondContact O-CG 3.43Å; W93-Q97 PolarHBondContact O-N 3.46Å; W93-Q97 VanDerWaalsContact O-N 3.1Å; W93-Q97 PolarHBondContact O-OE1 3.11Å; W93-L100 HydrophobicContact CZ3-CD1 4.46Å; W93-T161 VanDerWaalsContact CD1-O 3.29Å; W93-T161 PolarHBondContact NE1-O 2.9Å
94	S	89.5	Confident	89.2	Confident	69 Å²	69	20.2 Å²	20.2	48%	0.483	11%	0.107	S	C	.	.	H	α-helix	trans	-60.7	-25.2	-178.9	50.9	0	0	0	0	115	P90 R91 C92	P90-S94 PolarHBondContact O-N 3.27Å; P90-S94 PolarHBondContact O-OG 3.11Å; R91-S94 PolarHBondContact O-OG 3.35Å; C92-S94 VanDerWaalsContact C-N 3.35Å; C92-S94 PolarHBondContact O-N 3.29Å
95	V	90.8	Very high	89.7	Confident	44 Å²	44	20.4 Å²	20.4	27%	0.267	11%	0.107	S	C	.	.	H	α-helix	trans	-100	-21.8	176.1	-57.9	0	0	0	0	114	C92 W93 P98 T124 P127	C92-V95 VanDerWaalsContact O-CG2 3.28Å; C92-V95 WeakPolarHBondContact O-CG2 3.4Å; C92-V95 PolarHBondContact O-N 3.11Å; C92-V95 VanDerWaalsContact O-N 3.11Å; W93-V95 PolarHBondContact O-N 2.79Å; W93-V95 VanDerWaalsContact O-N 3.17Å; V95-P98 WeakPolarHBondContact O-CD 3.45Å; V95-T124 HydrophobicContact CG2-CG2 4.16Å; V95-T124 WeakPolarHBondContact O-CG2 3.43Å; V95-P127 HydrophobicContact CG2-CB 4.45Å; V95-P127 HydrophobicContact CG2-CG 3.5Å
96	I	92.2	Very high	90.2	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-85.4	-28.9	-179.2	-149.6	-177.6	0	0	0	112.5	W83 L86 C92 W93 L99 L100 T124 W137	W83-I96 HydrophobicContact CE3-CD1 4.47Å; W83-I96 HydrophobicContact CZ3-CD1 4.47Å; L86-I96 HydrophobicContact CD1-CD1 3.53Å; L86-I96 HydrophobicContact CD1-CG2 4.33Å; C92-I96 PolarHBondContact O-N 3.21Å; W93-I96 HydrophobicContact CE3-CG2 3.95Å; W93-I96 HydrophobicContact CZ3-CG2 4.34Å; W93-I96 PolarHBondContact O-N 2.94Å; I96-L99 PolarHBondContact O-N 3.1Å; I96-L99 VanDerWaalsContact O-N 3.11Å; I96-L100 HydrophobicContact CD1-CD1 4.43Å; I96-L100 HydrophobicContact CG1-CD1 4.23Å; I96-L100 HydrophobicContact CG1-CG 4.15Å; I96-L100 HydrophobicContact CG2-CD1 4Å; I96-L100 WeakPolarHBondContact O-CG 3.45Å; I96-L100 PolarHBondContact O-N 2.04Å; I96-T124 HydrophobicContact CB-CG2 4.32Å; I96-T124 HydrophobicContact CG1-CG2 4.18Å; I96-W137 HydrophobicContact CD1-CH2 3.84Å; I96-W137 HydrophobicContact CD1-CZ3 4.16Å; I96-W137 HydrophobicContact CG1-CH2 4.49Å
97	Q	91.7	Very high	90.6	Very high	4 Å²	4	20.6 Å²	20.6	2%	0.019	10%	0.104	C	C	.	.	H	α-helix	trans	-50.3	-49.6	177.7	-76.7	166.4	-67.2	0	0	113.8	L53 W93 L99 L100 C101 F159 T161	L53-Q97 HydrophobicContact CD1-CB 4.18Å; L53-Q97 HydrophobicContact CD1-CG 3.99Å; W93-Q97 HydrophobicContact CD2-CG 3.86Å; W93-Q97 VanDerWaalsContact CE2-CD 3.45Å; W93-Q97 HydrophobicContact CE3-CG 4.22Å; W93-Q97 HydrophobicContact CG-CG 4.38Å; W93-Q97 HydrophobicContact CH2-CG 4Å; W93-Q97 HydrophobicContact CZ2-CG 3.63Å; W93-Q97 HydrophobicContact CZ3-CG 4.28Å; W93-Q97 VanDerWaalsContact NE1-CD 3.27Å; W93-Q97 VanDerWaalsContact NE1-NE2 3.17Å; W93-Q97 VanDerWaalsContact O-CG 3.32Å; W93-Q97 WeakPolarHBondContact O-CG 3.43Å; W93-Q97 PolarHBondContact O-N 3.46Å; W93-Q97 VanDerWaalsContact O-N 3.1Å; W93-Q97 PolarHBondContact O-OE1 3.11Å; Q97-L99 PolarHBondContact O-N 3.4Å; Q97-L100 PolarHBondContact O-N 3.45Å; Q97-C101 PolarHBondContact O-N 3.17Å; Q97-C101 VanDerWaalsContact O-N 3.14Å; Q97-C101 PolarHBondContact O-SG 3.11Å; Q97-C101 VanDerWaalsContact O-SG 3.4Å; Q97-F159 HydrophobicContact CB-CB 4.42Å; Q97-F159 HydrophobicContact CB-CD1 3.69Å; Q97-F159 HydrophobicContact CB-CD2 4.33Å; Q97-F159 HydrophobicContact CB-CE1 4.01Å; Q97-F159 HydrophobicContact CB-CG 3.87Å; Q97-F159 HydrophobicContact CB-CZ 4.45Å; Q97-F159 HydrophobicContact CG-CD1 4.29Å; Q97-T161 PolarHBondContact NE2-O 3.22Å; Q97-T161 VanDerWaalsContact NE2-O 3.15Å
98	P	91.9	Very high	90.8	Very high	18 Å²	18	17.3 Å²	17.3	12%	0.117	9%	0.093	C	C	.	.	H	α-helix	trans	-69.8	-32.5	179.8	-10.9	25.6	0	0	0	112.5	V95 A102 L120 F159	V95-P98 WeakPolarHBondContact O-CD 3.45Å; P98-A102 VanDerWaalsContact O-CB 3.28Å; P98-A102 WeakPolarHBondContact O-CB 3.41Å; P98-A102 PolarHBondContact O-N 2.66Å; P98-L120 HydrophobicContact CB-CD1 4.18Å; P98-L120 HydrophobicContact CB-CD2 4.38Å; P98-F159 HydrophobicContact CB-CD2 4.41Å; P98-F159 HydrophobicContact CB-CE2 3.7Å; P98-F159 HydrophobicContact CB-CZ 4.35Å; P98-F159 HydrophobicContact CG-CD2 3.83Å; P98-F159 HydrophobicContact CG-CE2 3.63Å
99	L	92.8	Very high	91.3	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-67.6	-42.9	177.3	-178.3	65.7	0	0	0	111.3	I96 Q97 A102 V103 P116 L120 C121 T124 F146	I96-L99 PolarHBondContact O-N 3.1Å; I96-L99 VanDerWaalsContact O-N 3.11Å; Q97-L99 PolarHBondContact O-N 3.4Å; L99-A102 PolarHBondContact O-N 2.95Å; L99-V103 WeakPolarHBondContact O-CG2 3.16Å; L99-V103 PolarHBondContact O-N 3.14Å; L99-P116 HydrophobicContact CD1-CB 4.43Å; L99-L120 HydrophobicContact CB-CG 4.35Å; L99-L120 HydrophobicContact CD1-CG 4.35Å; L99-C121 HydrophobicContact CD1-CB 4.19Å; L99-T124 HydrophobicContact CB-CG2 4.21Å; L99-T124 HydrophobicContact CD2-CG2 3.67Å; L99-F146 HydrophobicContact CD1-CE2 4.47Å
100	L	93.6	Very high	91.4	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-47.8	177	-69.9	169.3	0	0	0	111.1	L53 L80 W83 W93 I96 Q97 A102 V103 Y104	L53-L100 HydrophobicContact CD1-CB 4.05Å; L53-L100 HydrophobicContact CD1-CD1 3.99Å; L80-L100 HydrophobicContact CD2-CB 3.82Å; W83-L100 HydrophobicContact CB-CD1 3.77Å; W83-L100 HydrophobicContact CB-CD2 4.17Å; W83-L100 HydrophobicContact CD2-CD2 3.86Å; W83-L100 HydrophobicContact CE3-CD2 4.5Å; W83-L100 HydrophobicContact CG-CD1 4.19Å; W83-L100 HydrophobicContact CG-CD2 3.68Å; W93-L100 HydrophobicContact CZ3-CD1 4.46Å; I96-L100 HydrophobicContact CD1-CD1 4.43Å; I96-L100 HydrophobicContact CG1-CD1 4.23Å; I96-L100 HydrophobicContact CG1-CG 4.15Å; I96-L100 HydrophobicContact CG2-CD1 4Å; I96-L100 WeakPolarHBondContact O-CG 3.45Å; I96-L100 PolarHBondContact O-N 2.04Å; Q97-L100 PolarHBondContact O-N 3.45Å; L100-A102 VanDerWaalsContact C-N 3.29Å; L100-A102 PolarHBondContact O-N 3.22Å; L100-V103 PolarHBondContact O-N 3.15Å; L100-V103 VanDerWaalsContact O-N 3.11Å; L100-Y104 HydrophobicContact CD2-CD2 4.19Å; L100-Y104 HydrophobicContact CD2-CE2 3.84Å; L100-Y104 WeakPolarHBondContact O-CD2 3.28Å; L100-Y104 PolarHBondContact O-N 2.92Å
101	C	92.9	Very high	91.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-34	176.3	-63	0	0	0	0	112.7	C52 Q97 V103 M105 F159	C52-C101 HydrophobicContact CB-CB 3.93Å; C52-C101 WeakPolarHBondContact CB-SG 3.43Å; C52-C101 WeakPolarHBondContact SG-CA 3.2Å; C52-C101 WeakPolarHBondContact SG-CB 3.34Å; C52-C101 CovalentContact SG-SG 2.04Å; C52-C101 PolarHBondContact SG-SG 3.35Å; Q97-C101 PolarHBondContact O-N 3.17Å; Q97-C101 VanDerWaalsContact O-N 3.14Å; Q97-C101 PolarHBondContact O-SG 3.11Å; Q97-C101 VanDerWaalsContact O-SG 3.4Å; C101-V103 PolarHBondContact O-N 3.5Å; C101-M105 CarbonylContact O-C 3.5Å; C101-M105 WeakPolarHBondContact O-CA 3.41Å; C101-M105 PolarHBondContact O-N 2.91Å; C101-M105 VanDerWaalsContact O-N 3.11Å; C101-F159 HydrophobicContact CB-CZ 4.24Å
102	A	92.3	Very high	91.4	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-68.9	-12.3	175.1	0	0	0	0	0	114.8	P98 L99 L100 P116 L120 V154	P98-A102 VanDerWaalsContact O-CB 3.28Å; P98-A102 WeakPolarHBondContact O-CB 3.41Å; P98-A102 PolarHBondContact O-N 2.66Å; L99-A102 PolarHBondContact O-N 2.95Å; L100-A102 VanDerWaalsContact C-N 3.29Å; L100-A102 PolarHBondContact O-N 3.22Å; A102-P116 HydrophobicContact CB-CB 4.17Å; A102-P116 HydrophobicContact CB-CG 3.81Å; A102-P116 WeakPolarHBondContact O-CG 3.45Å; A102-L120 HydrophobicContact CB-CD2 4.47Å; A102-V154 HydrophobicContact CB-CG1 4.33Å; A102-V154 HydrophobicContact CB-CG2 3.65Å
103	V	93.1	Very high	91.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-113.7	-44.8	-175.5	170.7	0	0	0	0	111.5	L66 L99 L100 C101 P116 F140 L141 F146	L66-V103 HydrophobicContact CB-CG1 4.4Å; L99-V103 WeakPolarHBondContact O-CG2 3.16Å; L99-V103 PolarHBondContact O-N 3.14Å; L100-V103 PolarHBondContact O-N 3.15Å; L100-V103 VanDerWaalsContact O-N 3.11Å; C101-V103 PolarHBondContact O-N 3.5Å; V103-P116 HydrophobicContact CG2-CG 3.86Å; V103-F140 HydrophobicContact CG1-CD2 3.68Å; V103-F140 HydrophobicContact CG1-CE2 3.96Å; V103-L141 HydrophobicContact CB-CD2 4.32Å; V103-L141 HydrophobicContact CG1-CD2 4.04Å; V103-L141 HydrophobicContact CG2-CD2 4.01Å; V103-F146 HydrophobicContact CG2-CZ 4.06Å
104	Y	93.4	Very high	91.4	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-86.5	-26.9	180	-71.8	-79.1	0	0	0	113.7	A67 D69 S70 A76 K79 L80 W83 L100 P106 F140	A67-Y104 HydrophobicContact CB-CD1 3.68Å; A67-Y104 HydrophobicContact CB-CE1 3.89Å; A67-Y104 HydrophobicContact CB-CG 4.43Å; D69-Y104 VanDerWaalsContact OD1-CE1 3.24Å; D69-Y104 WeakPolarHBondContact OD1-CE1 3.44Å; D69-Y104 PolarHBondContact OD2-OH 3.36Å; S70-Y104 WeakPolarHBondContact OG-CE1 3.27Å; A76-Y104 HydrophobicContact CB-CD1 4.05Å; K79-Y104 HydrophobicContact CB-CD1 4.23Å; K79-Y104 HydrophobicContact CB-CE1 3.49Å; K79-Y104 VanDerWaalsContact CB-CE1 3.49Å; K79-Y104 HydrophobicContact CG-CE1 3.81Å; L80-Y104 HydrophobicContact CD1-CG 4.49Å; L80-Y104 HydrophobicContact CD2-CD2 3.73Å; L80-Y104 HydrophobicContact CD2-CG 4.03Å; L80-Y104 HydrophobicContact CG-CD2 4.1Å; L80-Y104 HydrophobicContact CG-CG 3.94Å; W83-Y104 AromaticContact CD1-CE2 3.69Å; W83-Y104 AromaticContact CD1-CZ 3.91Å; W83-Y104 AromaticContact NE1-CE2 3.56Å; W83-Y104 AromaticContact NE1-CZ 3.57Å; W83-Y104 PolarHBondContact NE1-OH 3.15Å; L100-Y104 HydrophobicContact CD2-CD2 4.19Å; L100-Y104 HydrophobicContact CD2-CE2 3.84Å; L100-Y104 WeakPolarHBondContact O-CD2 3.28Å; L100-Y104 PolarHBondContact O-N 2.92Å; Y104-P106 VanDerWaalsContact C-CD 3.49Å; Y104-F140 HydrophobicContact CE2-CE2 4.39Å; Y104-F140 AromaticContact CZ-CE2 3.96Å; Y104-F140 WeakPolarHBondContact OH-CZ 3.38Å
105	M	93	Very high	91.4	Very high	10 Å²	10	28.4 Å²	28.4	5%	0.049	15%	0.149	C	C	.	.	S	Bend	trans	-136.6	49	-178.6	-59	178.6	79.2	0	0	112.7	L47 Y49 C52 L57 Y59 L80 C101	L47-M105 HydrophobicContact CD2-CE 3.62Å; Y49-M105 WeakPolarHBondContact O-CE 3.29Å; C52-M105 HydrophobicContact CB-SD 3.67Å; L57-M105 HydrophobicContact CD1-CB 4.23Å; L57-M105 HydrophobicContact CD1-CE 3.77Å; L57-M105 HydrophobicContact CD1-SD 4.48Å; Y59-M105 WeakPolarHBondContact CE2-O 3.49Å; Y59-M105 PolarHBondContact OH-O 3.46Å; L80-M105 HydrophobicContact CD1-CG 3.93Å; L80-M105 HydrophobicContact CD1-SD 3.64Å; C101-M105 CarbonylContact O-C 3.5Å; C101-M105 WeakPolarHBondContact O-CA 3.41Å; C101-M105 PolarHBondContact O-N 2.91Å; C101-M105 VanDerWaalsContact O-N 3.11Å
106	P	92.8	Very high	91.4	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.013	14%	0.137	C	C	.	.			trans	-67.4	152	-176.3	31.5	-38.1	0	0	0	112.5	T62 S63 L66 Y104 C108 V113	T62-P106 WeakPolarHBondContact CA-O 3.23Å; T62-P106 PolarHBondContact OG1-O 2.95Å; S63-P106 WeakPolarHBondContact O-CD 3.05Å; S63-P106 WeakPolarHBondContact O-CG 3.05Å; L66-P106 HydrophobicContact CD1-CB 4.04Å; L66-P106 HydrophobicContact CD1-CG 4Å; L66-P106 HydrophobicContact CG-CG 4.48Å; Y104-P106 VanDerWaalsContact C-CD 3.49Å; P106-C108 PolarHBondContact O-N 3.4Å; P106-V113 HydrophobicContact CB-CG2 3.51Å; P106-V113 HydrophobicContact CG-CG2 3.39Å
107	K	91.6	Very high	91.3	Very high	38 Å²	38	26.4 Å²	26.4	17%	0.165	14%	0.137	C	C	.	.			trans	-64.6	124.8	172.1	178	167.9	166	-73.4	0	110.6	Y59 E109 V113 E114 E153	Y59-K107 HydrophobicContact CD1-CB 3.82Å; Y59-K107 HydrophobicContact CD1-CD 3.91Å; Y59-K107 HydrophobicContact CD1-CG 4.04Å; Y59-K107 HydrophobicContact CD2-CB 4.04Å; Y59-K107 HydrophobicContact CD2-CG 4.36Å; Y59-K107 HydrophobicContact CE1-CB 3.88Å; Y59-K107 HydrophobicContact CE2-CB 4.08Å; Y59-K107 HydrophobicContact CG-CB 3.91Å; Y59-K107 HydrophobicContact CG-CD 4.16Å; Y59-K107 HydrophobicContact CG-CG 3.92Å; K107-E109 WeakPolarHBondContact CE-OE2 3.37Å; K107-E109 IonicContact NZ-OE2 2.71Å; K107-E109 PolarHBondContact NZ-OE2 2.78Å; K107-V113 WeakPolarHBondContact O-CA 3.39Å; K107-E114 WeakPolarHBondContact CD-OE1 3.49Å; K107-E114 IonicContact NZ-OE1 2.83Å; K107-E114 PolarHBondContact NZ-OE1 2.97Å; K107-E114 PolarHBondContact O-N 3.04Å; K107-E153 HydrophobicContact CD-CB 4.4Å; K107-E153 HydrophobicContact CD-CG 3.92Å
108	C	91.2	Very high	91.3	Very high	7 Å²	7	29 Å²	29	5%	0.047	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.4	172.6	-162.7	0	0	0	0	110.4	C44 H61 T62 P106 R112	C44-C108 WeakPolarHBondContact CA-SG 3.48Å; C44-C108 HydrophobicContact CB-CB 3.7Å; C44-C108 WeakPolarHBondContact CB-SG 3.09Å; C44-C108 WeakPolarHBondContact SG-CB 3.26Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 3.16Å; H61-C108 WeakPolarHBondContact CB-O 3.26Å; H61-C108 PolarHBondContact O-N 2.79Å; H61-C108 VanDerWaalsContact O-N 3.11Å; T62-C108 WeakPolarHBondContact O-CB 3.37Å; P106-C108 PolarHBondContact O-N 3.4Å; C108-R112 WeakPolarHBondContact CA-O 3.45Å
109	E	90.6	Very high	91.2	Very high	104 Å²	104	32 Å²	32	49%	0.486	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	132	-175.4	-173.4	174.6	-172.1	0	0	109.7	K107 G111 R112	K107-E109 WeakPolarHBondContact CE-OE2 3.37Å; K107-E109 IonicContact NZ-OE2 2.71Å; K107-E109 PolarHBondContact NZ-OE2 2.78Å; E109-G111 VanDerWaalsContact C-N 3.26Å; E109-G111 PolarHBondContact O-N 2.89Å; E109-G111 VanDerWaalsContact O-N 3.17Å; E109-R112 PolarHBondContact N-O 3.24Å; E109-R112 PolarHBondContact O-N 3.16Å; E109-R112 VanDerWaalsContact O-O 3.11Å
110	N	87.9	Confident	91.1	Very high	152 Å²	152	33 Å²	33	81%	0.813	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	40.1	178.2	-58.6	-37.6	0	0	0	114.6	R112	N110-R112 VanDerWaalsContact C-N 3.31Å; N110-R112 PolarHBondContact O-N 3.46Å
111	G	86.5	Confident	91.1	Very high	34 Å²	34	33 Å²	33	35%	0.351	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	18.7	-179.1	0	0	0	0	0	114.6	T41 S42 E109	T41-G111 WeakPolarHBondContact CA-O 3.29Å; S42-G111 PolarHBondContact N-O 2.67Å; S42-G111 CarbonylContact O-C 3.34Å; S42-G111 VanDerWaalsContact O-C 3.23Å; S42-G111 VanDerWaalsContact O-CA 3.28Å; S42-G111 WeakPolarHBondContact O-CA 3.47Å; E109-G111 VanDerWaalsContact C-N 3.26Å; E109-G111 PolarHBondContact O-N 2.89Å; E109-G111 VanDerWaalsContact O-N 3.17Å
112	R	89.9	Confident	91.1	Very high	108 Å²	108	36.8 Å²	36.8	41%	0.408	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.1	179.6	-62.9	177.7	172.5	-145.9	-3.9	110.3	D36 K39 K40 C108 E109 N110	D36-R112 IonicContact OD1-CZ 2.65Å; D36-R112 IonicContact OD1-NH1 2.68Å; D36-R112 PolarHBondContact OD1-NH1 3.24Å; D36-R112 IonicContact OD1-NH2 3.24Å; K39-R112 HydrophobicContact CB-CB 4.4Å; K40-R112 CarbonylContact O-C 3.56Å; K40-R112 WeakPolarHBondContact O-CA 3.4Å; C108-R112 WeakPolarHBondContact CA-O 3.45Å; E109-R112 PolarHBondContact N-O 3.24Å; E109-R112 PolarHBondContact O-N 3.16Å; E109-R112 VanDerWaalsContact O-O 3.11Å; N110-R112 VanDerWaalsContact C-N 3.31Å; N110-R112 PolarHBondContact O-N 3.46Å
113	V	91.1	Very high	91.1	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	139.2	174.8	69.2	0	0	0	0	110.7	K39 K40 I65 L66 P106 K107	K39-V113 CarbonylContact C-O 3.29Å; K39-V113 VanDerWaalsContact CA-O 3.28Å; K39-V113 WeakPolarHBondContact CA-O 3.45Å; K40-V113 HydrophobicContact CB-CG1 3.88Å; K40-V113 PolarHBondContact N-O 2.03Å; K40-V113 WeakPolarHBondContact O-CG1 3.43Å; K40-V113 PolarHBondContact O-N 2.95Å; I65-V113 HydrophobicContact CG2-CG1 3.66Å; L66-V113 HydrophobicContact CD1-CG2 4.39Å; L66-V113 HydrophobicContact CD2-CG1 4.47Å; P106-V113 HydrophobicContact CB-CG2 3.51Å; P106-V113 HydrophobicContact CG-CG2 3.39Å; K107-V113 WeakPolarHBondContact O-CA 3.39Å
114	E	89.9	Confident	91	Very high	34 Å²	34	39 Å²	39	16%	0.159	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.8	175.9	-69.9	174.7	-167.6	0	0	111.4	K107	K107-E114 WeakPolarHBondContact CD-OE1 3.49Å; K107-E114 IonicContact NZ-OE1 2.83Å; K107-E114 PolarHBondContact NZ-OE1 2.97Å; K107-E114 PolarHBondContact O-N 3.04Å
115	L	89.4	Confident	90.9	Very high	32 Å²	32	42.1 Å²	42.1	17%	0.168	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-93.3	134.1	178.6	-69.9	173.2	0	0	0	111.4	C38 K40 L66 S117 P147	C38-L115 WeakPolarHBondContact O-CB 3.28Å; C38-L115 PolarHBondContact O-N 2.78Å; K40-L115 HydrophobicContact CB-CD1 4.34Å; K40-L115 HydrophobicContact CB-CD2 4.06Å; K40-L115 HydrophobicContact CB-CG 4.22Å; K40-L115 HydrophobicContact CD-CD2 4.39Å; L66-L115 HydrophobicContact CD1-CD2 4.39Å; L66-L115 HydrophobicContact CD2-CD2 3.57Å; L115-S117 PolarHBondContact O-N 3.3Å; L115-P147 HydrophobicContact CB-CG 3.99Å; L115-P147 HydrophobicContact CD1-CG 4.32Å
116	P	91.8	Very high	90.7	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-58.7	135.9	175.9	-22.9	30.6	0	0	0	113.1	L99 A102 V103 F146	L99-P116 HydrophobicContact CD1-CB 4.43Å; A102-P116 HydrophobicContact CB-CB 4.17Å; A102-P116 HydrophobicContact CB-CG 3.81Å; A102-P116 WeakPolarHBondContact O-CG 3.45Å; V103-P116 HydrophobicContact CG2-CG 3.86Å; P116-F146 HydrophobicContact CB-CD1 3.82Å; P116-F146 HydrophobicContact CB-CE1 3.83Å; P116-F146 HydrophobicContact CB-CG 4.33Å; P116-F146 HydrophobicContact CB-CZ 4.33Å; P116-F146 HydrophobicContact CG-CD1 4.01Å; P116-F146 HydrophobicContact CG-CE1 3.59Å; P116-F146 HydrophobicContact CG-CZ 4.18Å; P116-F146 WeakPolarHBondContact O-CB 3.47Å; P116-F146 WeakPolarHBondContact O-CD1 3.5Å
117	S	90.8	Very high	90.5	Very high	1 Å²	1	50 Å²	50	1%	0.007	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-62.7	143.1	170.9	79.2	0	0	0	0	113.6	L115 S119 L120 C121 C150 N152 Q155	L115-S117 PolarHBondContact O-N 3.3Å; S117-S119 PolarHBondContact O-N 2.89Å; S117-S119 PolarHBondContact OG-OG 2.93Å; S117-L120 PolarHBondContact O-N 3.27Å; S117-L120 WeakPolarHBondContact OG-CB 3.32Å; S117-L120 PolarHBondContact OG-N 3.32Å; S117-C121 PolarHBondContact O-N 3.44Å; S117-C150 WeakPolarHBondContact CB-O 2.93Å; S117-N152 PolarHBondContact N-OD1 3.25Å; S117-Q155 PolarHBondContact OG-NE2 3Å
118	K	91.1	Very high	90.5	Very high	58 Å²	58	48.2 Å²	48.2	25%	0.252	25%	0.251	S	S	.	.	H	α-helix	trans	-59.6	-32.1	173.8	-169.5	160.1	-171	159.5	0	112.7	C121 V122 C143 D144 F146 P147 V148	K118-C121 PolarHBondContact O-N 3Å; K118-V122 HydrophobicContact CG-CG2 4.15Å; K118-V122 WeakPolarHBondContact O-CB 3.05Å; K118-V122 VanDerWaalsContact O-CG2 3.31Å; K118-V122 WeakPolarHBondContact O-CG2 3.03Å; K118-V122 PolarHBondContact O-N 3.32Å; K118-C143 VanDerWaalsContact CD-O 3.3Å; K118-C143 WeakPolarHBondContact CD-O 3.35Å; K118-C143 WeakPolarHBondContact CE-O 3.45Å; K118-C143 HydrophobicContact CG-CB 4.42Å; K118-C143 WeakPolarHBondContact CG-O 3.49Å; K118-C143 PolarHBondContact NZ-O 2.04Å; K118-D144 IonicContact NZ-OD1 3.64Å; K118-D144 PolarHBondContact NZ-OD1 3.5Å; K118-F146 HydrophobicContact CB-CB 4.29Å; K118-P147 WeakPolarHBondContact CB-O 3.33Å; K118-P147 PolarHBondContact N-O 3.12Å; K118-V148 HydrophobicContact CB-CG2 4.19Å; K118-V148 HydrophobicContact CD-CG2 4.15Å
119	S	90.4	Very high	90.3	Very high	82 Å²	82	49.8 Å²	49.8	57%	0.573	26%	0.262	S	S	*	.	H	α-helix	trans	-60.7	-43.5	176	49.6	0	0	0	0	112.5	S117 C121 V122 A123	S117-S119 PolarHBondContact O-N 2.89Å; S117-S119 PolarHBondContact OG-OG 2.93Å; S119-C121 VanDerWaalsContact C-N 3.34Å; S119-C121 PolarHBondContact O-N 3.33Å; S119-V122 PolarHBondContact O-N 3.25Å; S119-A123 PolarHBondContact O-N 3.44Å; S119-A123 VanDerWaalsContact O-N 3.07Å
120	L	90.7	Very high	90.1	Very high	23 Å²	23	46.4 Å²	46.4	12%	0.12	25%	0.247	C	C	.	.	H	α-helix	trans	-65.5	-38.4	177.5	-176.4	63.1	0	0	0	111.5	P98 L99 A102 S117 N152 V154	P98-L120 HydrophobicContact CB-CD1 4.18Å; P98-L120 HydrophobicContact CB-CD2 4.38Å; L99-L120 HydrophobicContact CB-CG 4.35Å; L99-L120 HydrophobicContact CD1-CG 4.35Å; A102-L120 HydrophobicContact CB-CD2 4.47Å; S117-L120 PolarHBondContact O-N 3.27Å; S117-L120 WeakPolarHBondContact OG-CB 3.32Å; S117-L120 PolarHBondContact OG-N 3.32Å; L120-N152 WeakPolarHBondContact CD2-ND2 3.38Å; L120-V154 HydrophobicContact CD2-CG2 4.21Å
121	C	92.6	Very high	90	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-39	176.4	-175	0	0	0	0	113.4	L99 S117 K118 S119 A123 T124 R125 C143 F146	L99-C121 HydrophobicContact CD1-CB 4.19Å; S117-C121 PolarHBondContact O-N 3.44Å; K118-C121 PolarHBondContact O-N 3Å; S119-C121 VanDerWaalsContact C-N 3.34Å; S119-C121 PolarHBondContact O-N 3.33Å; C121-A123 VanDerWaalsContact C-N 3.34Å; C121-T124 PolarHBondContact O-N 3.2Å; C121-T124 PolarHBondContact O-OG1 2.87Å; C121-T124 VanDerWaalsContact O-OG1 3.05Å; C121-R125 PolarHBondContact O-NE 2.71Å; C121-R125 PolarHBondContact SG-NH2 3.47Å; C121-C143 HydrophobicContact CB-CB 3.81Å; C121-C143 WeakPolarHBondContact CB-SG 3.42Å; C121-C143 PolarHBondContact O-SG 3.11Å; C121-C143 WeakPolarHBondContact SG-CA 3.23Å; C121-C143 WeakPolarHBondContact SG-CB 3.4Å; C121-C143 CovalentContact SG-SG 2.04Å; C121-C143 PolarHBondContact SG-SG 3.26Å; C121-F146 HydrophobicContact CB-CD2 3.53Å; C121-F146 HydrophobicContact CB-CE2 3.99Å; C121-F146 VanDerWaalsContact SG-CD2 3.54Å
122	V	93.1	Very high	90.1	Very high	80 Å²	80	42.9 Å²	42.9	49%	0.485	22%	0.22	S	C	.	.	H	α-helix	trans	-68.3	-35.4	178.7	169.7	0	0	0	0	111.1	K118 S119 T124 R125 C143	K118-V122 HydrophobicContact CG-CG2 4.15Å; K118-V122 WeakPolarHBondContact O-CB 3.05Å; K118-V122 VanDerWaalsContact O-CG2 3.31Å; K118-V122 WeakPolarHBondContact O-CG2 3.03Å; K118-V122 PolarHBondContact O-N 3.32Å; S119-V122 PolarHBondContact O-N 3.25Å; V122-T124 PolarHBondContact O-N 2.97Å; V122-R125 WeakPolarHBondContact O-CB 3.33Å; V122-R125 PolarHBondContact O-N 2.93Å; V122-R125 VanDerWaalsContact O-N 3.09Å; V122-C143 HydrophobicContact CG2-CB 4.32Å
123	A	91.6	Very high	89.7	Confident	52 Å²	52	42.8 Å²	42.8	43%	0.43	22%	0.22	S	C	.	.	H	α-helix	trans	-57.4	-29.4	177.6	0	0	0	0	0	113.8	S119 C121 P127	S119-A123 PolarHBondContact O-N 3.44Å; S119-A123 VanDerWaalsContact O-N 3.07Å; C121-A123 VanDerWaalsContact C-N 3.34Å; A123-P127 WeakPolarHBondContact O-CD 3.17Å
124	T	92.1	Very high	89.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-79.3	-22.7	178.4	70.7	0	0	0	0	113.9	V95 I96 L99 C121 V122 R126 C128	V95-T124 HydrophobicContact CG2-CG2 4.16Å; V95-T124 WeakPolarHBondContact O-CG2 3.43Å; I96-T124 HydrophobicContact CB-CG2 4.32Å; I96-T124 HydrophobicContact CG1-CG2 4.18Å; L99-T124 HydrophobicContact CB-CG2 4.21Å; L99-T124 HydrophobicContact CD2-CG2 3.67Å; C121-T124 PolarHBondContact O-N 3.2Å; C121-T124 PolarHBondContact O-OG1 2.87Å; C121-T124 VanDerWaalsContact O-OG1 3.05Å; V122-T124 PolarHBondContact O-N 2.97Å; T124-R126 VanDerWaalsContact C-N 3.34Å; T124-R126 PolarHBondContact O-N 2.92Å; T124-C128 WeakPolarHBondContact O-CB 3.45Å; T124-C128 PolarHBondContact O-N 3.22Å
125	R	91.3	Very high	88.8	Confident	66 Å²	66	52 Å²	52	25%	0.249	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-38.3	-165.8	-64.1	-60	112.7	159.2	9.9	114.2	C121 V122 L141 C143	C121-R125 PolarHBondContact O-NE 2.71Å; C121-R125 PolarHBondContact SG-NH2 3.47Å; V122-R125 WeakPolarHBondContact O-CB 3.33Å; V122-R125 PolarHBondContact O-N 2.93Å; V122-R125 VanDerWaalsContact O-N 3.09Å; R125-L141 PolarHBondContact NH1-O 2.63Å; R125-L141 PolarHBondContact NH2-O 3.4Å; R125-C143 PolarHBondContact NE-SG 3.14Å; R125-C143 VanDerWaalsContact NE-SG 3.44Å
126	R	89.2	Confident	88.7	Confident	164 Å²	164	51.7 Å²	51.7	62%	0.619	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-62	-180	173.1	177.1	175.3	166.2	1.5	112.6	T124 C128 S129 E183	T124-R126 VanDerWaalsContact C-N 3.34Å; T124-R126 PolarHBondContact O-N 2.92Å; R126-C128 VanDerWaalsContact C-N 3.28Å; R126-C128 PolarHBondContact O-N 3.05Å; R126-S129 WeakPolarHBondContact O-CB 3.2Å; R126-S129 PolarHBondContact O-N 2.97Å; R126-S129 PolarHBondContact O-OG 3.2Å; R126-E183 IonicContact NE-OE1 2.67Å; R126-E183 PolarHBondContact NE-OE1 3.18Å
127	P	88.6	Confident	88.7	Confident	14 Å²	14	52.5 Å²	52.5	9%	0.091	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.4	-175.7	27.3	-36.7	0	0	0	113.2	R91 C92 V95 A123 E183	R91-P127 HydrophobicContact CB-CB 4.37Å; C92-P127 WeakPolarHBondContact CB-O 3.47Å; V95-P127 HydrophobicContact CG2-CB 4.45Å; V95-P127 HydrophobicContact CG2-CG 3.5Å; A123-P127 WeakPolarHBondContact O-CD 3.17Å; P127-E183 WeakPolarHBondContact CA-OE2 3.17Å; P127-E183 WeakPolarHBondContact CB-OE2 3.19Å
128	C	90.1	Very high	88.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	31.5	175.9	-57.9	0	0	0	0	113.5	C92 T124 R126 I130 V131 W137	C92-C128 WeakPolarHBondContact CA-SG 3.42Å; C92-C128 HydrophobicContact CB-CB 4Å; C92-C128 WeakPolarHBondContact CB-SG 3.24Å; C92-C128 PolarHBondContact O-SG 3.47Å; C92-C128 VanDerWaalsContact SG-CA 3.52Å; C92-C128 WeakPolarHBondContact SG-CB 3.49Å; C92-C128 CovalentContact SG-SG 2.04Å; C92-C128 PolarHBondContact SG-SG 2.86Å; T124-C128 WeakPolarHBondContact O-CB 3.45Å; T124-C128 PolarHBondContact O-N 3.22Å; R126-C128 VanDerWaalsContact C-N 3.28Å; R126-C128 PolarHBondContact O-N 3.05Å; C128-I130 PolarHBondContact O-N 2.62Å; C128-V131 HydrophobicContact CB-CG2 4.09Å; C128-V131 WeakPolarHBondContact O-CB 3.34Å; C128-V131 PolarHBondContact O-N 3.06Å; C128-W137 HydrophobicContact CB-CH2 4.08Å; C128-W137 HydrophobicContact CB-CZ2 3.86Å
129	S	88.2	Confident	88.8	Confident	40 Å²	40	56.1 Å²	56.1	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-55.6	-30.9	176	48.1	0	0	0	0	113.4	R126 V131 D132 R133	R126-S129 WeakPolarHBondContact O-CB 3.2Å; R126-S129 PolarHBondContact O-N 2.97Å; R126-S129 PolarHBondContact O-OG 3.2Å; S129-V131 PolarHBondContact O-N 3.26Å; S129-D132 PolarHBondContact O-N 2.65Å; S129-R133 PolarHBondContact O-N 3.48Å
130	I	85.6	Confident	88.8	Confident	34 Å²	34	52.9 Å²	52.9	17%	0.174	26%	0.263	C	S	.	.	H	α-helix	trans	-50.9	-37	170.1	-170.8	169.3	0	0	0	113.7	L86 C128 D132 E134 D181 V182	L86-I130 HydrophobicContact CD2-CG2 4.04Å; C128-I130 PolarHBondContact O-N 2.62Å; I130-D132 VanDerWaalsContact C-N 3.33Å; I130-D132 PolarHBondContact O-N 2.66Å; I130-E134 HydrophobicContact CG1-CG 3.85Å; I130-E134 WeakPolarHBondContact O-CB 3.02Å; I130-E134 WeakPolarHBondContact O-CG 3.46Å; I130-E134 PolarHBondContact O-N 3.12Å; I130-D181 HydrophobicContact CB-CB 4.38Å; I130-V182 HydrophobicContact CD1-CG2 4.32Å
131	V	87	Confident	88.9	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-41.1	179	179.8	0	0	0	0	110.6	W83 L86 C128 S129 R135 G136 W137	W83-V131 HydrophobicContact CH2-CG1 3.89Å; W83-V131 HydrophobicContact CZ3-CG1 3.84Å; W83-V131 HydrophobicContact CZ3-CG2 4.15Å; L86-V131 HydrophobicContact CD1-CG2 3.72Å; L86-V131 HydrophobicContact CD2-CG2 4Å; C128-V131 HydrophobicContact CB-CG2 4.09Å; C128-V131 WeakPolarHBondContact O-CB 3.34Å; C128-V131 PolarHBondContact O-N 3.06Å; S129-V131 PolarHBondContact O-N 3.26Å; V131-R135 PolarHBondContact O-N 3.21Å; V131-G136 PolarHBondContact O-N 2.99Å; V131-W137 HydrophobicContact CB-CD2 4.41Å; V131-W137 HydrophobicContact CB-CH2 4.11Å; V131-W137 HydrophobicContact CB-CZ2 3.78Å; V131-W137 HydrophobicContact CG1-CD2 3.81Å; V131-W137 HydrophobicContact CG1-CE3 3.87Å; V131-W137 HydrophobicContact CG1-CG 4.46Å; V131-W137 HydrophobicContact CG1-CH2 4.05Å; V131-W137 HydrophobicContact CG1-CZ2 3.99Å; V131-W137 HydrophobicContact CG1-CZ3 3.99Å; V131-W137 HydrophobicContact CG2-CH2 4.17Å; V131-W137 HydrophobicContact CG2-CZ2 4.2Å
132	D	86.9	Confident	88.9	Confident	102 Å²	102	56.2 Å²	56.2	55%	0.545	28%	0.277	S	S	.	.	H	α-helix	trans	-71	-38.8	-177.1	-155.9	34.9	0	0	0	111.8	S129 I130 G136 W137	S129-D132 PolarHBondContact O-N 2.65Å; I130-D132 VanDerWaalsContact C-N 3.33Å; I130-D132 PolarHBondContact O-N 2.66Å; D132-G136 WeakPolarHBondContact O-CA 3.39Å; D132-G136 PolarHBondContact O-N 2.85Å; D132-W137 VanDerWaalsContact OD1-CD1 3.22Å
133	R	82.8	Confident	88.9	Confident	106 Å²	106	52.9 Å²	52.9	40%	0.4	26%	0.257	S	S	.	.	H	α-helix	trans	-79.3	-40.7	-178.9	-162	-175.5	70.8	-163.5	-7.2	114.2	S129 D181	S129-R133 PolarHBondContact O-N 3.48Å; R133-D181 IonicContact CZ-OD1 3.35Å; R133-D181 IonicContact CZ-OD2 2.63Å; R133-D181 IonicContact NH1-OD1 2.66Å; R133-D181 PolarHBondContact NH1-OD1 3.09Å; R133-D181 IonicContact NH1-OD2 3.72Å; R133-D181 PolarHBondContact NH1-OD2 3.34Å; R133-D181 IonicContact NH2-OD1 3.21Å; R133-D181 IonicContact NH2-OD2 2.69Å; R133-D181 PolarHBondContact NH2-OD2 3.01Å
134	E	80.8	Confident	88.8	Confident	64 Å²	64	56.8 Å²	56.8	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-88.8	-22.4	-172.6	-52.2	-52.9	150	0	0	113.5	I130 R457 L461	I130-E134 HydrophobicContact CG1-CG 3.85Å; I130-E134 WeakPolarHBondContact O-CB 3.02Å; I130-E134 WeakPolarHBondContact O-CG 3.46Å; I130-E134 PolarHBondContact O-N 3.12Å; E134-R457 IonicContact OE1-CZ 2.61Å; E134-R457 IonicContact OE1-NH2 2.63Å; E134-R457 PolarHBondContact OE1-NH2 3.47Å; E134-R457 IonicContact OE2-CZ 2.98Å; E134-R457 IonicContact OE2-NH2 2.71Å; E134-R457 PolarHBondContact OE2-NH2 3.4Å; E134-L461 HydrophobicContact CG-CD2 4.26Å
135	R	81.8	Confident	88.5	Confident	163 Å²	163	61.6 Å²	61.6	62%	0.615	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.7	-24	178.3	-69	-175.1	178.3	138.6	3	115	V131	V131-R135 PolarHBondContact O-N 3.21Å
136	G	87.6	Confident	88.4	Confident	26 Å²	26	59.2 Å²	59.2	27%	0.268	28%	0.283	S	S	.	.			trans	77.6	147.9	-169.1	0	0	0	0	0	112.3	V131 D132 P138	V131-G136 PolarHBondContact O-N 2.99Å; D132-G136 WeakPolarHBondContact O-CA 3.39Å; D132-G136 PolarHBondContact O-N 2.85Å; G136-P138 WeakPolarHBondContact O-CD 3.38Å
137	W	90.3	Very high	88.5	Confident	18 Å²	18	52.7 Å²	52.7	7%	0.068	26%	0.262	C	S	.	.			trans	-72.1	125.6	178	-72.2	98.2	0	0	0	112.5	I96 C128 V131 D132 L141 K142	I96-W137 HydrophobicContact CD1-CH2 3.84Å; I96-W137 HydrophobicContact CD1-CZ3 4.16Å; I96-W137 HydrophobicContact CG1-CH2 4.49Å; C128-W137 HydrophobicContact CB-CH2 4.08Å; C128-W137 HydrophobicContact CB-CZ2 3.86Å; V131-W137 HydrophobicContact CB-CD2 4.41Å; V131-W137 HydrophobicContact CB-CH2 4.11Å; V131-W137 HydrophobicContact CB-CZ2 3.78Å; V131-W137 HydrophobicContact CG1-CD2 3.81Å; V131-W137 HydrophobicContact CG1-CE3 3.87Å; V131-W137 HydrophobicContact CG1-CG 4.46Å; V131-W137 HydrophobicContact CG1-CH2 4.05Å; V131-W137 HydrophobicContact CG1-CZ2 3.99Å; V131-W137 HydrophobicContact CG1-CZ3 3.99Å; V131-W137 HydrophobicContact CG2-CH2 4.17Å; V131-W137 HydrophobicContact CG2-CZ2 4.2Å; D132-W137 VanDerWaalsContact OD1-CD1 3.22Å; W137-L141 HydrophobicContact CE3-CB 3.95Å; W137-L141 HydrophobicContact CE3-CD1 4.32Å; W137-L141 HydrophobicContact CZ3-CD1 4.41Å; W137-K142 HydrophobicContact CB-CG 4.46Å; W137-K142 WeakPolarHBondContact O-CE 3.24Å
138	P	92.6	Very high	88.4	Confident	39 Å²	39	57.4 Å²	57.4	25%	0.253	29%	0.29	S	S	.	.			trans	-56.7	151	173.2	-26.7	35.5	0	0	0	113	W83 G136 F140 L141 K142	W83-P138 HydrophobicContact CZ2-CG 4.28Å; G136-P138 WeakPolarHBondContact O-CD 3.38Å; P138-F140 VanDerWaalsContact C-N 3.27Å; P138-F140 HydrophobicContact CB-CD1 3.78Å; P138-F140 HydrophobicContact CB-CE1 3.37Å; P138-F140 HydrophobicContact CB-CZ 3.96Å; P138-F140 HydrophobicContact CG-CE1 4.23Å; P138-F140 HydrophobicContact CG-CZ 4.43Å; P138-F140 PolarHBondContact O-N 3.19Å; P138-F140 VanDerWaalsContact O-N 3.16Å; P138-L141 HydrophobicContact CG-CD1 4.27Å; P138-L141 WeakPolarHBondContact O-CA 3.06Å; P138-L141 PolarHBondContact O-N 3.32Å; P138-K142 PolarHBondContact O-N 3Å
139	N	91	Very high	88	Confident	97 Å²	97	60.7 Å²	60.7	52%	0.519	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-59.6	-32.1	-172.8	-74.8	-30	0	0	0	114.1	L141 K142 K145	N139-L141 VanDerWaalsContact C-N 3.34Å; N139-K142 WeakPolarHBondContact OD1-CE 3.39Å; N139-K142 PolarHBondContact OD1-NZ 3.09Å; N139-K145 VanDerWaalsContact O-CD 3.26Å; N139-K145 WeakPolarHBondContact O-CD 3.49Å; N139-K145 WeakPolarHBondContact O-CE 3.27Å; N139-K145 PolarHBondContact O-NZ 3.31Å; N139-K145 VanDerWaalsContact O-NZ 3.16Å
140	F	91.7	Very high	87.7	Confident	14 Å²	14	59.3 Å²	59.3	6%	0.061	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-75	-18.2	174.7	62.7	-81.2	0	0	0	114.3	L66 E68 D69 V103 Y104 P138 F146	L66-F140 WeakPolarHBondContact O-CB 3.41Å; L66-F140 WeakPolarHBondContact O-CD2 3.28Å; E68-F140 HydrophobicContact CB-CB 4.02Å; E68-F140 HydrophobicContact CB-CD1 3.85Å; E68-F140 HydrophobicContact CB-CG 4.14Å; E68-F140 HydrophobicContact CG-CB 3.83Å; E68-F140 HydrophobicContact CG-CG 4.47Å; E68-F140 PolarHBondContact OE2-N 3.15Å; D69-F140 HydrophobicContact CB-CE1 3.83Å; D69-F140 HydrophobicContact CB-CZ 4.01Å; D69-F140 WeakPolarHBondContact OD2-CZ 3.32Å; V103-F140 HydrophobicContact CG1-CD2 3.68Å; V103-F140 HydrophobicContact CG1-CE2 3.96Å; Y104-F140 HydrophobicContact CE2-CE2 4.39Å; Y104-F140 AromaticContact CZ-CE2 3.96Å; Y104-F140 WeakPolarHBondContact OH-CZ 3.38Å; P138-F140 VanDerWaalsContact C-N 3.27Å; P138-F140 HydrophobicContact CB-CD1 3.78Å; P138-F140 HydrophobicContact CB-CE1 3.37Å; P138-F140 HydrophobicContact CB-CZ 3.96Å; P138-F140 HydrophobicContact CG-CE1 4.23Å; P138-F140 HydrophobicContact CG-CZ 4.43Å; P138-F140 PolarHBondContact O-N 3.19Å; P138-F140 VanDerWaalsContact O-N 3.16Å; F140-F146 WeakPolarHBondContact O-CZ 3.48Å
141	L	93.2	Very high	87.1	Confident	1 Å²	1	62 Å²	62	1%	0.005	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-99.5	10.3	176.8	-67.1	174.6	0	0	0	113.6	W83 V103 R125 W137 P138 N139	W83-L141 HydrophobicContact CH2-CD1 4.05Å; W83-L141 HydrophobicContact CZ2-CD1 3.56Å; V103-L141 HydrophobicContact CB-CD2 4.32Å; V103-L141 HydrophobicContact CG1-CD2 4.04Å; V103-L141 HydrophobicContact CG2-CD2 4.01Å; R125-L141 PolarHBondContact NH1-O 2.63Å; R125-L141 PolarHBondContact NH2-O 3.4Å; W137-L141 HydrophobicContact CE3-CB 3.95Å; W137-L141 HydrophobicContact CE3-CD1 4.32Å; W137-L141 HydrophobicContact CZ3-CD1 4.41Å; P138-L141 HydrophobicContact CG-CD1 4.27Å; P138-L141 WeakPolarHBondContact O-CA 3.06Å; P138-L141 PolarHBondContact O-N 3.32Å; N139-L141 VanDerWaalsContact C-N 3.34Å
142	K	92.4	Very high	86.4	Confident	91 Å²	91	61.8 Å²	61.8	40%	0.396	34%	0.335	S	S	.	.			trans	-83.1	129.7	174.8	-71.9	178.6	-178.2	169.5	0	110.8	W137 P138 N139 D144 K145	W137-K142 HydrophobicContact CB-CG 4.46Å; W137-K142 WeakPolarHBondContact O-CE 3.24Å; P138-K142 PolarHBondContact O-N 3Å; N139-K142 WeakPolarHBondContact OD1-CE 3.39Å; N139-K142 PolarHBondContact OD1-NZ 3.09Å; K142-D144 PolarHBondContact O-N 3.46Å; K142-K145 PolarHBondContact O-N 3.32Å; K142-K145 VanDerWaalsContact O-N 3.14Å
143	C	92	Very high	85.7	Confident	11 Å²	11	59.9 Å²	59.9	7%	0.074	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-68.4	-6.7	-168.1	-55.2	0	0	0	0	115.9	K118 C121 V122 R125 F146	K118-C143 VanDerWaalsContact CD-O 3.3Å; K118-C143 WeakPolarHBondContact CD-O 3.35Å; K118-C143 WeakPolarHBondContact CE-O 3.45Å; K118-C143 HydrophobicContact CG-CB 4.42Å; K118-C143 WeakPolarHBondContact CG-O 3.49Å; K118-C143 PolarHBondContact NZ-O 2.04Å; C121-C143 HydrophobicContact CB-CB 3.81Å; C121-C143 WeakPolarHBondContact CB-SG 3.42Å; C121-C143 PolarHBondContact O-SG 3.11Å; C121-C143 WeakPolarHBondContact SG-CA 3.23Å; C121-C143 WeakPolarHBondContact SG-CB 3.4Å; C121-C143 CovalentContact SG-SG 2.04Å; C121-C143 PolarHBondContact SG-SG 3.26Å; V122-C143 HydrophobicContact CG2-CB 4.32Å; R125-C143 PolarHBondContact NE-SG 3.14Å; R125-C143 VanDerWaalsContact NE-SG 3.44Å; C143-F146 PolarHBondContact O-N 3.18Å
144	D	90.1	Very high	85.3	Confident	133 Å²	133	55.1 Å²	55.1	71%	0.711	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-83.5	-13	177	-52.8	-58.4	0	0	0	113.1	K118 K142 F146	K118-D144 IonicContact NZ-OD1 3.64Å; K118-D144 PolarHBondContact NZ-OD1 3.5Å; K142-D144 PolarHBondContact O-N 3.46Å; D144-F146 VanDerWaalsContact C-N 3.3Å
145	K	85.2	Confident	84.9	Confident	101 Å²	101	56.4 Å²	56.4	44%	0.439	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-77.3	-11.9	166.7	-70	-169.6	178.6	179.5	0	113.7	E68 N139 K142	E68-K145 IonicContact OE1-NZ 3.69Å; E68-K145 PolarHBondContact OE1-NZ 3.11Å; E68-K145 IonicContact OE2-NZ 2.63Å; E68-K145 PolarHBondContact OE2-NZ 3.15Å; N139-K145 VanDerWaalsContact O-CD 3.26Å; N139-K145 WeakPolarHBondContact O-CD 3.49Å; N139-K145 WeakPolarHBondContact O-CE 3.27Å; N139-K145 PolarHBondContact O-NZ 3.31Å; N139-K145 VanDerWaalsContact O-NZ 3.16Å; K142-K145 PolarHBondContact O-N 3.32Å; K142-K145 VanDerWaalsContact O-N 3.14Å
146	F	90.2	Very high	84.7	Confident	17 Å²	17	55 Å²	55	8%	0.075	31%	0.309	C	S	.	.	S	Bend	trans	-102.5	134.9	-170.6	-66.5	-48.9	0	0	0	113.7	L99 V103 P116 K118 C121 F140 C143 D144	L99-F146 HydrophobicContact CD1-CE2 4.47Å; V103-F146 HydrophobicContact CG2-CZ 4.06Å; P116-F146 HydrophobicContact CB-CD1 3.82Å; P116-F146 HydrophobicContact CB-CE1 3.83Å; P116-F146 HydrophobicContact CB-CG 4.33Å; P116-F146 HydrophobicContact CB-CZ 4.33Å; P116-F146 HydrophobicContact CG-CD1 4.01Å; P116-F146 HydrophobicContact CG-CE1 3.59Å; P116-F146 HydrophobicContact CG-CZ 4.18Å; P116-F146 WeakPolarHBondContact O-CB 3.47Å; P116-F146 WeakPolarHBondContact O-CD1 3.5Å; K118-F146 HydrophobicContact CB-CB 4.29Å; C121-F146 HydrophobicContact CB-CD2 3.53Å; C121-F146 HydrophobicContact CB-CE2 3.99Å; C121-F146 VanDerWaalsContact SG-CD2 3.54Å; F140-F146 WeakPolarHBondContact O-CZ 3.48Å; C143-F146 PolarHBondContact O-N 3.18Å; D144-F146 VanDerWaalsContact C-N 3.3Å
147	P	90.3	Very high	84.4	Confident	26 Å²	26	55 Å²	55	17%	0.169	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-72.1	156	-180	29	-36.4	0	0	0	113.8	L115 K118 C150	L115-P147 HydrophobicContact CB-CG 3.99Å; L115-P147 HydrophobicContact CD1-CG 4.32Å; K118-P147 WeakPolarHBondContact CB-O 3.33Å; K118-P147 PolarHBondContact N-O 3.12Å; P147-C150 WeakPolarHBondContact CG-SG 3.45Å
148	V	87.7	Confident	84	Confident	113 Å²	113	63.4 Å²	63.4	69%	0.685	34%	0.34	S	S	*	.	S	Bend	trans	-95.9	139.8	177.6	-176.5	0	0	0	0	110	K118	K118-V148 HydrophobicContact CB-CG2 4.19Å; K118-V148 HydrophobicContact CD-CG2 4.15Å
149	G	81.4	Confident	83.6	Confident	70 Å²	70	63.3 Å²	63.3	72%	0.722	34%	0.336	S	S	*	.	S	Bend	trans	89	-4.8	175	0	0	0	0	0	115.8
150	C	82	Confident	82.9	Confident	10 Å²	10	65.8 Å²	65.8	7%	0.068	35%	0.349	C	S	.	.			trans	-71.8	146.1	176	-55	0	0	0	0	112.3	C38 S117 P147	C38-C150 WeakPolarHBondContact CA-SG 3.46Å; C38-C150 HydrophobicContact CB-CB 3.75Å; C38-C150 WeakPolarHBondContact CB-SG 3.04Å; C38-C150 WeakPolarHBondContact SG-CA 3.39Å; C38-C150 WeakPolarHBondContact SG-CB 3Å; C38-C150 CovalentContact SG-SG 2.03Å; C38-C150 PolarHBondContact SG-SG 2.66Å; S117-C150 WeakPolarHBondContact CB-O 2.93Å; P147-C150 WeakPolarHBondContact CG-SG 3.45Å
151	S	73.1	Confident	82.2	Confident	90 Å²	90	67.4 Å²	67.4	63%	0.629	36%	0.361	S	S	*	.			trans	-108.8	134.7	169.9	-175.7	0	0	0	0	108.5
152	N	72.1	Confident	81.6	Confident	5 Å²	5	71.9 Å²	71.9	3%	0.027	39%	0.392	C	S	.	.			trans	-110.6	139.5	-179.2	-41.8	-9.9	0	0	0	109.4	S117 L120 V154 Q155	S117-N152 PolarHBondContact N-OD1 3.25Å; L120-N152 WeakPolarHBondContact CD2-ND2 3.38Å; N152-V154 HydrophobicContact CB-CG2 3.56Å; N152-V154 PolarHBondContact O-N 3.44Å; N152-V154 VanDerWaalsContact O-N 3.16Å; N152-Q155 HydrophobicContact CB-CG 4.26Å; N152-Q155 WeakPolarHBondContact O-CB 3.35Å; N152-Q155 PolarHBondContact O-N 3.11Å
153	E	72.6	Confident	81	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.29	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-58.4	-29.5	171.1	-70.3	-57.4	133.2	0	0	112.7	K107 Q155 K156	K107-E153 HydrophobicContact CD-CB 4.4Å; K107-E153 HydrophobicContact CD-CG 3.92Å; E153-Q155 PolarHBondContact O-N 2.85Å; E153-Q155 VanDerWaalsContact O-N 3.14Å; E153-K156 WeakPolarHBondContact O-CB 3.41Å; E153-K156 PolarHBondContact O-N 2.65Å; E153-K156 IonicContact OE1-NZ 3.57Å; E153-K156 PolarHBondContact OE1-NZ 3.13Å; E153-K156 WeakPolarHBondContact OE2-CD 3.29Å; E153-K156 VanDerWaalsContact OE2-CE 3.29Å; E153-K156 WeakPolarHBondContact OE2-CE 3.34Å; E153-K156 IonicContact OE2-NZ 2.66Å; E153-K156 PolarHBondContact OE2-NZ 2.94Å
154	V	73.6	Confident	80.5	Confident	6 Å²	6	74.4 Å²	74.4	4%	0.036	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-62.7	-18.6	176.3	-60	0	0	0	0	114.6	A102 L120 N152 K156 L157	A102-V154 HydrophobicContact CB-CG1 4.33Å; A102-V154 HydrophobicContact CB-CG2 3.65Å; L120-V154 HydrophobicContact CD2-CG2 4.21Å; N152-V154 HydrophobicContact CB-CG2 3.56Å; N152-V154 PolarHBondContact O-N 3.44Å; N152-V154 VanDerWaalsContact O-N 3.16Å; V154-K156 PolarHBondContact O-N 3.35Å; V154-L157 HydrophobicContact CB-CD1 4.03Å; V154-L157 HydrophobicContact CG1-CD1 4.04Å; V154-L157 WeakPolarHBondContact O-CB 3.48Å; V154-L157 PolarHBondContact O-N 2.85Å
155	Q	72.5	Confident	80.3	Confident	91 Å²	91	69.2 Å²	69.2	43%	0.425	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-73.5	-13.2	175.4	-66.5	173.2	17.9	0	0	111.9	S117 N152 E153	S117-Q155 PolarHBondContact OG-NE2 3Å; N152-Q155 HydrophobicContact CB-CG 4.26Å; N152-Q155 WeakPolarHBondContact O-CB 3.35Å; N152-Q155 PolarHBondContact O-N 3.11Å; E153-Q155 PolarHBondContact O-N 2.85Å; E153-Q155 VanDerWaalsContact O-N 3.14Å
156	K	76.5	Confident	80.1	Confident	133 Å²	133	69.1 Å²	69.1	58%	0.578	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-92.7	-10.9	175	-49.9	179.1	-163.4	164.2	0	112.6	E153 V154	E153-K156 WeakPolarHBondContact O-CB 3.41Å; E153-K156 PolarHBondContact O-N 2.65Å; E153-K156 IonicContact OE1-NZ 3.57Å; E153-K156 PolarHBondContact OE1-NZ 3.13Å; E153-K156 WeakPolarHBondContact OE2-CD 3.29Å; E153-K156 VanDerWaalsContact OE2-CE 3.29Å; E153-K156 WeakPolarHBondContact OE2-CE 3.34Å; E153-K156 IonicContact OE2-NZ 2.66Å; E153-K156 PolarHBondContact OE2-NZ 2.94Å; V154-K156 PolarHBondContact O-N 3.35Å
157	L	81.9	Confident	79.5	Confident	26 Å²	26	71.6 Å²	71.6	14%	0.136	41%	0.407	C	S	.	.			trans	-69	131.3	176	-69.8	173.9	0	0	0	110.5	P56 L57 V154 F159	P56-L157 VanDerWaalsContact O-CD2 3.29Å; P56-L157 WeakPolarHBondContact O-CD2 3.26Å; L57-L157 HydrophobicContact CD2-CD1 3.98Å; V154-L157 HydrophobicContact CB-CD1 4.03Å; V154-L157 HydrophobicContact CG1-CD1 4.04Å; V154-L157 WeakPolarHBondContact O-CB 3.48Å; V154-L157 PolarHBondContact O-N 2.85Å; L157-F159 HydrophobicContact CB-CD2 4.2Å; L157-F159 HydrophobicContact CB-CE2 3.58Å; L157-F159 HydrophobicContact CB-CZ 3.95Å; L157-F159 HydrophobicContact CD1-CE2 4.18Å; L157-F159 HydrophobicContact CD1-CZ 3.77Å
158	K	82.9	Confident	79.2	Confident	196 Å²	196	70.9 Å²	70.9	85%	0.852	40%	0.402	S	S	*	.			trans	-95.2	96.3	173.7	-68.8	-173.6	178.7	-178.1	0	110.2	N160	K158-N160 PolarHBondContact O-N 3.47Å; K158-N160 VanDerWaalsContact O-N 3.13Å
159	F	84.1	Confident	79.2	Confident	37 Å²	37	66.3 Å²	66.3	16%	0.162	37%	0.374	C	S	.	.			trans	-72.4	101.2	174.7	-66.6	-84.5	0	0	0	110.7	L53 S55 Q97 P98 C101 L157	L53-F159 HydrophobicContact CB-CE1 4.48Å; S55-F159 WeakPolarHBondContact OG-CA 3.44Å; S55-F159 WeakPolarHBondContact OG-CD1 3.42Å; Q97-F159 HydrophobicContact CB-CB 4.42Å; Q97-F159 HydrophobicContact CB-CD1 3.69Å; Q97-F159 HydrophobicContact CB-CD2 4.33Å; Q97-F159 HydrophobicContact CB-CE1 4.01Å; Q97-F159 HydrophobicContact CB-CG 3.87Å; Q97-F159 HydrophobicContact CB-CZ 4.45Å; Q97-F159 HydrophobicContact CG-CD1 4.29Å; P98-F159 HydrophobicContact CB-CD2 4.41Å; P98-F159 HydrophobicContact CB-CE2 3.7Å; P98-F159 HydrophobicContact CB-CZ 4.35Å; P98-F159 HydrophobicContact CG-CD2 3.83Å; P98-F159 HydrophobicContact CG-CE2 3.63Å; C101-F159 HydrophobicContact CB-CZ 4.24Å; L157-F159 HydrophobicContact CB-CD2 4.2Å; L157-F159 HydrophobicContact CB-CE2 3.58Å; L157-F159 HydrophobicContact CB-CZ 3.95Å; L157-F159 HydrophobicContact CD1-CE2 4.18Å; L157-F159 HydrophobicContact CD1-CZ 3.77Å
160	N	76.6	Confident	79.6	Confident	149 Å²	149	65.2 Å²	65.2	80%	0.797	35%	0.353	S	S	*	.			trans	-83	-17.1	-177.8	-157.3	29.7	0	0	0	113	K158 S162	K158-N160 PolarHBondContact O-N 3.47Å; K158-N160 VanDerWaalsContact O-N 3.13Å; N160-S162 PolarHBondContact O-N 3.46Å
161	T	76.9	Confident	80	Confident	48 Å²	48	71 Å²	71	29%	0.294	38%	0.377	S	S	.	.			trans	-75.9	84.1	179.6	-48.9	0	0	0	0	110.7	W93 Q97	W93-T161 VanDerWaalsContact CD1-O 3.29Å; W93-T161 PolarHBondContact NE1-O 2.9Å; Q97-T161 PolarHBondContact NE2-O 3.22Å; Q97-T161 VanDerWaalsContact NE2-O 3.15Å
162	S	78.8	Confident	80.8	Confident	95 Å²	95	67 Å²	67	66%	0.664	35%	0.348	S	S	*	.			trans	-61.7	149.2	171.9	-67.2	0	0	0	0	111.7	N160	N160-S162 PolarHBondContact O-N 3.46Å
163	G	79.7	Confident	81.6	Confident	15 Å²	15	71.3 Å²	71.3	16%	0.155	37%	0.371	C	S	.	.			trans	-74.4	161.3	169.5	0	0	0	0	0	112.1	R87	R87-G163 WeakPolarHBondContact O-CA 3.5Å
164	Q	83.4	Confident	82.2	Confident	139 Å²	139	70.6 Å²	70.6	65%	0.65	37%	0.369	S	S	*	.			trans	-129.3	155.7	174.5	-71.3	177.8	-31	0	0	108	R87 N88	R87-Q164 PolarHBondContact O-N 3.45Å; R87-Q164 VanDerWaalsContact O-N 3.13Å; R87-Q164 VanDerWaalsContact O-O 3.07Å; N88-Q164 CarbonylContact C-O 3.4Å; N88-Q164 VanDerWaalsContact CA-O 3.22Å; N88-Q164 WeakPolarHBondContact CA-O 3.43Å
165	C	85.9	Confident	82.9	Confident	25 Å²	25	76.3 Å²	76.3	17%	0.169	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-93.4	124.3	169.4	-55.3	0	0	0	0	107	L169 K171 C185	C165-L169 HydrophobicContact CB-CB 4.23Å; C165-L169 VanDerWaalsContact CB-O 3.3Å; C165-L169 WeakPolarHBondContact CB-O 3.45Å; C165-K171 WeakPolarHBondContact SG-CA 3.47Å; C165-C185 HydrophobicContact CB-CB 3.87Å; C165-C185 WeakPolarHBondContact CB-SG 3.3Å; C165-C185 WeakPolarHBondContact SG-CB 3.47Å; C165-C185 CovalentContact SG-SG 2.03Å; C165-C185 PolarHBondContact SG-SG 2.55Å
166	E	79.9	Confident	83.4	Confident	99 Å²	99	76.3 Å²	76.3	46%	0.463	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-87	151.2	176.1	-159.4	62.5	-123.9	0	0	109.7	L169 T467	E166-L169 WeakPolarHBondContact O-CA 3.27Å; E166-L169 WeakPolarHBondContact O-CB 3.41Å; E166-L169 PolarHBondContact O-N 2.97Å; E166-T467 HydrophobicContact CG-CG2 4.06Å
167	A	77.3	Confident	84	Confident	69 Å²	69	70.5 Å²	70.5	57%	0.57	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	139.7	176.5	0	0	0	0	0	111.1
168	P	83.8	Confident	84.3	Confident	10 Å²	10	72.1 Å²	72.1	7%	0.065	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	cis	-91.6	22.9	8.1	38.3	-37.9	0	0	0	114.7	Q188 P192 F456 V460	P168-Q188 WeakPolarHBondContact O-CG 3.3Å; P168-Q188 PolarHBondContact O-N 3.05Å; P168-P192 HydrophobicContact CB-CB 3.49Å; P168-P192 VanDerWaalsContact CB-CB 3.49Å; P168-P192 HydrophobicContact CB-CG 3.8Å; P168-P192 HydrophobicContact CG-CB 4.18Å; P168-P192 HydrophobicContact CG-CG 4.21Å; P168-F456 HydrophobicContact CG-CE2 4.46Å; P168-F456 HydrophobicContact CG-CZ 4.37Å; P168-V460 HydrophobicContact CG-CG2 4.07Å
169	L	87.8	Confident	84.6	Confident	18 Å²	18	65.4 Å²	65.4	9%	0.094	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.1	-179.5	-58.8	-179.6	0	0	0	112.1	C165 E166 Y179 V182 C185 G186 I187	C165-L169 HydrophobicContact CB-CB 4.23Å; C165-L169 VanDerWaalsContact CB-O 3.3Å; C165-L169 WeakPolarHBondContact CB-O 3.45Å; E166-L169 WeakPolarHBondContact O-CA 3.27Å; E166-L169 WeakPolarHBondContact O-CB 3.41Å; E166-L169 PolarHBondContact O-N 2.97Å; L169-Y179 HydrophobicContact CD2-CD1 4.39Å; L169-Y179 HydrophobicContact CD2-CD2 4.32Å; L169-Y179 HydrophobicContact CD2-CG 3.96Å; L169-V182 HydrophobicContact CD1-CG1 4.2Å; L169-C185 HydrophobicContact CB-CB 4.03Å; L169-C185 HydrophobicContact CD1-CB 4.24Å; L169-G186 CarbonylContact C-O 3.48Å; L169-G186 VanDerWaalsContact CA-O 3.25Å; L169-G186 WeakPolarHBondContact CA-O 3.35Å; L169-I187 HydrophobicContact CD2-CB 4.45Å
170	V	90.9	Very high	84.5	Confident	47 Å²	47	70.9 Å²	70.9	29%	0.285	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.3	178.1	173	0	0	0	0	109.4	T172 C185 G186 Q188	V170-T172 PolarHBondContact O-N 2.77Å; V170-C185 CarbonylContact O-C 3.46Å; V170-C185 WeakPolarHBondContact O-CA 3.4Å; V170-G186 PolarHBondContact N-O 2.87Å; V170-G186 PolarHBondContact O-N 2.59Å; V170-Q188 HydrophobicContact CG2-CB 3.75Å
171	K	89.8	Confident	84.6	Confident	132 Å²	132	65.5 Å²	65.5	57%	0.574	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	124.4	178.1	-172.6	-162.2	168	-156.2	0	110.6	C165 D173	C165-K171 WeakPolarHBondContact SG-CA 3.47Å; K171-D173 IonicContact NZ-OD2 2.77Å
172	T	90.1	Very high	85	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.025	34%	0.341	C	S	.	.			trans	-136.3	139.6	171	-174.8	0	0	0	0	112.2	V170 I174 W178 G184 D270 T272	V170-T172 PolarHBondContact O-N 2.77Å; T172-I174 WeakPolarHBondContact OG1-CB 3.05Å; T172-I174 PolarHBondContact OG1-N 2.69Å; T172-W178 PolarHBondContact O-NE1 2.81Å; T172-G184 PolarHBondContact N-O 3.18Å; T172-G184 VanDerWaalsContact N-O 3.1Å; T172-G184 CarbonylContact O-C 3.23Å; T172-G184 WeakPolarHBondContact O-CA 3.41Å; T172-D270 WeakPolarHBondContact CB-OD2 3.2Å; T172-D270 PolarHBondContact OG1-OD2 3.34Å; T172-T272 HydrophobicContact CG2-CG2 4.18Å
173	D	87.9	Confident	85.4	Confident	96 Å²	96	61.2 Å²	61.2	51%	0.513	32%	0.318	S	S	.	.			trans	-92.6	-0.9	172	-65.8	-54.6	0	0	0	111.7	R91 K171 Q175	R91-D173 IonicContact CZ-OD1 2.63Å; R91-D173 IonicContact NH2-OD1 2.69Å; R91-D173 PolarHBondContact NH2-OD1 3.46Å; K171-D173 IonicContact NZ-OD2 2.77Å; D173-Q175 PolarHBondContact O-N 2.75Å
174	I	86.3	Confident	85.8	Confident	47 Å²	47	60.6 Å²	60.6	24%	0.241	31%	0.311	C	S	.	.			trans	-80	108.3	173.9	-55.7	-177.1	0	0	0	109.9	T172 S176 S177 D270	T172-I174 WeakPolarHBondContact OG1-CB 3.05Å; T172-I174 PolarHBondContact OG1-N 2.69Å; I174-S176 VanDerWaalsContact C-N 3.26Å; I174-S176 WeakPolarHBondContact CG2-OG 3.07Å; I174-S176 PolarHBondContact O-N 2.88Å; I174-S177 PolarHBondContact O-N 3.16Å; I174-D270 HydrophobicContact CD1-CB 4.25Å
175	Q	87.1	Confident	86.1	Confident	126 Å²	126	54 Å²	54	59%	0.589	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-59.2	-31.1	-176.6	-178.5	174.8	-8.8	0	0	114.1	D173 S177 W178	D173-Q175 PolarHBondContact O-N 2.75Å; Q175-S177 VanDerWaalsContact C-N 3.3Å; Q175-W178 HydrophobicContact CB-CD2 4.42Å; Q175-W178 HydrophobicContact CB-CE3 4.37Å; Q175-W178 HydrophobicContact CB-CH2 4.23Å; Q175-W178 HydrophobicContact CB-CZ2 4.28Å; Q175-W178 HydrophobicContact CB-CZ3 4.29Å; Q175-W178 HydrophobicContact CG-CD2 4.33Å; Q175-W178 HydrophobicContact CG-CE3 3.82Å; Q175-W178 HydrophobicContact CG-CH2 4.13Å; Q175-W178 HydrophobicContact CG-CZ3 3.73Å
176	S	84.4	Confident	86.3	Confident	91 Å²	91	52.8 Å²	52.8	64%	0.636	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-78.5	-9.6	176.8	56.1	0	0	0	0	114.2	I174	I174-S176 VanDerWaalsContact C-N 3.26Å; I174-S176 WeakPolarHBondContact CG2-OG 3.07Å; I174-S176 PolarHBondContact O-N 2.88Å
177	S	88.1	Confident	86.8	Confident	11 Å²	11	49.1 Å²	49.1	8%	0.077	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-98.3	-2.2	173.3	-63.9	0	0	0	0	113	I174 Q175 Y179 G186 K268 T272	I174-S177 PolarHBondContact O-N 3.16Å; Q175-S177 VanDerWaalsContact C-N 3.3Å; S177-Y179 PolarHBondContact O-N 2.03Å; S177-G186 WeakPolarHBondContact O-CA 3.05Å; S177-K268 WeakPolarHBondContact OG-CD 3.42Å; S177-K268 PolarHBondContact OG-NZ 3.44Å; S177-T272 WeakPolarHBondContact CB-OG1 3.35Å; S177-T272 PolarHBondContact OG-OG1 2.97Å
178	W	89.7	Confident	87.5	Confident	60 Å²	60	48.6 Å²	48.6	23%	0.227	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-65.5	131.2	-179.2	-68.4	-14.9	0	0	0	112	T172 Q175 E183 C185	T172-W178 PolarHBondContact O-NE1 2.81Å; Q175-W178 HydrophobicContact CB-CD2 4.42Å; Q175-W178 HydrophobicContact CB-CE3 4.37Å; Q175-W178 HydrophobicContact CB-CH2 4.23Å; Q175-W178 HydrophobicContact CB-CZ2 4.28Å; Q175-W178 HydrophobicContact CB-CZ3 4.29Å; Q175-W178 HydrophobicContact CG-CD2 4.33Å; Q175-W178 HydrophobicContact CG-CE3 3.82Å; Q175-W178 HydrophobicContact CG-CH2 4.13Å; Q175-W178 HydrophobicContact CG-CZ3 3.73Å; W178-E183 HydrophobicContact CD2-CB 4.38Å; W178-E183 HydrophobicContact CE3-CB 3.88Å; W178-E183 HydrophobicContact CE3-CG 3.73Å; W178-E183 HydrophobicContact CH2-CB 4.49Å; W178-E183 HydrophobicContact CZ3-CB 3.94Å; W178-E183 HydrophobicContact CZ3-CG 3.75Å; W178-C185 CarbonylContact C-O 3.52Å; W178-C185 WeakPolarHBondContact CA-O 3.35Å
179	Y	87.4	Confident	88	Confident	56 Å²	56	48.4 Å²	48.4	22%	0.22	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-65.6	147.8	170.7	-171.2	-99.9	0	0	0	109.6	L169 S177 D181 V182 C185 I187 F456	L169-Y179 HydrophobicContact CD2-CD1 4.39Å; L169-Y179 HydrophobicContact CD2-CD2 4.32Å; L169-Y179 HydrophobicContact CD2-CG 3.96Å; S177-Y179 PolarHBondContact O-N 2.03Å; Y179-D181 PolarHBondContact O-N 3.13Å; Y179-V182 HydrophobicContact CD1-CG2 4.19Å; Y179-V182 PolarHBondContact O-N 2.98Å; Y179-V182 VanDerWaalsContact O-N 3.09Å; Y179-C185 PolarHBondContact N-O 3.1Å; Y179-I187 HydrophobicContact CD2-CB 4.47Å; Y179-F456 HydrophobicContact CE2-CE1 4.25Å
180	K	82.6	Confident	88.2	Confident	152 Å²	152	50.8 Å²	50.8	66%	0.661	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	132	-173.9	-154.6	-176	179.8	174	0	109.8	V182	K180-V182 PolarHBondContact O-N 3.2Å; K180-V182 VanDerWaalsContact O-N 3.1Å
181	D	79.8	Confident	88.2	Confident	35 Å²	35	50 Å²	50	19%	0.187	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	2.4	178.1	-27.8	-93	0	0	0	115.8	I130 R133 Y179	I130-D181 HydrophobicContact CB-CB 4.38Å; R133-D181 IonicContact CZ-OD1 3.35Å; R133-D181 IonicContact CZ-OD2 2.63Å; R133-D181 IonicContact NH1-OD1 2.66Å; R133-D181 PolarHBondContact NH1-OD1 3.09Å; R133-D181 IonicContact NH1-OD2 3.72Å; R133-D181 PolarHBondContact NH1-OD2 3.34Å; R133-D181 IonicContact NH2-OD1 3.21Å; R133-D181 IonicContact NH2-OD2 2.69Å; R133-D181 PolarHBondContact NH2-OD2 3.01Å; Y179-D181 PolarHBondContact O-N 3.13Å
182	V	84.9	Confident	88.1	Confident	15 Å²	15	45.1 Å²	45.1	9%	0.091	23%	0.229	C	C	.	.			trans	-120.4	76	-179.8	-170.7	0	0	0	0	110.4	A89 I130 L169 Y179 K180 G184 C185	A89-V182 HydrophobicContact CB-CG1 3.99Å; I130-V182 HydrophobicContact CD1-CG2 4.32Å; L169-V182 HydrophobicContact CD1-CG1 4.2Å; Y179-V182 HydrophobicContact CD1-CG2 4.19Å; Y179-V182 PolarHBondContact O-N 2.98Å; Y179-V182 VanDerWaalsContact O-N 3.09Å; K180-V182 PolarHBondContact O-N 3.2Å; K180-V182 VanDerWaalsContact O-N 3.1Å; V182-G184 PolarHBondContact O-N 3.3Å; V182-C185 HydrophobicContact CG1-CB 3.86Å; V182-C185 PolarHBondContact O-N 2.63Å
183	E	87.1	Confident	88	Confident	39 Å²	39	46.1 Å²	46.1	18%	0.182	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	128.4	178.4	-66.7	-166.4	163	0	0	111.2	R91 R126 P127 W178	R91-E183 HydrophobicContact CB-CB 3.85Å; R91-E183 VanDerWaalsContact CB-O 3.24Å; R91-E183 WeakPolarHBondContact CB-O 3.22Å; R91-E183 HydrophobicContact CG-CB 4.18Å; R91-E183 VanDerWaalsContact CG-O 3.23Å; R91-E183 WeakPolarHBondContact CG-O 3.19Å; R126-E183 IonicContact NE-OE1 2.67Å; R126-E183 PolarHBondContact NE-OE1 3.18Å; P127-E183 WeakPolarHBondContact CA-OE2 3.17Å; P127-E183 WeakPolarHBondContact CB-OE2 3.19Å; W178-E183 HydrophobicContact CD2-CB 4.38Å; W178-E183 HydrophobicContact CE3-CB 3.88Å; W178-E183 HydrophobicContact CE3-CG 3.73Å; W178-E183 HydrophobicContact CH2-CB 4.49Å; W178-E183 HydrophobicContact CZ3-CB 3.94Å; W178-E183 HydrophobicContact CZ3-CG 3.75Å
184	G	87.1	Confident	88.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-3.7	179	0	0	0	0	0	116.4	T172 V182	T172-G184 PolarHBondContact N-O 3.18Å; T172-G184 VanDerWaalsContact N-O 3.1Å; T172-G184 CarbonylContact O-C 3.23Å; T172-G184 WeakPolarHBondContact O-CA 3.41Å; V182-G184 PolarHBondContact O-N 3.3Å
185	C	90.1	Very high	88.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.2	170.7	-54.8	0	0	0	0	110.2	P90 C165 L169 V170 W178 Y179 V182	P90-C185 WeakPolarHBondContact CD-SG 3.21Å; C165-C185 HydrophobicContact CB-CB 3.87Å; C165-C185 WeakPolarHBondContact CB-SG 3.3Å; C165-C185 WeakPolarHBondContact SG-CB 3.47Å; C165-C185 CovalentContact SG-SG 2.03Å; C165-C185 PolarHBondContact SG-SG 2.55Å; L169-C185 HydrophobicContact CB-CB 4.03Å; L169-C185 HydrophobicContact CD1-CB 4.24Å; V170-C185 CarbonylContact O-C 3.46Å; V170-C185 WeakPolarHBondContact O-CA 3.4Å; W178-C185 CarbonylContact C-O 3.52Å; W178-C185 WeakPolarHBondContact CA-O 3.35Å; Y179-C185 PolarHBondContact N-O 3.1Å; V182-C185 HydrophobicContact CG1-CB 3.86Å; V182-C185 PolarHBondContact O-N 2.63Å
186	G	91	Very high	88.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	170.2	168.6	0	0	0	0	0	111	L169 V170 S177	L169-G186 CarbonylContact C-O 3.48Å; L169-G186 VanDerWaalsContact CA-O 3.25Å; L169-G186 WeakPolarHBondContact CA-O 3.35Å; V170-G186 PolarHBondContact N-O 2.87Å; V170-G186 PolarHBondContact O-N 2.59Å; S177-G186 WeakPolarHBondContact O-CA 3.05Å
187	I	89.9	Confident	89.2	Confident	22 Å²	22	49 Å²	49	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	138.7	169.7	-169.8	171.2	0	0	0	109.8	L169 Y179 P192 T272 M273 F456	L169-I187 HydrophobicContact CD2-CB 4.45Å; Y179-I187 HydrophobicContact CD2-CB 4.47Å; I187-P192 HydrophobicContact CD1-CG 4.12Å; I187-P192 HydrophobicContact CG1-CG 4.48Å; I187-T272 VanDerWaalsContact O-CA 3.23Å; I187-T272 WeakPolarHBondContact O-CA 3.48Å; I187-T272 VanDerWaalsContact O-CB 3.28Å; I187-T272 WeakPolarHBondContact O-CB 3.4Å; I187-M273 HydrophobicContact CD1-SD 4.43Å; I187-M273 HydrophobicContact CG2-CG 3.73Å; I187-M273 HydrophobicContact CG2-SD 3.56Å; I187-M273 VanDerWaalsContact CG2-SD 3.56Å; I187-M273 PolarHBondContact O-N 3.32Å; I187-F456 HydrophobicContact CD1-CE1 3.87Å; I187-F456 HydrophobicContact CD1-CZ 3.7Å
188	Q	92.2	Very high	89.5	Confident	58 Å²	58	50.3 Å²	50.3	27%	0.271	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-58.3	157.4	175	68.2	-176.6	41.4	0	0	112.7	P168 V170 D190	P168-Q188 WeakPolarHBondContact O-CG 3.3Å; P168-Q188 PolarHBondContact O-N 3.05Å; V170-Q188 HydrophobicContact CG2-CB 3.75Å; Q188-D190 WeakPolarHBondContact CG-O 3.34Å; Q188-D190 PolarHBondContact NE2-O 2.63Å
189	C	93.1	Very high	89.7	Confident	6 Å²	6	48.1 Å²	48.1	4%	0.041	24%	0.235	C	C	.	.	S	Bend	trans	-64.6	-44.7	178.8	-177.6	0	0	0	0	113.7	N191 C267 N271	C189-N191 PolarHBondContact O-N 2.87Å; C189-C267 HydrophobicContact CB-CB 3.69Å; C189-C267 WeakPolarHBondContact CB-SG 3.33Å; C189-C267 WeakPolarHBondContact SG-CA 3.47Å; C189-C267 WeakPolarHBondContact SG-CB 3.36Å; C189-C267 CovalentContact SG-SG 2.03Å; C189-C267 PolarHBondContact SG-SG 3.04Å; C189-N271 WeakPolarHBondContact CB-O 3.38Å; C189-N271 PolarHBondContact N-O 3.22Å
190	D	92.8	Very high	90.1	Very high	68 Å²	68	50.4 Å²	50.4	36%	0.364	25%	0.251	S	S	.	.	S	Bend	trans	-80.2	115.5	-176.8	-63.1	-64.9	0	0	0	110.6	Q188 P192	Q188-D190 WeakPolarHBondContact CG-O 3.34Å; Q188-D190 PolarHBondContact NE2-O 2.63Å; D190-P192 WeakPolarHBondContact O-CD 3.14Å; D190-P192 VanDerWaalsContact O-N 3.14Å
191	N	90.9	Very high	90.7	Very high	32 Å²	32	47 Å²	47	17%	0.171	24%	0.24	C	C	.	.			trans	-55.6	109.3	-167.2	-172.2	-23.4	0	0	0	112.6	C189 L193 F194 H199 D356 S357 V358	C189-N191 PolarHBondContact O-N 2.87Å; N191-L193 PolarHBondContact O-N 3.25Å; N191-L193 WeakPolarHBondContact OD1-CB 3.46Å; N191-L193 PolarHBondContact OD1-N 3.15Å; N191-F194 HydrophobicContact CB-CD2 4.49Å; N191-F194 PolarHBondContact O-N 3.4Å; N191-H199 PolarHBondContact O-CE1 2.95Å; N191-D356 PolarHBondContact ND2-OD1 3.35Å; N191-D356 VanDerWaalsContact ND2-OD1 3.16Å; N191-S357 VanDerWaalsContact CB-OG 3.23Å; N191-S357 WeakPolarHBondContact CB-OG 3.17Å; N191-S357 PolarHBondContact N-OG 3.35Å; N191-V358 HydrophobicContact CB-CG2 3.9Å
192	P	88.3	Confident	91.5	Very high	29 Å²	29	45.4 Å²	45.4	19%	0.188	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	0.3	-169.6	31	-38.5	0	0	0	114.6	P168 I187 D190 F194 F456	P168-P192 HydrophobicContact CB-CB 3.49Å; P168-P192 VanDerWaalsContact CB-CB 3.49Å; P168-P192 HydrophobicContact CB-CG 3.8Å; P168-P192 HydrophobicContact CG-CB 4.18Å; P168-P192 HydrophobicContact CG-CG 4.21Å; I187-P192 HydrophobicContact CD1-CG 4.12Å; I187-P192 HydrophobicContact CG1-CG 4.48Å; D190-P192 WeakPolarHBondContact O-CD 3.14Å; D190-P192 VanDerWaalsContact O-N 3.14Å; P192-F194 VanDerWaalsContact C-N 3.29Å; P192-F456 HydrophobicContact CG-CE2 3.7Å; P192-F456 HydrophobicContact CG-CZ 3.85Å
193	L	88.1	Confident	92	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.126	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-11.5	172.9	-64.8	174.8	0	0	0	113.1	N191 F456 I481 R484 P485	N191-L193 PolarHBondContact O-N 3.25Å; N191-L193 WeakPolarHBondContact OD1-CB 3.46Å; N191-L193 PolarHBondContact OD1-N 3.15Å; L193-F456 HydrophobicContact CD2-CB 4.23Å; L193-F456 HydrophobicContact CD2-CD2 3.64Å; L193-F456 HydrophobicContact CD2-CE2 4.43Å; L193-F456 HydrophobicContact CD2-CG 4.23Å; L193-F456 HydrophobicContact CG-CD2 4.31Å; L193-I481 HydrophobicContact CD2-CD1 4.16Å; L193-I481 HydrophobicContact CD2-CG2 4.31Å; L193-R484 WeakPolarHBondContact O-CD 3.31Å; L193-R484 PolarHBondContact O-NH1 3.35Å; L193-P485 HydrophobicContact CD1-CG 4.31Å
194	F	90.8	Very high	92.5	Very high	23 Å²	23	46.4 Å²	46.4	10%	0.101	25%	0.246	C	C	.	.	S	Bend	trans	-137.4	146.2	-171.5	-55	-72.2	0	0	0	112.5	N191 P192 E198 V358 R484 P485 L487	N191-F194 HydrophobicContact CB-CD2 4.49Å; N191-F194 PolarHBondContact O-N 3.4Å; P192-F194 VanDerWaalsContact C-N 3.29Å; F194-E198 VanDerWaalsContact CA-OE2 3.25Å; F194-E198 WeakPolarHBondContact CA-OE2 3.46Å; F194-E198 HydrophobicContact CB-CB 4.16Å; F194-V358 HydrophobicContact CB-CG2 4.48Å; F194-V358 HydrophobicContact CD2-CG2 3.54Å; F194-V358 HydrophobicContact CE2-CG2 4.11Å; F194-V358 HydrophobicContact CG-CG2 4.25Å; F194-R484 VanDerWaalsContact CD1-NH1 3.34Å; F194-P485 WeakPolarHBondContact CE1-O 3.19Å; F194-P485 HydrophobicContact CZ-CB 4.07Å; F194-P485 HydrophobicContact CZ-CG 4.19Å; F194-P485 WeakPolarHBondContact CZ-O 3.47Å; F194-L487 HydrophobicContact CD1-CD1 3.68Å; F194-L487 HydrophobicContact CD1-CD2 3.75Å; F194-L487 HydrophobicContact CD1-CG 3.76Å; F194-L487 HydrophobicContact CE1-CD1 4.01Å; F194-L487 HydrophobicContact CE1-CD2 3.59Å; F194-L487 HydrophobicContact CE1-CG 3.57Å; F194-L487 HydrophobicContact CE2-CD2 4.34Å; F194-L487 HydrophobicContact CG-CD1 4.5Å; F194-L487 HydrophobicContact CG-CD2 4.21Å; F194-L487 HydrophobicContact CZ-CD2 3.89Å; F194-L487 HydrophobicContact CZ-CG 4.31Å
195	T	92.1	Very high	93	Very high	73 Å²	73	48.8 Å²	48.8	45%	0.448	26%	0.255	S	S	.	.			trans	-75.4	165.4	179.6	70.7	0	0	0	0	112.2	E197 E198 H199	T195-E197 PolarHBondContact O-N 3.28Å; T195-E197 PolarHBondContact OG1-N 3.1Å; T195-E198 PolarHBondContact N-OE2 3.37Å; T195-E198 PolarHBondContact O-N 2.97Å; T195-E198 WeakPolarHBondContact OG1-CG 3.32Å; T195-E198 PolarHBondContact OG1-N 3.37Å; T195-E198 VanDerWaalsContact OG1-N 3.14Å; T195-H199 PolarHBondContact O-N 3.42Å; T195-H199 PolarHBondContact O-ND1 3.4Å
196	E	92.4	Very high	93.4	Very high	161 Å²	161	48.8 Å²	48.8	75%	0.752	26%	0.255	S	S	*	.	H	α-helix	trans	-61.8	-30.5	171.3	-65.5	-167.4	138.5	0	0	112.1	H199 N200	E196-H199 PolarHBondContact O-N 2.82Å; E196-N200 WeakPolarHBondContact O-CB 3.29Å; E196-N200 PolarHBondContact O-N 2.82Å; E196-N200 PolarHBondContact O-ND2 2.75Å
197	E	94.2	Very high	93.7	Very high	164 Å²	164	50.1 Å²	50.1	77%	0.766	27%	0.266	S	S	*	.	H	α-helix	trans	-65.5	-44.9	174.1	-60.3	-174.7	162.8	0	0	111.3	T195 H199 N200 D201	T195-E197 PolarHBondContact O-N 3.28Å; T195-E197 PolarHBondContact OG1-N 3.1Å; E197-H199 VanDerWaalsContact C-N 3.34Å; E197-H199 PolarHBondContact O-N 2.66Å; E197-N200 PolarHBondContact O-N 2.74Å; E197-D201 WeakPolarHBondContact O-CB 3.39Å; E197-D201 PolarHBondContact O-N 3.05Å
198	E	94.8	Very high	94	Very high	39 Å²	39	55.9 Å²	55.9	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-37.1	176.6	-74.1	178.8	136.4	0	0	112.4	F194 T195 M202 R484 L487	F194-E198 VanDerWaalsContact CA-OE2 3.25Å; F194-E198 WeakPolarHBondContact CA-OE2 3.46Å; F194-E198 HydrophobicContact CB-CB 4.16Å; T195-E198 PolarHBondContact N-OE2 3.37Å; T195-E198 PolarHBondContact O-N 2.97Å; T195-E198 WeakPolarHBondContact OG1-CG 3.32Å; T195-E198 PolarHBondContact OG1-N 3.37Å; T195-E198 VanDerWaalsContact OG1-N 3.14Å; E198-M202 PolarHBondContact O-N 3.16Å; E198-M202 VanDerWaalsContact O-N 3.1Å; E198-R484 IonicContact OE1-CZ 2.76Å; E198-R484 IonicContact OE1-NH1 3.73Å; E198-R484 PolarHBondContact OE1-NH1 2.84Å; E198-R484 IonicContact OE1-NH2 2.98Å; E198-R484 PolarHBondContact OE1-NH2 3.12Å; E198-R484 IonicContact OE2-CZ 3.77Å; E198-R484 IonicContact OE2-NH1 2.9Å; E198-R484 PolarHBondContact OE2-NH1 3.29Å; E198-R484 IonicContact OE2-NH2 3.28Å; E198-L487 HydrophobicContact CB-CD1 3.7Å; E198-L487 HydrophobicContact CG-CD1 3.81Å
199	H	94.4	Very high	94.3	Very high	14 Å²	14	54.7 Å²	54.7	7%	0.065	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-52.3	171	-77.7	84.9	0	0	0	111.4	N191 T195 E196 E197 D201 M202 H203 S357	N191-H199 PolarHBondContact O-CE1 2.95Å; T195-H199 PolarHBondContact O-N 3.42Å; T195-H199 PolarHBondContact O-ND1 3.4Å; E196-H199 PolarHBondContact O-N 2.82Å; E197-H199 VanDerWaalsContact C-N 3.34Å; E197-H199 PolarHBondContact O-N 2.66Å; H199-D201 VanDerWaalsContact C-N 3.32Å; H199-D201 PolarHBondContact O-N 2.76Å; H199-M202 PolarHBondContact O-N 3.45Å; H199-M202 VanDerWaalsContact O-N 3.16Å; H199-H203 WeakPolarHBondContact O-CB 3.25Å; H199-H203 PolarHBondContact O-N 3.02Å; H199-H203 PolarHBondContact O-ND1 2.7Å; H199-S357 PolarHBondContact NE2-OG 3.22Å
200	N	94.8	Very high	94.5	Very high	104 Å²	104	54.4 Å²	54.4	56%	0.556	28%	0.279	S	S	*	.	H	α-helix	trans	-61.5	-38.2	-178.6	-78.9	-62.2	0	0	0	112.5	E196 E197 H203 A204	E196-N200 WeakPolarHBondContact O-CB 3.29Å; E196-N200 PolarHBondContact O-N 2.82Å; E196-N200 PolarHBondContact O-ND2 2.75Å; E197-N200 PolarHBondContact O-N 2.74Å; N200-H203 PolarHBondContact O-N 3.35Å; N200-A204 WeakPolarHBondContact O-CB 3.4Å; N200-A204 PolarHBondContact O-N 3.43Å
201	D	95.8	Very high	94.8	Very high	80 Å²	80	54.1 Å²	54.1	43%	0.428	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-45.6	172.9	169.9	38.1	0	0	0	112	E197 H199 A204 Y205 K491	E197-D201 WeakPolarHBondContact O-CB 3.39Å; E197-D201 PolarHBondContact O-N 3.05Å; H199-D201 VanDerWaalsContact C-N 3.32Å; H199-D201 PolarHBondContact O-N 2.76Å; D201-A204 PolarHBondContact O-N 2.86Å; D201-Y205 WeakPolarHBondContact O-CB 3.28Å; D201-Y205 PolarHBondContact O-N 3.48Å; D201-K491 IonicContact OD1-NZ 2.73Å; D201-K491 PolarHBondContact OD1-NZ 3.1Å; D201-K491 IonicContact OD2-NZ 2.71Å; D201-K491 PolarHBondContact OD2-NZ 2.68Å
202	M	96.3	Very high	95.1	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-42.7	174.7	-170.3	65.6	77.1	0	0	112.1	E198 H199 A204 Y205 I206 V358 L487 E490 K491 L494	E198-M202 PolarHBondContact O-N 3.16Å; E198-M202 VanDerWaalsContact O-N 3.1Å; H199-M202 PolarHBondContact O-N 3.45Å; H199-M202 VanDerWaalsContact O-N 3.16Å; M202-A204 PolarHBondContact O-N 3.12Å; M202-Y205 WeakPolarHBondContact O-CB 3.23Å; M202-Y205 PolarHBondContact O-N 3.35Å; M202-I206 HydrophobicContact CG-CD1 4.02Å; M202-I206 WeakPolarHBondContact O-CG1 3.44Å; M202-I206 PolarHBondContact O-N 3.27Å; M202-V358 HydrophobicContact CB-CG1 4.17Å; M202-V358 HydrophobicContact CE-CG1 4.19Å; M202-V358 HydrophobicContact CG-CG1 3.98Å; M202-V358 VanDerWaalsContact CG-O 3.25Å; M202-V358 WeakPolarHBondContact CG-O 3.48Å; M202-L487 HydrophobicContact CE-CB 4.14Å; M202-L487 HydrophobicContact CE-CD2 3.83Å; M202-E490 HydrophobicContact CE-CB 4.41Å; M202-K491 HydrophobicContact CE-CG 3.94Å; M202-K491 HydrophobicContact SD-CG 3.86Å; M202-L494 HydrophobicContact SD-CD1 3.66Å
203	H	96.4	Very high	95.6	Very high	12 Å²	12	53.9 Å²	53.9	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-41.7	178.3	-62.1	155.6	0	0	0	111.9	H199 N200 Y205 I206 A207 F257 R262 S357 V358	H199-H203 WeakPolarHBondContact O-CB 3.25Å; H199-H203 PolarHBondContact O-N 3.02Å; H199-H203 PolarHBondContact O-ND1 2.7Å; N200-H203 PolarHBondContact O-N 3.35Å; H203-Y205 VanDerWaalsContact C-N 3.32Å; H203-Y205 PolarHBondContact O-N 2.77Å; H203-I206 PolarHBondContact O-N 3.39Å; H203-A207 WeakPolarHBondContact O-CB 3.44Å; H203-A207 PolarHBondContact O-N 2.85Å; H203-F257 HydrophobicContact CB-CE1 4.17Å; H203-F257 VanDerWaalsContact O-CZ 3.23Å; H203-F257 WeakPolarHBondContact O-CZ 3.43Å; H203-R262 PolarHBondContact CE1-NH1 3.17Å; H203-R262 VanDerWaalsContact CG-CZ 3.48Å; H203-R262 PolarHBondContact ND1-NH1 3.38Å; H203-R262 PolarHBondContact ND1-NH2 3.06Å; H203-S357 PolarHBondContact CE1-O 3.23Å; H203-S357 PolarHBondContact NE2-O 2.99Å; H203-V358 PolarHBondContact CD2-O 2.89Å; H203-V358 VanDerWaalsContact CD2-O 3.31Å; H203-V358 PolarHBondContact NE2-O 3.07Å
204	A	96.9	Very high	96.1	Very high	62 Å²	62	54.7 Å²	54.7	51%	0.512	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-38.6	173.6	0	0	0	0	0	112.1	N200 D201 M202 A207 Y208	N200-A204 WeakPolarHBondContact O-CB 3.4Å; N200-A204 PolarHBondContact O-N 3.43Å; D201-A204 PolarHBondContact O-N 2.86Å; M202-A204 PolarHBondContact O-N 3.12Å; A204-A207 PolarHBondContact O-N 2.77Å; A204-Y208 WeakPolarHBondContact O-CB 3.46Å; A204-Y208 PolarHBondContact O-N 2.85Å
205	Y	97.6	Very high	96.4	Very high	51 Å²	51	58.8 Å²	58.8	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-62.4	-47.7	175.8	-164.9	-92.2	0	0	0	112.2	D201 M202 H203 Y208 F209 K491 L494	D201-Y205 WeakPolarHBondContact O-CB 3.28Å; D201-Y205 PolarHBondContact O-N 3.48Å; M202-Y205 WeakPolarHBondContact O-CB 3.23Å; M202-Y205 PolarHBondContact O-N 3.35Å; H203-Y205 VanDerWaalsContact C-N 3.32Å; H203-Y205 PolarHBondContact O-N 2.77Å; Y205-Y208 PolarHBondContact O-N 3.08Å; Y205-F209 AromaticContact CD1-CD2 3.95Å; Y205-F209 HydrophobicContact CD1-CD2 3.95Å; Y205-F209 HydrophobicContact CD1-CE2 4.43Å; Y205-F209 HydrophobicContact CD2-CD2 4.29Å; Y205-F209 HydrophobicContact CD2-CE2 4.11Å; Y205-F209 AromaticContact CE1-CD2 3.64Å; Y205-F209 HydrophobicContact CE1-CD2 3.64Å; Y205-F209 AromaticContact CE1-CE2 3.88Å; Y205-F209 HydrophobicContact CE1-CE2 3.88Å; Y205-F209 HydrophobicContact CE2-CD2 4.03Å; Y205-F209 AromaticContact CE2-CE2 3.53Å; Y205-F209 HydrophobicContact CE2-CE2 3.53Å; Y205-F209 HydrophobicContact CG-CD2 4.25Å; Y205-F209 AromaticContact CZ-CD2 3.68Å; Y205-F209 AromaticContact CZ-CE2 3.38Å; Y205-F209 PolarHBondContact O-N 2.87Å; Y205-K491 HydrophobicContact CD1-CG 4.03Å; Y205-K491 HydrophobicContact CD2-CD 4.1Å; Y205-K491 HydrophobicContact CD2-CG 4.31Å; Y205-K491 HydrophobicContact CE1-CB 4.11Å; Y205-K491 HydrophobicContact CE1-CG 4.07Å; Y205-K491 HydrophobicContact CE2-CD 4.23Å; Y205-K491 HydrophobicContact CE2-CG 4.33Å; Y205-K491 HydrophobicContact CG-CD 4.33Å; Y205-K491 HydrophobicContact CG-CG 4.16Å; Y205-K491 PolarHBondContact OH-O 3.45Å; Y205-L494 HydrophobicContact CD1-CB 4.5Å; Y205-L494 HydrophobicContact CD1-CD1 4.41Å; Y205-L494 HydrophobicContact CE1-CB 4.16Å
206	I	97.8	Very high	96.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-42.4	177.2	-66.1	168.6	0	0	0	110.8	M202 H203 Y208 G210 W253 F257 S359 L494	M202-I206 HydrophobicContact CG-CD1 4.02Å; M202-I206 WeakPolarHBondContact O-CG1 3.44Å; M202-I206 PolarHBondContact O-N 3.27Å; H203-I206 PolarHBondContact O-N 3.39Å; I206-Y208 PolarHBondContact O-N 2.82Å; I206-G210 WeakPolarHBondContact O-CA 3.43Å; I206-G210 PolarHBondContact O-N 3.47Å; I206-W253 HydrophobicContact CD1-CE3 4.27Å; I206-W253 HydrophobicContact CD1-CZ3 4.03Å; I206-W253 HydrophobicContact CG2-CB 4.4Å; I206-W253 HydrophobicContact CG2-CE3 4Å; I206-F257 HydrophobicContact CB-CZ 4.35Å; I206-F257 HydrophobicContact CG2-CE2 4.11Å; I206-F257 HydrophobicContact CG2-CZ 4.24Å; I206-S359 VanDerWaalsContact CD1-O 3.27Å; I206-S359 WeakPolarHBondContact CD1-O 3.26Å; I206-L494 HydrophobicContact CD1-CD1 4.15Å; I206-L494 HydrophobicContact CG1-CD1 3.82Å
207	A	97.6	Very high	97	Very high	29 Å²	29	48.7 Å²	48.7	24%	0.24	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-45.3	176.4	0	0	0	0	0	111.9	H203 A204 T211 F257	H203-A207 WeakPolarHBondContact O-CB 3.44Å; H203-A207 PolarHBondContact O-N 2.85Å; A204-A207 PolarHBondContact O-N 2.77Å; A207-T211 WeakPolarHBondContact O-CB 3.28Å; A207-T211 PolarHBondContact O-N 3.46Å; A207-T211 PolarHBondContact O-OG1 2.88Å; A207-F257 HydrophobicContact CB-CE1 3.97Å; A207-F257 HydrophobicContact CB-CE2 4.03Å; A207-F257 HydrophobicContact CB-CZ 3.72Å
208	Y	97.4	Very high	97.1	Very high	143 Å²	143	46.4 Å²	46.4	56%	0.561	24%	0.241	S	C	*	.	H	α-helix	trans	-64.4	-57.7	179.5	178.7	-96.3	0	0	0	112.2	A204 Y205 I206 T211 I212	A204-Y208 WeakPolarHBondContact O-CB 3.46Å; A204-Y208 PolarHBondContact O-N 2.85Å; Y205-Y208 PolarHBondContact O-N 3.08Å; I206-Y208 PolarHBondContact O-N 2.82Å; Y208-T211 PolarHBondContact O-N 2.86Å; Y208-I212 HydrophobicContact CD1-CD1 3.97Å; Y208-I212 HydrophobicContact CD2-CD1 4.14Å; Y208-I212 HydrophobicContact CE1-CD1 3.53Å; Y208-I212 HydrophobicContact CE2-CD1 3.72Å; Y208-I212 HydrophobicContact CG-CD1 4.26Å; Y208-I212 WeakPolarHBondContact O-CG1 3.33Å; Y208-I212 PolarHBondContact O-N 3.12Å; Y208-I212 VanDerWaalsContact O-N 3.12Å
209	F	97.7	Very high	97.2	Very high	32 Å²	32	48.1 Å²	48.1	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-70.5	-36.3	-176.6	-80.1	-77.9	0	0	0	112.9	Y205 T213 F495 F498 I502	Y205-F209 AromaticContact CD1-CD2 3.95Å; Y205-F209 HydrophobicContact CD1-CD2 3.95Å; Y205-F209 HydrophobicContact CD1-CE2 4.43Å; Y205-F209 HydrophobicContact CD2-CD2 4.29Å; Y205-F209 HydrophobicContact CD2-CE2 4.11Å; Y205-F209 AromaticContact CE1-CD2 3.64Å; Y205-F209 HydrophobicContact CE1-CD2 3.64Å; Y205-F209 AromaticContact CE1-CE2 3.88Å; Y205-F209 HydrophobicContact CE1-CE2 3.88Å; Y205-F209 HydrophobicContact CE2-CD2 4.03Å; Y205-F209 AromaticContact CE2-CE2 3.53Å; Y205-F209 HydrophobicContact CE2-CE2 3.53Å; Y205-F209 HydrophobicContact CG-CD2 4.25Å; Y205-F209 AromaticContact CZ-CD2 3.68Å; Y205-F209 AromaticContact CZ-CE2 3.38Å; Y205-F209 PolarHBondContact O-N 2.87Å; F209-T213 WeakPolarHBondContact O-CB 3.38Å; F209-T213 PolarHBondContact O-N 3.02Å; F209-T213 PolarHBondContact O-OG1 2.73Å; F209-F495 AromaticContact CE1-CD2 3.81Å; F209-F495 HydrophobicContact CE1-CD2 3.81Å; F209-F495 HydrophobicContact CE1-CE2 4.16Å; F209-F495 AromaticContact CZ-CD2 3.92Å; F209-F495 HydrophobicContact CZ-CD2 3.92Å; F209-F495 HydrophobicContact CZ-CE2 4.39Å; F209-F498 HydrophobicContact CB-CB 3.96Å; F209-F498 HydrophobicContact CB-CD2 3.53Å; F209-F498 HydrophobicContact CB-CE2 4.21Å; F209-F498 HydrophobicContact CB-CG 3.86Å; F209-I502 HydrophobicContact CD1-CD1 4.46Å
210	G	97.7	Very high	97.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-47.2	173.8	0	0	0	0	0	112.1	I206 T213 L214	I206-G210 WeakPolarHBondContact O-CA 3.43Å; I206-G210 PolarHBondContact O-N 3.47Å; G210-T213 PolarHBondContact O-N 2.92Å; G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.32Å
211	T	98.1	Very high	97.4	Very high	63 Å²	63	43.4 Å²	43.4	39%	0.387	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-43.7	179.8	-59.5	0	0	0	0	111.9	A207 Y208 L214 L215	A207-T211 WeakPolarHBondContact O-CB 3.28Å; A207-T211 PolarHBondContact O-N 3.46Å; A207-T211 PolarHBondContact O-OG1 2.88Å; Y208-T211 PolarHBondContact O-N 2.86Å; T211-L214 PolarHBondContact O-N 2.93Å; T211-L215 HydrophobicContact CG2-CD1 4.01Å; T211-L215 HydrophobicContact CG2-CG 4.48Å; T211-L215 WeakPolarHBondContact O-CG 3.42Å; T211-L215 PolarHBondContact O-N 3.08Å
212	I	98.1	Very high	97.4	Very high	56 Å²	56	40.5 Å²	40.5	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-62.5	-45.5	176.7	-67.8	170.1	0	0	0	110.4	Y208 L214 L215 C216 I502	Y208-I212 HydrophobicContact CD1-CD1 3.97Å; Y208-I212 HydrophobicContact CD2-CD1 4.14Å; Y208-I212 HydrophobicContact CE1-CD1 3.53Å; Y208-I212 HydrophobicContact CE2-CD1 3.72Å; Y208-I212 HydrophobicContact CG-CD1 4.26Å; Y208-I212 WeakPolarHBondContact O-CG1 3.33Å; Y208-I212 PolarHBondContact O-N 3.12Å; Y208-I212 VanDerWaalsContact O-N 3.12Å; I212-L214 PolarHBondContact O-N 3.47Å; I212-L215 PolarHBondContact O-N 3.33Å; I212-C216 VanDerWaalsContact O-CB 3.32Å; I212-C216 WeakPolarHBondContact O-CB 3.31Å; I212-C216 PolarHBondContact O-N 2.75Å; I212-C216 PolarHBondContact O-SG 2.52Å; I212-I502 HydrophobicContact CB-CD1 4.44Å; I212-I502 HydrophobicContact CG2-CD1 3.74Å; I212-I502 HydrophobicContact CG2-CG1 4.16Å
213	T	98.3	Very high	97.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-43.6	178.8	-52.6	0	0	0	0	111.4	F209 G210 C216 T217 S250 F498 I502	F209-T213 WeakPolarHBondContact O-CB 3.38Å; F209-T213 PolarHBondContact O-N 3.02Å; F209-T213 PolarHBondContact O-OG1 2.73Å; G210-T213 PolarHBondContact O-N 2.92Å; T213-C216 PolarHBondContact O-N 2.71Å; T213-T217 HydrophobicContact CG2-CG2 4.13Å; T213-T217 WeakPolarHBondContact O-CB 3.31Å; T213-T217 VanDerWaalsContact O-CG2 3.27Å; T213-T217 WeakPolarHBondContact O-CG2 3.46Å; T213-T217 PolarHBondContact O-N 3.37Å; T213-T217 PolarHBondContact O-OG1 2.93Å; T213-S250 WeakPolarHBondContact CG2-OG 3.37Å; T213-F498 HydrophobicContact CG2-CD1 4.25Å; T213-F498 WeakPolarHBondContact OG1-CB 3.43Å; T213-F498 WeakPolarHBondContact OG1-CD1 3.48Å; T213-F498 PolarHBondContact OG1-O 3.14Å; T213-I502 HydrophobicContact CG2-CG1 4.45Å
214	L	98.3	Very high	97.1	Very high	41 Å²	41	40 Å²	40	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-49	176.5	-171.3	78.2	0	0	0	111.5	G210 T211 I212 T217 F218 F247 I251 L254	G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.32Å; T211-L214 PolarHBondContact O-N 2.93Å; I212-L214 PolarHBondContact O-N 3.47Å; L214-T217 PolarHBondContact O-OG1 3.1Å; L214-T217 VanDerWaalsContact O-OG1 3.14Å; L214-F218 WeakPolarHBondContact O-CB 3.32Å; L214-F218 PolarHBondContact O-N 2.98Å; L214-F247 HydrophobicContact CD1-CD2 3.59Å; L214-F247 HydrophobicContact CD1-CE2 3.51Å; L214-F247 HydrophobicContact CD1-CG 4.47Å; L214-F247 HydrophobicContact CD1-CZ 4.37Å; L214-F247 HydrophobicContact CG-CD2 4.28Å; L214-F247 HydrophobicContact CG-CE2 4.05Å; L214-I251 HydrophobicContact CD1-CD1 4.41Å; L214-I251 HydrophobicContact CD1-CG1 3.58Å; L214-L254 HydrophobicContact CB-CD1 4.12Å; L214-L254 HydrophobicContact CD2-CD1 3.86Å; L214-L254 HydrophobicContact CG-CD1 4.45Å
215	L	98.2	Very high	97	Very high	108 Å²	108	42 Å²	42	57%	0.565	21%	0.21	S	C	*	.	H	α-helix	trans	-66.7	-42.9	-179.2	-69.2	172.8	0	0	0	112.4	T211 I212 F219	T211-L215 HydrophobicContact CG2-CD1 4.01Å; T211-L215 HydrophobicContact CG2-CG 4.48Å; T211-L215 WeakPolarHBondContact O-CG 3.42Å; T211-L215 PolarHBondContact O-N 3.08Å; I212-L215 PolarHBondContact O-N 3.33Å; L215-F219 WeakPolarHBondContact O-CB 3.07Å; L215-F219 PolarHBondContact O-N 2.93Å
216	C	98	Very high	96.6	Very high	22 Å²	22	41 Å²	41	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-68.4	-42	179.7	-71.4	0	0	0	0	112.6	I212 T213 T220 S505	I212-C216 VanDerWaalsContact O-CB 3.32Å; I212-C216 WeakPolarHBondContact O-CB 3.31Å; I212-C216 PolarHBondContact O-N 2.75Å; I212-C216 PolarHBondContact O-SG 2.52Å; T213-C216 PolarHBondContact O-N 2.71Å; C216-T220 PolarHBondContact O-N 3.27Å; C216-T220 VanDerWaalsContact O-N 3.16Å; C216-T220 PolarHBondContact O-OG1 3.45Å; C216-S505 WeakPolarHBondContact CB-OG 3.16Å; C216-S505 WeakPolarHBondContact O-CB 3.35Å
217	T	97.8	Very high	96.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69	-42.5	174.9	55	0	0	0	0	111.3	T213 L214 F219 T220 L221 N243 F246 F247	T213-T217 HydrophobicContact CG2-CG2 4.13Å; T213-T217 WeakPolarHBondContact O-CB 3.31Å; T213-T217 VanDerWaalsContact O-CG2 3.27Å; T213-T217 WeakPolarHBondContact O-CG2 3.46Å; T213-T217 PolarHBondContact O-N 3.37Å; T213-T217 PolarHBondContact O-OG1 2.93Å; L214-T217 PolarHBondContact O-OG1 3.1Å; L214-T217 VanDerWaalsContact O-OG1 3.14Å; T217-F219 PolarHBondContact O-N 2.66Å; T217-T220 WeakPolarHBondContact O-CA 3.39Å; T217-T220 VanDerWaalsContact O-CB 3.3Å; T217-T220 WeakPolarHBondContact O-CB 3.29Å; T217-T220 PolarHBondContact O-N 3.25Å; T217-L221 WeakPolarHBondContact O-CG 3.49Å; T217-L221 PolarHBondContact O-N 2.91Å; T217-N243 HydrophobicContact CG2-CB 4.49Å; T217-F246 HydrophobicContact CG2-CB 3.82Å; T217-F247 WeakPolarHBondContact OG1-CA 3.19Å
218	F	97.9	Very high	95.7	Very high	116 Å²	116	44.7 Å²	44.7	51%	0.509	22%	0.222	S	C	.	.	H	α-helix	trans	-57	-48.6	174	177.5	-103.4	0	0	0	112.6	L214 T220 L221 A222 F247	L214-F218 WeakPolarHBondContact O-CB 3.32Å; L214-F218 PolarHBondContact O-N 2.98Å; F218-T220 PolarHBondContact O-N 2.8Å; F218-L221 PolarHBondContact O-N 3.3Å; F218-A222 WeakPolarHBondContact O-CB 3.44Å; F218-A222 PolarHBondContact O-N 2.96Å; F218-F247 HydrophobicContact CB-CD2 4.07Å; F218-F247 HydrophobicContact CB-CE2 3.79Å; F218-F247 AromaticContact CD2-CE2 3.95Å; F218-F247 HydrophobicContact CD2-CE2 3.95Å; F218-F247 HydrophobicContact CD2-CZ 4.13Å; F218-F247 HydrophobicContact CG-CE2 4.31Å
219	F	96.9	Very high	95.1	Very high	75 Å²	75	48 Å²	48	33%	0.329	24%	0.239	S	C	.	.	H	α-helix	trans	-57.9	-35.6	175.1	173.7	-105	0	0	0	112.1	L215 T217 T223 V508 T513 W517	L215-F219 WeakPolarHBondContact O-CB 3.07Å; L215-F219 PolarHBondContact O-N 2.93Å; T217-F219 PolarHBondContact O-N 2.66Å; F219-T223 VanDerWaalsContact O-CB 3.31Å; F219-T223 WeakPolarHBondContact O-CB 3.41Å; F219-T223 PolarHBondContact O-N 2.96Å; F219-T223 PolarHBondContact O-OG1 3.45Å; F219-V508 HydrophobicContact CD1-CG2 4.05Å; F219-V508 HydrophobicContact CE1-CG2 3.9Å; F219-T513 HydrophobicContact CE1-CG2 4.19Å; F219-T513 HydrophobicContact CZ-CG2 3.73Å; F219-W517 HydrophobicContact CD2-CZ2 4.31Å; F219-W517 AromaticContact CE2-CE2 3.89Å; F219-W517 HydrophobicContact CE2-CZ2 4.25Å; F219-W517 AromaticContact CE2-NE1 3.42Å; F219-W517 AromaticContact CZ-NE1 3.85Å
220	T	95.8	Very high	94.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68	-50.5	176.7	-58.9	0	0	0	0	111.7	C216 T217 F218 A222 T223 F224 N243 S505 V508	C216-T220 PolarHBondContact O-N 3.27Å; C216-T220 VanDerWaalsContact O-N 3.16Å; C216-T220 PolarHBondContact O-OG1 3.45Å; T217-T220 WeakPolarHBondContact O-CA 3.39Å; T217-T220 VanDerWaalsContact O-CB 3.3Å; T217-T220 WeakPolarHBondContact O-CB 3.29Å; T217-T220 PolarHBondContact O-N 3.25Å; F218-T220 PolarHBondContact O-N 2.8Å; T220-A222 PolarHBondContact O-N 3.15Å; T220-T223 WeakPolarHBondContact O-CB 3.36Å; T220-T223 PolarHBondContact O-N 3.33Å; T220-F224 HydrophobicContact CG2-CD2 3.85Å; T220-F224 HydrophobicContact CG2-CE2 3.89Å; T220-F224 WeakPolarHBondContact O-CD2 3.47Å; T220-F224 PolarHBondContact O-N 3.45Å; T220-N243 HydrophobicContact CG2-CB 4Å; T220-N243 VanDerWaalsContact CG2-CG 3.48Å; T220-S505 WeakPolarHBondContact OG1-CA 3.34Å; T220-S505 WeakPolarHBondContact OG1-CB 3.35Å; T220-S505 PolarHBondContact OG1-O 3.16Å; T220-V508 HydrophobicContact CG2-CG1 3.89Å; T220-V508 HydrophobicContact CG2-CG2 4.06Å
221	L	96.8	Very high	93.7	Very high	19 Å²	19	48.9 Å²	48.9	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-48.4	175.8	-64.3	174	0	0	0	111.6	T217 F218 T223 F224 L225 F240 N243 A244 F247	T217-L221 WeakPolarHBondContact O-CG 3.49Å; T217-L221 PolarHBondContact O-N 2.91Å; F218-L221 PolarHBondContact O-N 3.3Å; L221-T223 VanDerWaalsContact C-N 3.3Å; L221-T223 PolarHBondContact O-N 3.2Å; L221-F224 PolarHBondContact O-N 3.47Å; L221-L225 WeakPolarHBondContact O-CB 3.46Å; L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.38Å; L221-F240 HydrophobicContact CB-CE2 4.37Å; L221-F240 HydrophobicContact CD2-CD2 3.54Å; L221-F240 HydrophobicContact CD2-CE2 3.46Å; L221-F240 VanDerWaalsContact CD2-CE2 3.46Å; L221-F240 HydrophobicContact CD2-CG 4.35Å; L221-F240 HydrophobicContact CD2-CZ 4.2Å; L221-N243 HydrophobicContact CD2-CB 4.28Å; L221-A244 HydrophobicContact CD2-CB 3.9Å; L221-F247 HydrophobicContact CD1-CB 3.74Å; L221-F247 HydrophobicContact CD1-CD1 3.82Å; L221-F247 HydrophobicContact CD1-CD2 4.35Å; L221-F247 HydrophobicContact CD1-CG 3.71Å
222	A	95.8	Very high	93	Very high	20 Å²	20	49.4 Å²	49.4	17%	0.165	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-38	177.1	0	0	0	0	0	112.5	F218 T220 A226 W517	F218-A222 WeakPolarHBondContact O-CB 3.44Å; F218-A222 PolarHBondContact O-N 2.96Å; T220-A222 PolarHBondContact O-N 3.15Å; A222-A226 VanDerWaalsContact O-CB 3.26Å; A222-A226 WeakPolarHBondContact O-CB 3.48Å; A222-A226 PolarHBondContact O-N 2.87Å; A222-W517 HydrophobicContact CB-CH2 4.08Å; A222-W517 HydrophobicContact CB-CZ2 3.88Å
223	T	94.2	Very high	92.3	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-45.3	175.5	-61.8	0	0	0	0	112.1	F219 T220 L221 A226 D227 V508 T513 W517	F219-T223 VanDerWaalsContact O-CB 3.31Å; F219-T223 WeakPolarHBondContact O-CB 3.41Å; F219-T223 PolarHBondContact O-N 2.96Å; F219-T223 PolarHBondContact O-OG1 3.45Å; T220-T223 WeakPolarHBondContact O-CB 3.36Å; T220-T223 PolarHBondContact O-N 3.33Å; L221-T223 VanDerWaalsContact C-N 3.3Å; L221-T223 PolarHBondContact O-N 3.2Å; T223-A226 PolarHBondContact O-N 3.28Å; T223-D227 PolarHBondContact O-N 3.06Å; T223-V508 HydrophobicContact CG2-CB 4.04Å; T223-V508 HydrophobicContact CG2-CG1 4.13Å; T223-V508 HydrophobicContact CG2-CG2 4.45Å; T223-T513 HydrophobicContact CG2-CG2 3.64Å; T223-W517 PolarHBondContact OG1-NE1 3.4Å
224	F	93.1	Very high	91.6	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-41.6	176.4	-92.7	-82.8	0	0	0	112	T220 L221 D227 W228 L239 F240 W507 V508	T220-F224 HydrophobicContact CG2-CD2 3.85Å; T220-F224 HydrophobicContact CG2-CE2 3.89Å; T220-F224 WeakPolarHBondContact O-CD2 3.47Å; T220-F224 PolarHBondContact O-N 3.45Å; L221-F224 PolarHBondContact O-N 3.47Å; F224-D227 CarbonylContact O-C 3.58Å; F224-D227 PolarHBondContact O-N 2.03Å; F224-W228 VanDerWaalsContact O-CA 3.24Å; F224-W228 WeakPolarHBondContact O-CA 3.35Å; F224-W228 PolarHBondContact O-N 3.3Å; F224-L239 HydrophobicContact CZ-CB 4.32Å; F224-F240 HydrophobicContact CB-CB 4.43Å; F224-F240 HydrophobicContact CB-CD2 3.51Å; F224-F240 HydrophobicContact CB-CE2 4.17Å; F224-F240 HydrophobicContact CB-CG 4.31Å; F224-F240 HydrophobicContact CD1-CB 3.92Å; F224-F240 HydrophobicContact CD2-CB 4.12Å; F224-F240 HydrophobicContact CD2-CD2 4.32Å; F224-F240 HydrophobicContact CE1-CB 4.13Å; F224-F240 HydrophobicContact CE2-CB 4.32Å; F224-F240 HydrophobicContact CG-CB 3.92Å; F224-F240 AromaticContact CG-CD2 3.92Å; F224-F240 HydrophobicContact CG-CD2 3.92Å; F224-F240 HydrophobicContact CG-CG 4.34Å; F224-F240 HydrophobicContact CZ-CB 4.32Å; F224-W507 AromaticContact CZ-CD1 3.87Å; F224-V508 HydrophobicContact CD2-CG1 3.94Å; F224-V508 HydrophobicContact CE2-CG1 3.69Å
225	L	93.3	Very high	90.7	Very high	104 Å²	104	53.5 Å²	53.5	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-66.7	-39.3	177.1	-69.3	169.3	0	0	0	112.1	L221 D227 W228 F240	L221-L225 WeakPolarHBondContact O-CB 3.46Å; L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.49Å; L221-L225 PolarHBondContact O-N 3.38Å; L225-D227 PolarHBondContact O-N 2.86Å; L225-W228 HydrophobicContact CD2-CE3 4.39Å; L225-W228 WeakPolarHBondContact O-CB 3.37Å; L225-W228 PolarHBondContact O-N 2.97Å; L225-F240 HydrophobicContact CD2-CE2 4.32Å; L225-F240 HydrophobicContact CD2-CZ 4.29Å; L225-F240 HydrophobicContact CG-CE2 4.18Å
226	A	90.2	Very high	90	Very high	29 Å²	29	48.9 Å²	48.9	24%	0.24	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-24.3	178.6	0	0	0	0	0	114.2	A222 T223 I516	A222-A226 VanDerWaalsContact O-CB 3.26Å; A222-A226 WeakPolarHBondContact O-CB 3.48Å; A222-A226 PolarHBondContact O-N 2.87Å; T223-A226 PolarHBondContact O-N 3.28Å; A226-I516 HydrophobicContact CB-CG2 3.95Å
227	D	88.9	Confident	89.6	Confident	23 Å²	23	47.9 Å²	47.9	12%	0.123	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	27.3	177.3	-155.9	60	0	0	0	112.1	T223 F224 L225 K229 N230 S231 I516 R519	T223-D227 PolarHBondContact O-N 3.06Å; F224-D227 CarbonylContact O-C 3.58Å; F224-D227 PolarHBondContact O-N 2.03Å; L225-D227 PolarHBondContact O-N 2.86Å; D227-K229 VanDerWaalsContact C-N 3.31Å; D227-K229 PolarHBondContact O-N 3.11Å; D227-K229 VanDerWaalsContact O-N 3.15Å; D227-N230 PolarHBondContact O-N 2.97Å; D227-N230 WeakPolarHBondContact OD2-CB 3.5Å; D227-N230 PolarHBondContact OD2-ND2 3.07Å; D227-S231 PolarHBondContact O-N 3.2Å; D227-S231 PolarHBondContact O-OG 3.45Å; D227-I516 HydrophobicContact CB-CD1 3.86Å; D227-I516 HydrophobicContact CB-CG1 4.1Å; D227-I516 HydrophobicContact CB-CG2 3.99Å; D227-R519 IonicContact OD1-NH1 2.66Å; D227-R519 PolarHBondContact OD1-NH1 2.93Å
228	W	88.4	Confident	89.3	Confident	84 Å²	84	47.9 Å²	47.9	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-52	-42.2	-169.8	-175.9	-110	0	0	0	114.1	F224 L225 N230 S231 N232 V237 F240	F224-W228 VanDerWaalsContact O-CA 3.24Å; F224-W228 WeakPolarHBondContact O-CA 3.35Å; F224-W228 PolarHBondContact O-N 3.3Å; L225-W228 HydrophobicContact CD2-CE3 4.39Å; L225-W228 WeakPolarHBondContact O-CB 3.37Å; L225-W228 PolarHBondContact O-N 2.97Å; W228-N230 PolarHBondContact O-N 3.04Å; W228-S231 PolarHBondContact O-N 2.94Å; W228-N232 HydrophobicContact CD2-CB 3.89Å; W228-N232 HydrophobicContact CE3-CB 4.25Å; W228-N232 HydrophobicContact CG-CB 4.38Å; W228-N232 HydrophobicContact CH2-CB 4.2Å; W228-N232 HydrophobicContact CZ2-CB 3.85Å; W228-N232 VanDerWaalsContact CZ2-CG 3.41Å; W228-N232 HydrophobicContact CZ3-CB 4.4Å; W228-N232 WeakPolarHBondContact O-CB 3.26Å; W228-N232 PolarHBondContact O-N 3.07Å; W228-V237 HydrophobicContact CH2-CG2 4.1Å; W228-V237 HydrophobicContact CZ3-CG2 4.33Å; W228-F240 HydrophobicContact CH2-CD1 4.23Å; W228-F240 HydrophobicContact CH2-CE1 4.05Å; W228-F240 AromaticContact CZ3-CD1 3.94Å; W228-F240 HydrophobicContact CZ3-CD1 3.94Å; W228-F240 HydrophobicContact CZ3-CD2 4.43Å; W228-F240 AromaticContact CZ3-CE1 3.88Å; W228-F240 HydrophobicContact CZ3-CE1 3.88Å; W228-F240 HydrophobicContact CZ3-CE2 4.36Å; W228-F240 HydrophobicContact CZ3-CG 4.22Å; W228-F240 HydrophobicContact CZ3-CZ 4.1Å
229	K	84.8	Confident	89	Confident	211 Å²	211	42.3 Å²	42.3	92%	0.917	20%	0.203	S	C	*	.	H	α-helix	trans	-60.1	-18.7	179.4	-65.8	-162.3	175.6	-162.6	0	114.6	D227	D227-K229 VanDerWaalsContact C-N 3.31Å; D227-K229 PolarHBondContact O-N 3.11Å; D227-K229 VanDerWaalsContact O-N 3.15Å
230	N	80.7	Confident	88.9	Confident	49 Å²	49	40 Å²	40	26%	0.262	19%	0.193	S	C	.	.	H	α-helix	trans	-111.5	-32.8	177.9	172.6	68.1	0	0	0	111.6	D227 W228 R233	D227-N230 PolarHBondContact O-N 2.97Å; D227-N230 WeakPolarHBondContact OD2-CB 3.5Å; D227-N230 PolarHBondContact OD2-ND2 3.07Å; W228-N230 PolarHBondContact O-N 3.04Å; N230-R233 WeakPolarHBondContact O-CD 2.99Å
231	S	83.8	Confident	89	Confident	2 Å²	2	42 Å²	42	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-87.4	-16.6	-176.2	-58	0	0	0	0	114.6	D227 W228 R233	D227-S231 PolarHBondContact O-N 3.2Å; D227-S231 PolarHBondContact O-OG 3.45Å; W228-S231 PolarHBondContact O-N 2.94Å; S231-R233 PolarHBondContact O-N 3.29Å
232	N	84.3	Confident	89	Confident	75 Å²	75	41.3 Å²	41.3	40%	0.401	20%	0.197	S	C	.	.			trans	-75.7	59.9	173.3	-173.7	26.3	0	0	0	111.7	W228	W228-N232 HydrophobicContact CD2-CB 3.89Å; W228-N232 HydrophobicContact CE3-CB 4.25Å; W228-N232 HydrophobicContact CG-CB 4.38Å; W228-N232 HydrophobicContact CH2-CB 4.2Å; W228-N232 HydrophobicContact CZ2-CB 3.85Å; W228-N232 VanDerWaalsContact CZ2-CG 3.41Å; W228-N232 HydrophobicContact CZ3-CB 4.4Å; W228-N232 WeakPolarHBondContact O-CB 3.26Å; W228-N232 PolarHBondContact O-N 3.07Å
233	R	83.7	Confident	89	Confident	116 Å²	116	40.3 Å²	40.3	44%	0.438	19%	0.189	S	C	.	.			trans	-133.9	137.5	179.6	-68.2	-179.4	173.5	-165.9	-7.1	109.3	N230 S231 A236 V237	N230-R233 WeakPolarHBondContact O-CD 2.99Å; S231-R233 PolarHBondContact O-N 3.29Å; R233-A236 PolarHBondContact O-N 3.07Å; R233-V237 PolarHBondContact O-N 3.28Å
234	Y	82.4	Confident	89.2	Confident	53 Å²	53	41.4 Å²	41.4	21%	0.208	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	143.4	170.1	-75.7	-91.6	0	0	0	110.2	V237 I238 T329 F332 H333	Y234-V237 HydrophobicContact CD1-CG1 3.84Å; Y234-V237 HydrophobicContact CD2-CG1 3.69Å; Y234-V237 HydrophobicContact CE1-CG1 3.7Å; Y234-V237 HydrophobicContact CE2-CG1 3.56Å; Y234-V237 HydrophobicContact CG-CG1 3.84Å; Y234-I238 HydrophobicContact CD1-CD1 4.02Å; Y234-I238 HydrophobicContact CD1-CG1 3.85Å; Y234-I238 HydrophobicContact CE1-CD1 4.26Å; Y234-I238 HydrophobicContact CE1-CG1 3.77Å; Y234-T329 HydrophobicContact CD2-CG2 3.44Å; Y234-T329 VanDerWaalsContact CD2-CG2 3.44Å; Y234-T329 HydrophobicContact CE2-CG2 3.25Å; Y234-T329 HydrophobicContact CG-CG2 4.2Å; Y234-F332 HydrophobicContact CD1-CD2 4.29Å; Y234-F332 HydrophobicContact CD1-CE2 4.36Å; Y234-F332 AromaticContact CE1-CD2 3.82Å; Y234-F332 HydrophobicContact CE1-CD2 3.82Å; Y234-F332 HydrophobicContact CE1-CE2 4.35Å; Y234-H333 PolarHBondContact OH-CD2 3.35Å; Y234-H333 VanDerWaalsContact OH-CD2 3.32Å; Y234-H333 PolarHBondContact OH-NE2 3.31Å
235	P	80.3	Confident	89.4	Confident	13 Å²	13	41.6 Å²	41.6	8%	0.084	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	cis	-84.2	-10.9	3	34.9	-36.6	0	0	0	114.7	V237 I238 A310 L325 L424 I575	P235-V237 VanDerWaalsContact C-N 3.31Å; P235-V237 PolarHBondContact O-N 3.35Å; P235-I238 HydrophobicContact CB-CD1 4.5Å; P235-I238 WeakPolarHBondContact O-CB 3.41Å; P235-I238 WeakPolarHBondContact O-CG1 3.47Å; P235-I238 PolarHBondContact O-N 2.96Å; P235-A310 HydrophobicContact CB-CB 4Å; P235-L325 HydrophobicContact CB-CD1 4.35Å; P235-L424 HydrophobicContact CB-CD2 4.27Å; P235-L424 HydrophobicContact CG-CD2 3.84Å; P235-I575 HydrophobicContact CG-CD1 4.45Å
236	A	83.1	Confident	89.7	Confident	12 Å²	12	38 Å²	38	10%	0.099	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35.1	-169.4	0	0	0	0	0	114.4	R233 I238 L239	R233-A236 PolarHBondContact O-N 3.07Å; A236-I238 PolarHBondContact O-N 2.03Å; A236-L239 WeakPolarHBondContact O-CB 3.25Å; A236-L239 PolarHBondContact O-N 2.82Å; A236-L239 VanDerWaalsContact O-N 3.08Å
237	V	89.9	Confident	90.1	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-19.5	178	74.7	0	0	0	0	113.8	W228 R233 Y234 P235 L239 F240 Y241	W228-V237 HydrophobicContact CH2-CG2 4.1Å; W228-V237 HydrophobicContact CZ3-CG2 4.33Å; R233-V237 PolarHBondContact O-N 3.28Å; Y234-V237 HydrophobicContact CD1-CG1 3.84Å; Y234-V237 HydrophobicContact CD2-CG1 3.69Å; Y234-V237 HydrophobicContact CE1-CG1 3.7Å; Y234-V237 HydrophobicContact CE2-CG1 3.56Å; Y234-V237 HydrophobicContact CG-CG1 3.84Å; P235-V237 VanDerWaalsContact C-N 3.31Å; P235-V237 PolarHBondContact O-N 3.35Å; V237-L239 VanDerWaalsContact C-N 3.25Å; V237-L239 PolarHBondContact O-N 3.49Å; V237-F240 HydrophobicContact CG2-CB 4.47Å; V237-F240 HydrophobicContact CG2-CD1 4.5Å; V237-F240 WeakPolarHBondContact O-CB 3.22Å; V237-F240 PolarHBondContact O-N 3.27Å; V237-F240 VanDerWaalsContact O-N 3.15Å; V237-Y241 HydrophobicContact CG1-CE2 4.44Å; V237-Y241 HydrophobicContact CG2-CD2 4.4Å; V237-Y241 HydrophobicContact CG2-CE2 3.74Å; V237-Y241 VanDerWaalsContact O-CD2 3.26Å; V237-Y241 WeakPolarHBondContact O-CD2 3.06Å; V237-Y241 PolarHBondContact O-N 2.97Å
238	I	92.2	Very high	90.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-38.8	172.5	-63.8	171.7	0	0	0	110.6	Y234 P235 A236 F240 Y241 I242 W303 L307 A310 F332	Y234-I238 HydrophobicContact CD1-CD1 4.02Å; Y234-I238 HydrophobicContact CD1-CG1 3.85Å; Y234-I238 HydrophobicContact CE1-CD1 4.26Å; Y234-I238 HydrophobicContact CE1-CG1 3.77Å; P235-I238 HydrophobicContact CB-CD1 4.5Å; P235-I238 WeakPolarHBondContact O-CB 3.41Å; P235-I238 WeakPolarHBondContact O-CG1 3.47Å; P235-I238 PolarHBondContact O-N 2.96Å; A236-I238 PolarHBondContact O-N 2.03Å; I238-F240 VanDerWaalsContact C-N 3.28Å; I238-F240 PolarHBondContact O-N 3.42Å; I238-Y241 PolarHBondContact O-N 3.21Å; I238-I242 HydrophobicContact CG2-CD1 3.88Å; I238-I242 HydrophobicContact CG2-CG1 4.38Å; I238-I242 WeakPolarHBondContact O-CG1 3.39Å; I238-I242 PolarHBondContact O-N 3.37Å; I238-W303 HydrophobicContact CG1-CE3 4.45Å; I238-W303 HydrophobicContact CG1-CZ3 4.21Å; I238-W303 HydrophobicContact CG2-CE3 3.94Å; I238-L307 HydrophobicContact CB-CD1 4.3Å; I238-L307 HydrophobicContact CG2-CB 3.92Å; I238-L307 HydrophobicContact CG2-CD1 3.93Å; I238-A310 HydrophobicContact CD1-CB 3.56Å; I238-F332 HydrophobicContact CD1-CE2 4.48Å
239	L	91.4	Very high	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-26.8	179.2	-65.7	168.2	0	0	0	112.3	F224 A236 V237 I242 N243 L307 L424 M504 W507	F224-L239 HydrophobicContact CZ-CB 4.32Å; A236-L239 WeakPolarHBondContact O-CB 3.25Å; A236-L239 PolarHBondContact O-N 2.82Å; A236-L239 VanDerWaalsContact O-N 3.08Å; V237-L239 VanDerWaalsContact C-N 3.25Å; V237-L239 PolarHBondContact O-N 3.49Å; L239-I242 HydrophobicContact CD2-CD1 4.33Å; L239-N243 WeakPolarHBondContact O-CB 3.29Å; L239-N243 PolarHBondContact O-N 2.83Å; L239-N243 PolarHBondContact O-ND2 3.4Å; L239-L307 HydrophobicContact CD2-CD1 3.79Å; L239-L307 HydrophobicContact CD2-CD2 3.89Å; L239-L307 HydrophobicContact CG-CD1 3.97Å; L239-L424 HydrophobicContact CD1-CD1 3.93Å; L239-M504 HydrophobicContact CD2-SD 4.1Å; L239-W507 HydrophobicContact CD1-CB 4.03Å; L239-W507 HydrophobicContact CD1-CD2 3.35Å; L239-W507 HydrophobicContact CD1-CE3 3.72Å; L239-W507 HydrophobicContact CD1-CG 3.46Å; L239-W507 VanDerWaalsContact CD1-CG 3.46Å; L239-W507 HydrophobicContact CD1-CZ2 4.42Å; L239-W507 HydrophobicContact CD1-CZ3 4.39Å
240	F	95.1	Very high	91.6	Very high	26 Å²	26	27.4 Å²	27.4	11%	0.114	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-48.1	169.7	169.5	-99.5	0	0	0	111	L221 F224 L225 W228 V237 I238 N243 A244	L221-F240 HydrophobicContact CB-CE2 4.37Å; L221-F240 HydrophobicContact CD2-CD2 3.54Å; L221-F240 HydrophobicContact CD2-CE2 3.46Å; L221-F240 VanDerWaalsContact CD2-CE2 3.46Å; L221-F240 HydrophobicContact CD2-CG 4.35Å; L221-F240 HydrophobicContact CD2-CZ 4.2Å; F224-F240 HydrophobicContact CB-CB 4.43Å; F224-F240 HydrophobicContact CB-CD2 3.51Å; F224-F240 HydrophobicContact CB-CE2 4.17Å; F224-F240 HydrophobicContact CB-CG 4.31Å; F224-F240 HydrophobicContact CD1-CB 3.92Å; F224-F240 HydrophobicContact CD2-CB 4.12Å; F224-F240 HydrophobicContact CD2-CD2 4.32Å; F224-F240 HydrophobicContact CE1-CB 4.13Å; F224-F240 HydrophobicContact CE2-CB 4.32Å; F224-F240 HydrophobicContact CG-CB 3.92Å; F224-F240 AromaticContact CG-CD2 3.92Å; F224-F240 HydrophobicContact CG-CD2 3.92Å; F224-F240 HydrophobicContact CG-CG 4.34Å; F224-F240 HydrophobicContact CZ-CB 4.32Å; L225-F240 HydrophobicContact CD2-CE2 4.32Å; L225-F240 HydrophobicContact CD2-CZ 4.29Å; L225-F240 HydrophobicContact CG-CE2 4.18Å; W228-F240 HydrophobicContact CH2-CD1 4.23Å; W228-F240 HydrophobicContact CH2-CE1 4.05Å; W228-F240 AromaticContact CZ3-CD1 3.94Å; W228-F240 HydrophobicContact CZ3-CD1 3.94Å; W228-F240 HydrophobicContact CZ3-CD2 4.43Å; W228-F240 AromaticContact CZ3-CE1 3.88Å; W228-F240 HydrophobicContact CZ3-CE1 3.88Å; W228-F240 HydrophobicContact CZ3-CE2 4.36Å; W228-F240 HydrophobicContact CZ3-CG 4.22Å; W228-F240 HydrophobicContact CZ3-CZ 4.1Å; V237-F240 HydrophobicContact CG2-CB 4.47Å; V237-F240 HydrophobicContact CG2-CD1 4.5Å; V237-F240 WeakPolarHBondContact O-CB 3.22Å; V237-F240 PolarHBondContact O-N 3.27Å; V237-F240 VanDerWaalsContact O-N 3.15Å; I238-F240 VanDerWaalsContact C-N 3.28Å; I238-F240 PolarHBondContact O-N 3.42Å; F240-N243 PolarHBondContact O-N 3.12Å; F240-A244 WeakPolarHBondContact O-CB 3.03Å; F240-A244 PolarHBondContact O-N 3.26Å
241	Y	96.6	Very high	92.4	Very high	42 Å²	42	28.8 Å²	28.8	17%	0.165	14%	0.144	C	C	.	.	H	α-helix	trans	-67.1	-36.3	178.4	-62.8	-59.1	0	0	0	113.4	V237 I238 A244 C245 W303 H333 W337	V237-Y241 HydrophobicContact CG1-CE2 4.44Å; V237-Y241 HydrophobicContact CG2-CD2 4.4Å; V237-Y241 HydrophobicContact CG2-CE2 3.74Å; V237-Y241 VanDerWaalsContact O-CD2 3.26Å; V237-Y241 WeakPolarHBondContact O-CD2 3.06Å; V237-Y241 PolarHBondContact O-N 2.97Å; I238-Y241 PolarHBondContact O-N 3.21Å; Y241-A244 WeakPolarHBondContact O-CB 3.36Å; Y241-A244 PolarHBondContact O-N 3.46Å; Y241-C245 PolarHBondContact O-N 3.06Å; Y241-C245 PolarHBondContact O-SG 3.33Å; Y241-W303 HydrophobicContact CD1-CZ2 4.43Å; Y241-W303 AromaticContact CD2-CH2 3.52Å; Y241-W303 HydrophobicContact CD2-CH2 3.52Å; Y241-W303 AromaticContact CD2-CZ2 3.67Å; Y241-W303 HydrophobicContact CD2-CZ2 3.67Å; Y241-W303 HydrophobicContact CD2-CZ3 4.06Å; Y241-W303 HydrophobicContact CE2-CH2 4.13Å; Y241-W303 HydrophobicContact CE2-CZ2 4.43Å; Y241-W303 HydrophobicContact CG-CH2 4.04Å; Y241-W303 AromaticContact CG-CZ2 3.69Å; Y241-W303 HydrophobicContact CG-CZ2 3.69Å; Y241-H333 AromaticContact CE2-CE1 3.59Å; Y241-H333 AromaticContact CE2-NE2 3.54Å; Y241-H333 AromaticContact CZ-CE1 3.47Å; Y241-H333 VanDerWaalsContact CZ-CE1 3.47Å; Y241-H333 AromaticContact CZ-NE2 3.88Å; Y241-H333 PolarHBondContact OH-CE1 3.3Å; Y241-W337 HydrophobicContact CD1-CZ2 4.12Å; Y241-W337 HydrophobicContact CG-CZ2 4.47Å
242	I	96	Very high	93	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-49	172	-68	170.6	0	0	0	110.6	I238 L239 A244 C245 F246 W303 L307 M504	I238-I242 HydrophobicContact CG2-CD1 3.88Å; I238-I242 HydrophobicContact CG2-CG1 4.38Å; I238-I242 WeakPolarHBondContact O-CG1 3.39Å; I238-I242 PolarHBondContact O-N 3.37Å; L239-I242 HydrophobicContact CD2-CD1 4.33Å; I242-A244 VanDerWaalsContact C-N 3.26Å; I242-A244 PolarHBondContact O-N 2.99Å; I242-C245 PolarHBondContact O-N 3.29Å; I242-F246 HydrophobicContact CG2-CD2 3.79Å; I242-F246 HydrophobicContact CG2-CE2 3.75Å; I242-F246 VanDerWaalsContact O-CD2 3.3Å; I242-F246 WeakPolarHBondContact O-CD2 3.47Å; I242-F246 PolarHBondContact O-N 3.06Å; I242-F246 VanDerWaalsContact O-N 3.07Å; I242-W303 HydrophobicContact CD1-CB 4.27Å; I242-W303 HydrophobicContact CG1-CB 3.54Å; I242-W303 HydrophobicContact CG1-CG 4.44Å; I242-L307 HydrophobicContact CD1-CB 4.16Å; I242-L307 HydrophobicContact CD1-CD2 4.01Å; I242-M504 HydrophobicContact CG2-CB 4.07Å; I242-M504 HydrophobicContact CG2-CG 3.85Å
243	N	97.1	Very high	93.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-31	176.6	-82	-94.7	0	0	0	112.3	T217 T220 L221 L239 F240 F247 M504 S505	T217-N243 HydrophobicContact CG2-CB 4.49Å; T220-N243 HydrophobicContact CG2-CB 4Å; T220-N243 VanDerWaalsContact CG2-CG 3.48Å; L221-N243 HydrophobicContact CD2-CB 4.28Å; L239-N243 WeakPolarHBondContact O-CB 3.29Å; L239-N243 PolarHBondContact O-N 2.83Å; L239-N243 PolarHBondContact O-ND2 3.4Å; F240-N243 PolarHBondContact O-N 3.12Å; N243-F247 VanDerWaalsContact O-CB 3.26Å; N243-F247 WeakPolarHBondContact O-CB 3.24Å; N243-F247 PolarHBondContact O-N 2.95Å; N243-M504 PolarHBondContact ND2-O 3.16Å; N243-S505 VanDerWaalsContact OD1-CA 3.25Å; N243-S505 WeakPolarHBondContact OD1-CA 3.44Å; N243-S505 WeakPolarHBondContact OD1-CB 3.03Å; N243-S505 PolarHBondContact OD1-N 3.24Å
244	A	98.1	Very high	94.4	Very high	24 Å²	24	21.5 Å²	21.5	20%	0.198	11%	0.113	C	C	.	.	H	α-helix	trans	-66.7	-41.6	174.9	0	0	0	0	0	111.8	L221 F240 Y241 I242 F247 V248	L221-A244 HydrophobicContact CD2-CB 3.9Å; F240-A244 WeakPolarHBondContact O-CB 3.03Å; F240-A244 PolarHBondContact O-N 3.26Å; Y241-A244 WeakPolarHBondContact O-CB 3.36Å; Y241-A244 PolarHBondContact O-N 3.46Å; I242-A244 VanDerWaalsContact C-N 3.26Å; I242-A244 PolarHBondContact O-N 2.99Å; A244-F247 PolarHBondContact O-N 3.47Å; A244-V248 WeakPolarHBondContact O-CG2 3.32Å; A244-V248 PolarHBondContact O-N 3Å
245	C	98.2	Very high	95.1	Very high	7 Å²	7	19.9 Å²	19.9	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-49.1	174.4	-61	0	0	0	0	111	Y241 I242 F247 V248 G249 S296 S299	Y241-C245 PolarHBondContact O-N 3.06Å; Y241-C245 PolarHBondContact O-SG 3.33Å; I242-C245 PolarHBondContact O-N 3.29Å; C245-F247 VanDerWaalsContact C-N 3.33Å; C245-F247 PolarHBondContact O-N 2.99Å; C245-V248 PolarHBondContact O-N 3.43Å; C245-G249 PolarHBondContact O-N 2.83Å; C245-S296 WeakPolarHBondContact O-CB 3.2Å; C245-S299 PolarHBondContact SG-OG 2.93Å
246	F	97.9	Very high	95.8	Very high	28 Å²	28	19.5 Å²	19.5	12%	0.123	11%	0.108	C	C	.	.	H	α-helix	trans	-65.7	-32.2	177.7	-77.1	-69.9	0	0	0	113.5	T217 I242 S250 M497 T500	T217-F246 HydrophobicContact CG2-CB 3.82Å; I242-F246 HydrophobicContact CG2-CD2 3.79Å; I242-F246 HydrophobicContact CG2-CE2 3.75Å; I242-F246 VanDerWaalsContact O-CD2 3.3Å; I242-F246 WeakPolarHBondContact O-CD2 3.47Å; I242-F246 PolarHBondContact O-N 3.06Å; I242-F246 VanDerWaalsContact O-N 3.07Å; F246-S250 VanDerWaalsContact O-CB 3.32Å; F246-S250 WeakPolarHBondContact O-CB 3.48Å; F246-S250 PolarHBondContact O-N 2.99Å; F246-S250 PolarHBondContact O-OG 2.99Å; F246-M497 VanDerWaalsContact CE1-O 3.24Å; F246-M497 WeakPolarHBondContact CE1-O 3.37Å; F246-T500 HydrophobicContact CE1-CG2 4.39Å; F246-T500 HydrophobicContact CE2-CG2 3.73Å; F246-T500 HydrophobicContact CZ-CG2 3.44Å; F246-T500 VanDerWaalsContact CZ-CG2 3.44Å
247	F	98.5	Very high	96.5	Very high	49 Å²	49	22.6 Å²	22.6	22%	0.215	12%	0.119	C	C	.	.	H	α-helix	trans	-63.4	-51.9	172.9	177.4	-107.1	0	0	0	111.6	L214 T217 F218 L221 N243 A244 C245 S250 I251	L214-F247 HydrophobicContact CD1-CD2 3.59Å; L214-F247 HydrophobicContact CD1-CE2 3.51Å; L214-F247 HydrophobicContact CD1-CG 4.47Å; L214-F247 HydrophobicContact CD1-CZ 4.37Å; L214-F247 HydrophobicContact CG-CD2 4.28Å; L214-F247 HydrophobicContact CG-CE2 4.05Å; T217-F247 WeakPolarHBondContact OG1-CA 3.19Å; F218-F247 HydrophobicContact CB-CD2 4.07Å; F218-F247 HydrophobicContact CB-CE2 3.79Å; F218-F247 AromaticContact CD2-CE2 3.95Å; F218-F247 HydrophobicContact CD2-CE2 3.95Å; F218-F247 HydrophobicContact CD2-CZ 4.13Å; F218-F247 HydrophobicContact CG-CE2 4.31Å; L221-F247 HydrophobicContact CD1-CB 3.74Å; L221-F247 HydrophobicContact CD1-CD1 3.82Å; L221-F247 HydrophobicContact CD1-CD2 4.35Å; L221-F247 HydrophobicContact CD1-CG 3.71Å; N243-F247 VanDerWaalsContact O-CB 3.26Å; N243-F247 WeakPolarHBondContact O-CB 3.24Å; N243-F247 PolarHBondContact O-N 2.95Å; A244-F247 PolarHBondContact O-N 3.47Å; C245-F247 VanDerWaalsContact C-N 3.33Å; C245-F247 PolarHBondContact O-N 2.99Å; F247-S250 PolarHBondContact O-N 3.36Å; F247-I251 HydrophobicContact CD1-CD1 4.23Å; F247-I251 HydrophobicContact CE1-CD1 3.76Å; F247-I251 HydrophobicContact CZ-CD1 3.93Å; F247-I251 PolarHBondContact O-N 3.11Å; F247-I251 VanDerWaalsContact O-N 3.13Å
248	V	98.4	Very high	96.7	Very high	63 Å²	63	28.4 Å²	28.4	38%	0.382	15%	0.15	S	C	.	.	H	α-helix	trans	-64.9	-41.7	179.3	175.9	0	0	0	0	111.5	A244 C245 S250 I251 G252 I292 S296	A244-V248 WeakPolarHBondContact O-CG2 3.32Å; A244-V248 PolarHBondContact O-N 3Å; C245-V248 PolarHBondContact O-N 3.43Å; V248-S250 VanDerWaalsContact C-N 3.33Å; V248-S250 PolarHBondContact O-N 2.99Å; V248-I251 WeakPolarHBondContact O-CB 3.41Å; V248-I251 PolarHBondContact O-N 3.44Å; V248-G252 PolarHBondContact O-N 3.43Å; V248-I292 HydrophobicContact CG1-CG2 4.03Å; V248-I292 WeakPolarHBondContact O-CG2 3.49Å; V248-S296 WeakPolarHBondContact CG1-OG 3.41Å
249	G	97.9	Very high	96.7	Very high	10 Å²	10	36.8 Å²	36.8	10%	0.103	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-39.9	173.3	0	0	0	0	0	113	C245 I251 G252 W253 S296	C245-G249 PolarHBondContact O-N 2.83Å; G249-I251 VanDerWaalsContact C-N 3.32Å; G249-I251 PolarHBondContact O-N 2.69Å; G249-G252 PolarHBondContact O-N 3.3Å; G249-G252 VanDerWaalsContact O-N 3.16Å; G249-W253 VanDerWaalsContact O-CD1 3.28Å; G249-W253 PolarHBondContact O-N 3.37Å; G249-S296 PolarHBondContact N-OG 3.32Å
250	S	98.1	Very high	96.7	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-65	-33.9	176.4	-58.3	0	0	0	0	112.3	T213 F246 F247 V248 W253 L254	T213-S250 WeakPolarHBondContact CG2-OG 3.37Å; F246-S250 VanDerWaalsContact O-CB 3.32Å; F246-S250 WeakPolarHBondContact O-CB 3.48Å; F246-S250 PolarHBondContact O-N 2.99Å; F246-S250 PolarHBondContact O-OG 2.99Å; F247-S250 PolarHBondContact O-N 3.36Å; V248-S250 VanDerWaalsContact C-N 3.33Å; V248-S250 PolarHBondContact O-N 2.99Å; S250-W253 PolarHBondContact O-N 2.94Å; S250-L254 WeakPolarHBondContact O-CB 3.47Å; S250-L254 VanDerWaalsContact O-CG 3.24Å; S250-L254 WeakPolarHBondContact O-CG 3.12Å; S250-L254 PolarHBondContact O-N 3.48Å
251	I	97.8	Very high	96.6	Very high	77 Å²	77	39.2 Å²	39.2	40%	0.395	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-44	172.2	-64.1	170.2	0	0	0	110.3	L214 F247 V248 G249 L254 A255	L214-I251 HydrophobicContact CD1-CD1 4.41Å; L214-I251 HydrophobicContact CD1-CG1 3.58Å; F247-I251 HydrophobicContact CD1-CD1 4.23Å; F247-I251 HydrophobicContact CE1-CD1 3.76Å; F247-I251 HydrophobicContact CZ-CD1 3.93Å; F247-I251 PolarHBondContact O-N 3.11Å; F247-I251 VanDerWaalsContact O-N 3.13Å; V248-I251 WeakPolarHBondContact O-CB 3.41Å; V248-I251 PolarHBondContact O-N 3.44Å; G249-I251 VanDerWaalsContact C-N 3.32Å; G249-I251 PolarHBondContact O-N 2.69Å; I251-L254 PolarHBondContact O-N 3.19Å; I251-A255 PolarHBondContact O-N 3.45Å
252	G	97.3	Very high	96.5	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176.5	0	0	0	0	0	113.1	V248 G249 L254 A255	V248-G252 PolarHBondContact O-N 3.43Å; G249-G252 PolarHBondContact O-N 3.3Å; G249-G252 VanDerWaalsContact O-N 3.16Å; G252-L254 VanDerWaalsContact C-N 3.33Å; G252-L254 PolarHBondContact O-N 3.37Å; G252-A255 PolarHBondContact O-N 3.14Å
253	W	97.9	Very high	96.4	Very high	9 Å²	9	45.9 Å²	45.9	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-33.5	175.9	-80.4	107.8	0	0	0	113.9	I206 G249 S250 Q256 V293 I361 L494 M497 F498	I206-W253 HydrophobicContact CD1-CE3 4.27Å; I206-W253 HydrophobicContact CD1-CZ3 4.03Å; I206-W253 HydrophobicContact CG2-CB 4.4Å; I206-W253 HydrophobicContact CG2-CE3 4Å; G249-W253 VanDerWaalsContact O-CD1 3.28Å; G249-W253 PolarHBondContact O-N 3.37Å; S250-W253 PolarHBondContact O-N 2.94Å; W253-Q256 PolarHBondContact O-NE2 3.44Å; W253-V293 HydrophobicContact CZ2-CG1 4.43Å; W253-I361 HydrophobicContact CD2-CD1 4.33Å; W253-I361 HydrophobicContact CD2-CG2 4.42Å; W253-I361 HydrophobicContact CE3-CD1 4.09Å; W253-I361 HydrophobicContact CE3-CG1 4.36Å; W253-I361 HydrophobicContact CE3-CG2 3.82Å; W253-I361 HydrophobicContact CH2-CD1 3.41Å; W253-I361 VanDerWaalsContact CH2-CD1 3.41Å; W253-I361 HydrophobicContact CH2-CG1 4.03Å; W253-I361 HydrophobicContact CZ2-CD1 3.68Å; W253-I361 HydrophobicContact CZ3-CD1 3.64Å; W253-I361 HydrophobicContact CZ3-CG1 3.84Å; W253-I361 HydrophobicContact CZ3-CG2 4.12Å; W253-L494 HydrophobicContact CE3-CD2 4.37Å; W253-L494 HydrophobicContact CH2-CD2 3.47Å; W253-L494 VanDerWaalsContact CH2-CD2 3.47Å; W253-L494 HydrophobicContact CZ2-CD2 3.76Å; W253-L494 HydrophobicContact CZ3-CD2 3.8Å; W253-M497 HydrophobicContact CZ2-CE 4.18Å; W253-M497 HydrophobicContact CZ2-SD 4.13Å; W253-F498 HydrophobicContact CB-CE1 4.29Å; W253-F498 HydrophobicContact CB-CZ 3.9Å; W253-F498 AromaticContact CD1-CE1 3.96Å; W253-F498 AromaticContact CD1-CZ 3.85Å; W253-F498 HydrophobicContact CD2-CZ 4.07Å; W253-F498 HydrophobicContact CG-CE1 4.14Å; W253-F498 AromaticContact CG-CZ 3.68Å; W253-F498 HydrophobicContact CG-CZ 3.68Å
254	L	97.8	Very high	96.3	Very high	31 Å²	31	50.9 Å²	50.9	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-85.9	-13.5	-179.1	-69.7	170.7	0	0	0	114.1	L214 S250 I251 G252 Q256 F257	L214-L254 HydrophobicContact CB-CD1 4.12Å; L214-L254 HydrophobicContact CD2-CD1 3.86Å; L214-L254 HydrophobicContact CG-CD1 4.45Å; S250-L254 WeakPolarHBondContact O-CB 3.47Å; S250-L254 VanDerWaalsContact O-CG 3.24Å; S250-L254 WeakPolarHBondContact O-CG 3.12Å; S250-L254 PolarHBondContact O-N 3.48Å; I251-L254 PolarHBondContact O-N 3.19Å; G252-L254 VanDerWaalsContact C-N 3.33Å; G252-L254 PolarHBondContact O-N 3.37Å; L254-Q256 PolarHBondContact O-N 3.48Å; L254-Q256 VanDerWaalsContact O-N 3.13Å; L254-F257 HydrophobicContact CB-CD2 4.44Å; L254-F257 HydrophobicContact CD2-CD2 3.9Å; L254-F257 HydrophobicContact CD2-CE2 3.95Å; L254-F257 WeakPolarHBondContact O-CD2 3.38Å; L254-F257 PolarHBondContact O-N 3.25Å; L254-F257 VanDerWaalsContact O-N 3.1Å
255	A	97	Very high	96.1	Very high	18 Å²	18	50.1 Å²	50.1	15%	0.149	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-58.6	-28.5	-177.9	0	0	0	0	0	113.5	I251 G252 F257 L258 A261 I265 I289	I251-A255 PolarHBondContact O-N 3.45Å; G252-A255 PolarHBondContact O-N 3.14Å; A255-F257 PolarHBondContact O-N 2.66Å; A255-L258 PolarHBondContact O-N 2.92Å; A255-A261 WeakPolarHBondContact O-CB 3.5Å; A255-I265 HydrophobicContact CB-CD1 4.43Å; A255-I289 HydrophobicContact CB-CD1 3.49Å; A255-I289 VanDerWaalsContact CB-CD1 3.49Å
256	Q	95.9	Very high	96	Very high	5 Å²	5	49.9 Å²	49.9	2%	0.023	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-62.8	-19.3	177.7	71.3	172.9	-81	0	0	114.7	W253 L254 L258 R262 S359 G360	W253-Q256 PolarHBondContact O-NE2 3.44Å; L254-Q256 PolarHBondContact O-N 3.48Å; L254-Q256 VanDerWaalsContact O-N 3.13Å; Q256-L258 VanDerWaalsContact C-N 3.34Å; Q256-R262 HydrophobicContact CB-CB 4.14Å; Q256-R262 HydrophobicContact CB-CG 4.37Å; Q256-R262 PolarHBondContact O-N 3Å; Q256-S359 PolarHBondContact NE2-O 2.77Å; Q256-G360 WeakPolarHBondContact CB-O 3.43Å
257	F	96.7	Very high	95.8	Very high	78 Å²	78	49 Å²	49	34%	0.342	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-90.4	3.9	-177.7	-56.8	-72.6	0	0	0	113.5	H203 I206 A207 L254 A255	H203-F257 HydrophobicContact CB-CE1 4.17Å; H203-F257 VanDerWaalsContact O-CZ 3.23Å; H203-F257 WeakPolarHBondContact O-CZ 3.43Å; I206-F257 HydrophobicContact CB-CZ 4.35Å; I206-F257 HydrophobicContact CG2-CE2 4.11Å; I206-F257 HydrophobicContact CG2-CZ 4.24Å; A207-F257 HydrophobicContact CB-CE1 3.97Å; A207-F257 HydrophobicContact CB-CE2 4.03Å; A207-F257 HydrophobicContact CB-CZ 3.72Å; L254-F257 HydrophobicContact CB-CD2 4.44Å; L254-F257 HydrophobicContact CD2-CD2 3.9Å; L254-F257 HydrophobicContact CD2-CE2 3.95Å; L254-F257 WeakPolarHBondContact O-CD2 3.38Å; L254-F257 PolarHBondContact O-N 3.25Å; L254-F257 VanDerWaalsContact O-N 3.1Å; A255-F257 PolarHBondContact O-N 2.66Å
258	L	94.4	Very high	95.5	Very high	122 Å²	122	47.3 Å²	47.3	64%	0.639	26%	0.257	S	S	*	.	S	Bend	trans	-74.5	148.1	165.5	-59.7	174.6	0	0	0	109.6	A255 Q256 G260 A261	A255-L258 PolarHBondContact O-N 2.92Å; Q256-L258 VanDerWaalsContact C-N 3.34Å; L258-G260 PolarHBondContact O-N 2.89Å; L258-G260 VanDerWaalsContact O-N 3.13Å; L258-A261 HydrophobicContact CB-CB 3.77Å; L258-A261 WeakPolarHBondContact O-CB 3.38Å; L258-A261 PolarHBondContact O-N 3Å
259	D	92.8	Very high	95	Very high	176 Å²	176	48.6 Å²	48.6	94%	0.941	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	118.3	-173.6	-67.3	-46.1	0	0	0	112.2	A261	D259-A261 PolarHBondContact O-N 3.22Å; D259-A261 VanDerWaalsContact O-N 3.16Å
260	G	91	Very high	94.6	Very high	61 Å²	61	49.3 Å²	49.3	63%	0.629	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-15.2	-177.3	0	0	0	0	0	116	L258 R262 K263 E264	L258-G260 PolarHBondContact O-N 2.89Å; L258-G260 VanDerWaalsContact O-N 3.13Å; G260-R262 PolarHBondContact O-N 3.01Å; G260-K263 PolarHBondContact O-N 2.98Å; G260-E264 PolarHBondContact O-N 2.04Å
261	A	94.3	Very high	94.2	Very high	15 Å²	15	54 Å²	54	12%	0.124	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-37.1	-166.9	0	0	0	0	0	114.1	A255 L258 D259 K263 E264 I265	A255-A261 WeakPolarHBondContact O-CB 3.5Å; L258-A261 HydrophobicContact CB-CB 3.77Å; L258-A261 WeakPolarHBondContact O-CB 3.38Å; L258-A261 PolarHBondContact O-N 3Å; D259-A261 PolarHBondContact O-N 3.22Å; D259-A261 VanDerWaalsContact O-N 3.16Å; A261-K263 VanDerWaalsContact C-N 3.26Å; A261-K263 PolarHBondContact O-N 2.87Å; A261-E264 PolarHBondContact O-N 3.01Å; A261-E264 VanDerWaalsContact O-N 3.12Å; A261-I265 HydrophobicContact CB-CD1 4.2Å; A261-I265 WeakPolarHBondContact O-CB 3.49Å; A261-I265 WeakPolarHBondContact O-CD1 3.43Å; A261-I265 WeakPolarHBondContact O-CG1 3.48Å; A261-I265 PolarHBondContact O-N 3.05Å
262	R	94.3	Very high	94	Very high	62 Å²	62	50.4 Å²	50.4	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-54	-43	175.4	-171.9	-174.7	-63.5	133.8	1.6	112.3	H203 Q256 G260 I265 V266	H203-R262 PolarHBondContact CE1-NH1 3.17Å; H203-R262 VanDerWaalsContact CG-CZ 3.48Å; H203-R262 PolarHBondContact ND1-NH1 3.38Å; H203-R262 PolarHBondContact ND1-NH2 3.06Å; Q256-R262 HydrophobicContact CB-CB 4.14Å; Q256-R262 HydrophobicContact CB-CG 4.37Å; Q256-R262 PolarHBondContact O-N 3Å; G260-R262 PolarHBondContact O-N 3.01Å; R262-I265 PolarHBondContact O-N 3.45Å; R262-V266 HydrophobicContact CG-CG2 4.41Å; R262-V266 WeakPolarHBondContact O-CB 3.31Å; R262-V266 PolarHBondContact O-N 2.84Å
263	K	93.5	Very high	93.7	Very high	125 Å²	125	52 Å²	52	54%	0.543	28%	0.284	S	S	.	.	H	α-helix	trans	-70.4	-36.9	179.8	-66.4	-158.6	172.7	-155.7	0	111.5	G260 A261 C267	G260-K263 PolarHBondContact O-N 2.98Å; A261-K263 VanDerWaalsContact C-N 3.26Å; A261-K263 PolarHBondContact O-N 2.87Å; K263-C267 WeakPolarHBondContact O-CA 3.49Å; K263-C267 WeakPolarHBondContact O-CB 3.43Å; K263-C267 PolarHBondContact O-N 3.38Å
264	E	93.9	Very high	93.4	Very high	104 Å²	104	51.7 Å²	51.7	49%	0.486	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-36.6	173.9	-159.4	-160.3	127.3	0	0	112.8	G260 A261 R274 S285	G260-E264 PolarHBondContact O-N 2.04Å; A261-E264 PolarHBondContact O-N 3.01Å; A261-E264 VanDerWaalsContact O-N 3.12Å; E264-R274 PolarHBondContact O-NH2 3.48Å; E264-S285 VanDerWaalsContact OE1-CB 3.31Å; E264-S285 WeakPolarHBondContact OE1-CB 3.4Å; E264-S285 PolarHBondContact OE1-OG 3.27Å
265	I	94.9	Very high	93.1	Very high	9 Å²	9	52.7 Å²	52.7	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-73.6	-44.6	-179.4	-68.3	159.8	0	0	0	111.5	A255 A261 R262 R274 C286 I289 C362	A255-I265 HydrophobicContact CB-CD1 4.43Å; A261-I265 HydrophobicContact CB-CD1 4.2Å; A261-I265 WeakPolarHBondContact O-CB 3.49Å; A261-I265 WeakPolarHBondContact O-CD1 3.43Å; A261-I265 WeakPolarHBondContact O-CG1 3.48Å; A261-I265 PolarHBondContact O-N 3.05Å; R262-I265 PolarHBondContact O-N 3.45Å; I265-R274 VanDerWaalsContact O-CD 3.27Å; I265-R274 WeakPolarHBondContact O-CD 3.47Å; I265-R274 PolarHBondContact O-NE 2.94Å; I265-C286 VanDerWaalsContact O-CB 3.24Å; I265-C286 WeakPolarHBondContact O-CB 3.44Å; I265-I289 HydrophobicContact CD1-CD1 4.42Å; I265-I289 HydrophobicContact CD1-CG1 3.91Å; I265-I289 HydrophobicContact CG1-CG1 3.96Å; I265-I289 HydrophobicContact CG2-CB 4.31Å; I265-I289 HydrophobicContact CG2-CG1 4.1Å; I265-C362 PolarHBondContact O-SG 3.35Å
266	V	95.4	Very high	92.8	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-100.4	-34.6	-168.9	179.1	0	0	0	0	113.3	R262 R274	R262-V266 HydrophobicContact CG-CG2 4.41Å; R262-V266 WeakPolarHBondContact O-CB 3.31Å; R262-V266 PolarHBondContact O-N 2.84Å; V266-R274 WeakPolarHBondContact O-CB 3.49Å; V266-R274 VanDerWaalsContact O-CG 3.28Å; V266-R274 WeakPolarHBondContact O-CG 3.1Å; V266-R274 PolarHBondContact O-N 3.25Å
267	C	93.8	Very high	92.6	Very high	10 Å²	10	53.2 Å²	53.2	7%	0.068	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-94	154.6	-177.1	-44.6	0	0	0	0	111.5	C189 K263 R274	C189-C267 HydrophobicContact CB-CB 3.69Å; C189-C267 WeakPolarHBondContact CB-SG 3.33Å; C189-C267 WeakPolarHBondContact SG-CA 3.47Å; C189-C267 WeakPolarHBondContact SG-CB 3.36Å; C189-C267 CovalentContact SG-SG 2.03Å; C189-C267 PolarHBondContact SG-SG 3.04Å; K263-C267 WeakPolarHBondContact O-CA 3.49Å; K263-C267 WeakPolarHBondContact O-CB 3.43Å; K263-C267 PolarHBondContact O-N 3.38Å; C267-R274 PolarHBondContact O-NE 2.92Å
268	K	92.1	Very high	92.3	Very high	12 Å²	12	52.1 Å²	52.1	5%	0.052	30%	0.298	C	S	.	.			trans	-86.2	168.5	162.7	-66.2	-172.1	-169.5	176.5	0	111.2	S177 D270 N271 T272 R274 E282	S177-K268 WeakPolarHBondContact OG-CD 3.42Å; S177-K268 PolarHBondContact OG-NZ 3.44Å; K268-D270 WeakPolarHBondContact CB-OD1 3.06Å; K268-D270 PolarHBondContact O-N 3.12Å; K268-N271 PolarHBondContact O-N 2.68Å; K268-T272 PolarHBondContact N-O 2.66Å; K268-R274 HydrophobicContact CG-CG 3.67Å; K268-E282 HydrophobicContact CB-CG 4.38Å; K268-E282 HydrophobicContact CD-CG 4.31Å; K268-E282 HydrophobicContact CG-CG 4.1Å
269	S	89.1	Confident	91.8	Very high	91 Å²	91	47.7 Å²	47.7	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-23.3	174.7	62.3	0	0	0	0	115.8	E282	S269-E282 WeakPolarHBondContact CB-OE1 3.23Å; S269-E282 PolarHBondContact N-OE1 3.46Å; S269-E282 PolarHBondContact N-OE2 3.31Å; S269-E282 PolarHBondContact OG-OE1 3.13Å
270	D	88.8	Confident	91.2	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.134	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.9	179.4	66.5	-3	0	0	0	114.5	T172 I174 K268 T272	T172-D270 WeakPolarHBondContact CB-OD2 3.2Å; T172-D270 PolarHBondContact OG1-OD2 3.34Å; I174-D270 HydrophobicContact CD1-CB 4.25Å; K268-D270 WeakPolarHBondContact CB-OD1 3.06Å; K268-D270 PolarHBondContact O-N 3.12Å; D270-T272 VanDerWaalsContact C-N 3.26Å; D270-T272 VanDerWaalsContact CG-OG1 3.25Å; D270-T272 PolarHBondContact O-N 3.27Å; D270-T272 VanDerWaalsContact OD1-CB 3.3Å; D270-T272 WeakPolarHBondContact OD1-CB 3.03Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.1Å; D270-T272 PolarHBondContact OD1-N 3.16Å; D270-T272 PolarHBondContact OD1-OG1 3.36Å; D270-T272 WeakPolarHBondContact OD2-CG2 3.49Å; D270-T272 PolarHBondContact OD2-OG1 2.99Å
271	N	89.8	Confident	90.5	Very high	100 Å²	100	47 Å²	47	54%	0.535	28%	0.276	S	S	.	.	S	Bend	trans	64.8	16.9	-170.1	-51.1	-88.2	0	0	0	115.3	C189 K268	C189-N271 WeakPolarHBondContact CB-O 3.38Å; C189-N271 PolarHBondContact N-O 3.22Å; K268-N271 PolarHBondContact O-N 2.68Å
272	T	92.5	Very high	90.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-81.5	157.9	164.2	65	0	0	0	0	111.3	T172 S177 I187 K268 D270	T172-T272 HydrophobicContact CG2-CG2 4.18Å; S177-T272 WeakPolarHBondContact CB-OG1 3.35Å; S177-T272 PolarHBondContact OG-OG1 2.97Å; I187-T272 VanDerWaalsContact O-CA 3.23Å; I187-T272 WeakPolarHBondContact O-CA 3.48Å; I187-T272 VanDerWaalsContact O-CB 3.28Å; I187-T272 WeakPolarHBondContact O-CB 3.4Å; K268-T272 PolarHBondContact N-O 2.66Å; D270-T272 VanDerWaalsContact C-N 3.26Å; D270-T272 VanDerWaalsContact CG-OG1 3.25Å; D270-T272 PolarHBondContact O-N 3.27Å; D270-T272 VanDerWaalsContact OD1-CB 3.3Å; D270-T272 WeakPolarHBondContact OD1-CB 3.03Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.1Å; D270-T272 PolarHBondContact OD1-N 3.16Å; D270-T272 PolarHBondContact OD1-OG1 3.36Å; D270-T272 WeakPolarHBondContact OD2-CG2 3.49Å; D270-T272 PolarHBondContact OD2-OG1 2.99Å
273	M	90.9	Very high	89.9	Confident	34 Å²	34	47.9 Å²	47.9	17%	0.167	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-69.3	146.6	174.7	81.3	-172.5	-66.5	0	0	111	I187 L275 G355	I187-M273 HydrophobicContact CD1-SD 4.43Å; I187-M273 HydrophobicContact CG2-CG 3.73Å; I187-M273 HydrophobicContact CG2-SD 3.56Å; I187-M273 VanDerWaalsContact CG2-SD 3.56Å; I187-M273 PolarHBondContact O-N 3.32Å; M273-L275 HydrophobicContact CE-CD2 3.93Å; M273-L275 HydrophobicContact CG-CD1 4.14Å; M273-L275 HydrophobicContact CG-CD2 3.93Å; M273-L275 HydrophobicContact CG-CG 3.77Å; M273-L275 PolarHBondContact O-N 2.85Å; M273-L275 HydrophobicContact SD-CD1 4.41Å; M273-L275 HydrophobicContact SD-CD2 3.94Å; M273-L275 HydrophobicContact SD-CG 4.31Å; M273-G355 VanDerWaalsContact CE-O 3.25Å; M273-G355 WeakPolarHBondContact CE-O 3.43Å
274	R	93	Very high	89.9	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.011	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72	126.4	172.7	-73.3	174.7	-178.2	-114.6	18.6	110.9	E264 I265 V266 C267 K268 E277 T283 G355	E264-R274 PolarHBondContact O-NH2 3.48Å; I265-R274 VanDerWaalsContact O-CD 3.27Å; I265-R274 WeakPolarHBondContact O-CD 3.47Å; I265-R274 PolarHBondContact O-NE 2.94Å; V266-R274 WeakPolarHBondContact O-CB 3.49Å; V266-R274 VanDerWaalsContact O-CG 3.28Å; V266-R274 WeakPolarHBondContact O-CG 3.1Å; V266-R274 PolarHBondContact O-N 3.25Å; C267-R274 PolarHBondContact O-NE 2.92Å; K268-R274 HydrophobicContact CG-CG 3.67Å; R274-E277 HydrophobicContact CB-CG 4.12Å; R274-E277 VanDerWaalsContact CD-OE1 3.29Å; R274-E277 WeakPolarHBondContact CD-OE1 3.44Å; R274-E277 VanDerWaalsContact CG-OE1 3.32Å; R274-E277 WeakPolarHBondContact CG-OE1 3.37Å; R274-E277 IonicContact CZ-OE1 2.69Å; R274-E277 IonicContact NE-OE1 2.63Å; R274-E277 IonicContact NH1-OE1 2.66Å; R274-E277 PolarHBondContact NH1-OE1 3.44Å; R274-T283 PolarHBondContact NH1-O 3.2Å; R274-T283 PolarHBondContact NH2-O 3.1Å; R274-T283 PolarHBondContact NH2-OG1 2.78Å; R274-G355 PolarHBondContact O-N 3.45Å
275	L	91.4	Very high	89.9	Confident	53 Å²	53	43.6 Å²	43.6	28%	0.277	27%	0.272	S	S	.	.			trans	-136	136.8	177.7	-63.1	176.6	0	0	0	108.2	M273 D354 K367	M273-L275 HydrophobicContact CE-CD2 3.93Å; M273-L275 HydrophobicContact CG-CD1 4.14Å; M273-L275 HydrophobicContact CG-CD2 3.93Å; M273-L275 HydrophobicContact CG-CG 3.77Å; M273-L275 PolarHBondContact O-N 2.85Å; M273-L275 HydrophobicContact SD-CD1 4.41Å; M273-L275 HydrophobicContact SD-CD2 3.94Å; M273-L275 HydrophobicContact SD-CG 4.31Å; L275-D354 WeakPolarHBondContact CA-OD1 3.27Å; L275-D354 HydrophobicContact CD2-CB 4.33Å; L275-K367 HydrophobicContact CD2-CB 3.98Å; L275-K367 HydrophobicContact CD2-CD 4.49Å; L275-K367 HydrophobicContact CD2-CG 4.35Å
276	G	90	Very high	89.9	Confident	33 Å²	33	43.1 Å²	43.1	34%	0.34	27%	0.27	S	S	.	.	S	Bend	trans	64.9	45	173.6	0	0	0	0	0	115.2	A351 V353 D354	G276-A351 CarbonylContact C-O 3.11Å; G276-A351 VanDerWaalsContact C-O 3.29Å; G276-A351 WeakPolarHBondContact CA-O 3.26Å; G276-V353 PolarHBondContact N-O 3.5Å; G276-D354 PolarHBondContact N-OD1 3.21Å; G276-D354 VanDerWaalsContact N-OD1 3.12Å
277	E	91.3	Very high	89.9	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-80.4	148.2	175.2	-62.1	-82	-159.3	0	0	110.9	R274 S279 V287 A351 V353	R274-E277 HydrophobicContact CB-CG 4.12Å; R274-E277 VanDerWaalsContact CD-OE1 3.29Å; R274-E277 WeakPolarHBondContact CD-OE1 3.44Å; R274-E277 VanDerWaalsContact CG-OE1 3.32Å; R274-E277 WeakPolarHBondContact CG-OE1 3.37Å; R274-E277 IonicContact CZ-OE1 2.69Å; R274-E277 IonicContact NE-OE1 2.63Å; R274-E277 IonicContact NH1-OE1 2.66Å; R274-E277 PolarHBondContact NH1-OE1 3.44Å; E277-S279 VanDerWaalsContact OE2-CB 3.27Å; E277-S279 WeakPolarHBondContact OE2-CB 3.32Å; E277-S279 PolarHBondContact OE2-N 3.25Å; E277-S279 PolarHBondContact OE2-OG 3.13Å; E277-V287 HydrophobicContact CB-CG2 4.06Å; E277-A351 CarbonylContact O-C 3.54Å; E277-A351 VanDerWaalsContact O-CA 3.31Å; E277-A351 WeakPolarHBondContact O-CA 3.43Å; E277-V353 HydrophobicContact CB-CB 4.2Å; E277-V353 WeakPolarHBondContact CB-O 3.38Å; E277-V353 PolarHBondContact N-O 3.43Å; E277-V353 WeakPolarHBondContact O-CB 3.49Å; E277-V353 PolarHBondContact O-N 2.99Å
278	P	90.8	Very high	90.1	Very high	55 Å²	55	46.5 Å²	46.5	36%	0.357	29%	0.291	S	S	.	.	P	Polyproline II helix	cis	-81.3	124.7	9.7	31	-35.5	0	0	0	115	V287	P278-V287 HydrophobicContact CB-CG2 3.96Å
279	S	84.9	Confident	90.3	Very high	28 Å²	28	46.7 Å²	46.7	20%	0.196	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-92.6	151.8	169.3	66.9	0	0	0	0	111.8	E277 S281	E277-S279 VanDerWaalsContact OE2-CB 3.27Å; E277-S279 WeakPolarHBondContact OE2-CB 3.32Å; E277-S279 PolarHBondContact OE2-N 3.25Å; E277-S279 PolarHBondContact OE2-OG 3.13Å; S279-S281 PolarHBondContact O-N 2.79Å
280	S	79.1	Confident	90.7	Very high	133 Å²	133	42.3 Å²	42.3	93%	0.93	26%	0.261	S	S	*	.	S	Bend	trans	-86.4	0.5	-172.2	64	0	0	0	0	115.3
281	S	77.9	Confident	91.2	Very high	90 Å²	90	44.2 Å²	44.2	63%	0.629	27%	0.271	S	S	*	.	S	Bend	trans	-122.3	-12.7	-171.4	56.1	0	0	0	0	114.9	S279	S279-S281 PolarHBondContact O-N 2.79Å
282	E	84.8	Confident	91.6	Very high	32 Å²	32	41.9 Å²	41.9	15%	0.15	26%	0.258	C	S	.	.	S	Bend	trans	-109.7	172.6	-176.9	-66.7	-71.5	154.8	0	0	111	K268 S269	K268-E282 HydrophobicContact CB-CG 4.38Å; K268-E282 HydrophobicContact CD-CG 4.31Å; K268-E282 HydrophobicContact CG-CG 4.1Å; S269-E282 WeakPolarHBondContact CB-OE1 3.23Å; S269-E282 PolarHBondContact N-OE1 3.46Å; S269-E282 PolarHBondContact N-OE2 3.31Å; S269-E282 PolarHBondContact OG-OE1 3.13Å
283	T	90.3	Very high	91.8	Very high	63 Å²	63	41.9 Å²	41.9	39%	0.387	26%	0.258	S	S	.	.			trans	-72.4	146.6	178.9	66.8	0	0	0	0	111.9	R274 S285	R274-T283 PolarHBondContact NH1-O 3.2Å; R274-T283 PolarHBondContact NH2-O 3.1Å; R274-T283 PolarHBondContact NH2-OG1 2.78Å; T283-S285 PolarHBondContact O-N 3.22Å; T283-S285 VanDerWaalsContact O-N 3.08Å; T283-S285 PolarHBondContact OG1-OG 3.43Å; T283-S285 VanDerWaalsContact OG1-OG 3.12Å
284	L	92.7	Very high	92.2	Very high	112 Å²	112	40.2 Å²	40.2	59%	0.586	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	10.3	177.4	-60.9	178.6	0	0	0	113.9	V287 T288	L284-V287 PolarHBondContact O-N 3.48Å; L284-T288 WeakPolarHBondContact O-CB 3.45Å; L284-T288 PolarHBondContact O-N 2.96Å; L284-T288 PolarHBondContact O-OG1 3.37Å
285	S	93.9	Very high	92.4	Very high	27 Å²	27	43.2 Å²	43.2	19%	0.189	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-44.9	-173.9	-46.8	0	0	0	0	111.6	E264 T283 V287 T288 I289	E264-S285 VanDerWaalsContact OE1-CB 3.31Å; E264-S285 WeakPolarHBondContact OE1-CB 3.4Å; E264-S285 PolarHBondContact OE1-OG 3.27Å; T283-S285 PolarHBondContact O-N 3.22Å; T283-S285 VanDerWaalsContact O-N 3.08Å; T283-S285 PolarHBondContact OG1-OG 3.43Å; T283-S285 VanDerWaalsContact OG1-OG 3.12Å; S285-V287 PolarHBondContact O-N 2.65Å; S285-T288 PolarHBondContact O-N 3.39Å; S285-I289 WeakPolarHBondContact O-CG1 3.31Å; S285-I289 PolarHBondContact O-N 3.39Å; S285-I289 VanDerWaalsContact O-N 3.07Å
286	C	95.4	Very high	92.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-53	-53.7	170.3	178.1	0	0	0	0	112.5	I265 T288 I289 F290 C362	I265-C286 VanDerWaalsContact O-CB 3.24Å; I265-C286 WeakPolarHBondContact O-CB 3.44Å; C286-T288 VanDerWaalsContact C-N 3.29Å; C286-T288 PolarHBondContact O-N 3.16Å; C286-I289 PolarHBondContact O-N 3.04Å; C286-F290 PolarHBondContact O-N 3Å; C286-C362 WeakPolarHBondContact CA-SG 3.19Å; C286-C362 HydrophobicContact CB-CB 4.11Å; C286-C362 WeakPolarHBondContact CB-SG 3.47Å; C286-C362 WeakPolarHBondContact O-CB 3.32Å; C286-C362 WeakPolarHBondContact SG-CB 3.47Å; C286-C362 CovalentContact SG-SG 2.03Å; C286-C362 PolarHBondContact SG-SG 2.77Å
287	V	96.3	Very high	93.1	Very high	13 Å²	13	40.5 Å²	40.5	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-37.6	-179.5	176.5	0	0	0	0	111.6	E277 P278 L284 S285 F290 I291 L348	E277-V287 HydrophobicContact CB-CG2 4.06Å; P278-V287 HydrophobicContact CB-CG2 3.96Å; L284-V287 PolarHBondContact O-N 3.48Å; S285-V287 PolarHBondContact O-N 2.65Å; V287-F290 PolarHBondContact O-N 3.05Å; V287-I291 HydrophobicContact CG1-CD1 3.94Å; V287-I291 VanDerWaalsContact O-CG1 3.26Å; V287-I291 WeakPolarHBondContact O-CG1 3.5Å; V287-I291 PolarHBondContact O-N 2.99Å; V287-L348 HydrophobicContact CG1-CD2 3.74Å
288	T	96.2	Very high	93.4	Very high	70 Å²	70	40.5 Å²	40.5	43%	0.429	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-46	178.6	-57	0	0	0	0	111.4	L284 S285 C286 I291 I292	L284-T288 WeakPolarHBondContact O-CB 3.45Å; L284-T288 PolarHBondContact O-N 2.96Å; L284-T288 PolarHBondContact O-OG1 3.37Å; S285-T288 PolarHBondContact O-N 3.39Å; C286-T288 VanDerWaalsContact C-N 3.29Å; C286-T288 PolarHBondContact O-N 3.16Å; T288-I291 PolarHBondContact O-N 2.89Å; T288-I292 HydrophobicContact CG2-CD1 4.05Å; T288-I292 VanDerWaalsContact O-CG1 3.29Å; T288-I292 WeakPolarHBondContact O-CG1 3.5Å; T288-I292 PolarHBondContact O-N 3.47Å
289	I	97.5	Very high	93.7	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.077	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-42.1	175.7	-62	-53.3	0	0	0	111.2	A255 I265 S285 C286 I291 I292 V293 I361	A255-I289 HydrophobicContact CB-CD1 3.49Å; A255-I289 VanDerWaalsContact CB-CD1 3.49Å; I265-I289 HydrophobicContact CD1-CD1 4.42Å; I265-I289 HydrophobicContact CD1-CG1 3.91Å; I265-I289 HydrophobicContact CG1-CG1 3.96Å; I265-I289 HydrophobicContact CG2-CB 4.31Å; I265-I289 HydrophobicContact CG2-CG1 4.1Å; S285-I289 WeakPolarHBondContact O-CG1 3.31Å; S285-I289 PolarHBondContact O-N 3.39Å; S285-I289 VanDerWaalsContact O-N 3.07Å; C286-I289 PolarHBondContact O-N 3.04Å; I289-I291 PolarHBondContact O-N 3.1Å; I289-I292 PolarHBondContact O-N 3.18Å; I289-V293 HydrophobicContact CG2-CG2 4.24Å; I289-V293 WeakPolarHBondContact O-CG2 3.44Å; I289-V293 PolarHBondContact O-N 3.17Å; I289-I361 HydrophobicContact CG2-CB 4.08Å; I289-I361 HydrophobicContact CG2-CG2 4.08Å
290	F	97.9	Very high	94.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-54.7	-50.7	173.8	162.6	-107.2	0	0	0	111.9	C286 V287 I292 V293 Y294 T344 I347 L348 V353 C362 V364	C286-F290 PolarHBondContact O-N 3Å; V287-F290 PolarHBondContact O-N 3.05Å; F290-I292 PolarHBondContact O-N 3.25Å; F290-V293 PolarHBondContact O-N 2.93Å; F290-Y294 HydrophobicContact CE2-CD1 4.36Å; F290-Y294 AromaticContact CE2-CD2 4Å; F290-Y294 HydrophobicContact CE2-CD2 4Å; F290-Y294 AromaticContact CE2-CG 3.7Å; F290-Y294 HydrophobicContact CE2-CG 3.7Å; F290-Y294 HydrophobicContact CZ-CD1 4.15Å; F290-Y294 HydrophobicContact CZ-CD2 4.48Å; F290-Y294 AromaticContact CZ-CG 3.96Å; F290-Y294 HydrophobicContact CZ-CG 3.96Å; F290-Y294 WeakPolarHBondContact O-CB 3.49Å; F290-Y294 PolarHBondContact O-N 2.76Å; F290-T344 HydrophobicContact CE1-CG2 4.11Å; F290-I347 HydrophobicContact CE1-CB 4.46Å; F290-I347 HydrophobicContact CE1-CG2 4.08Å; F290-I347 HydrophobicContact CE2-CD1 4.43Å; F290-I347 HydrophobicContact CE2-CG2 4.34Å; F290-I347 HydrophobicContact CZ-CB 3.99Å; F290-I347 HydrophobicContact CZ-CD1 3.82Å; F290-I347 HydrophobicContact CZ-CG2 3.59Å; F290-L348 HydrophobicContact CD1-CD2 4Å; F290-L348 HydrophobicContact CE1-CD2 3.89Å; F290-L348 HydrophobicContact CE1-CG 4.16Å; F290-V353 HydrophobicContact CB-CG1 3.74Å; F290-V353 HydrophobicContact CD1-CG1 4.14Å; F290-V353 HydrophobicContact CD1-CG2 3.65Å; F290-V353 HydrophobicContact CD2-CG1 4.04Å; F290-V353 HydrophobicContact CD2-CG2 4.2Å; F290-V353 HydrophobicContact CE1-CG2 3.69Å; F290-V353 HydrophobicContact CE2-CG2 4.22Å; F290-V353 HydrophobicContact CG-CB 4.49Å; F290-V353 HydrophobicContact CG-CG1 3.67Å; F290-V353 HydrophobicContact CG-CG2 3.93Å; F290-V353 HydrophobicContact CZ-CG2 3.98Å; F290-C362 WeakPolarHBondContact CA-O 3.48Å; F290-C362 HydrophobicContact CB-CB 4.21Å; F290-V364 HydrophobicContact CE2-CB 4.12Å
291	I	98.2	Very high	95.1	Very high	65 Å²	65	30.9 Å²	30.9	33%	0.333	17%	0.174	S	C	.	.	H	α-helix	trans	-58.5	-48	178.2	-68.8	163.2	0	0	0	110.5	V287 T288 I289 V293 Y295 T344 L348	V287-I291 HydrophobicContact CG1-CD1 3.94Å; V287-I291 VanDerWaalsContact O-CG1 3.26Å; V287-I291 WeakPolarHBondContact O-CG1 3.5Å; V287-I291 PolarHBondContact O-N 2.99Å; T288-I291 PolarHBondContact O-N 2.89Å; I289-I291 PolarHBondContact O-N 3.1Å; I291-V293 PolarHBondContact O-N 3.23Å; I291-Y295 WeakPolarHBondContact O-CB 3.49Å; I291-Y295 PolarHBondContact O-N 3.27Å; I291-T344 HydrophobicContact CG1-CG2 3.93Å; I291-T344 HydrophobicContact CG2-CG2 4.48Å; I291-L348 HydrophobicContact CD1-CD1 4.03Å; I291-L348 HydrophobicContact CG1-CD1 4.18Å
292	I	98.1	Very high	96	Very high	50 Å²	50	27.5 Å²	27.5	26%	0.256	15%	0.149	S	C	.	.	H	α-helix	trans	-59.5	-46.6	-178.9	-70.1	167	0	0	0	111.4	V248 T288 I289 F290 S296	V248-I292 HydrophobicContact CG1-CG2 4.03Å; V248-I292 WeakPolarHBondContact O-CG2 3.49Å; T288-I292 HydrophobicContact CG2-CD1 4.05Å; T288-I292 VanDerWaalsContact O-CG1 3.29Å; T288-I292 WeakPolarHBondContact O-CG1 3.5Å; T288-I292 PolarHBondContact O-N 3.47Å; I289-I292 PolarHBondContact O-N 3.18Å; F290-I292 PolarHBondContact O-N 3.25Å; I292-S296 WeakPolarHBondContact O-CB 3.41Å; I292-S296 PolarHBondContact O-OG 2.97Å
293	V	98	Very high	96.6	Very high	2 Å²	2	26 Å²	26	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-74.7	-51.9	-177.6	176.3	0	0	0	0	111.4	W253 I289 F290 I291 S296 L297 I361 F363	W253-V293 HydrophobicContact CZ2-CG1 4.43Å; I289-V293 HydrophobicContact CG2-CG2 4.24Å; I289-V293 WeakPolarHBondContact O-CG2 3.44Å; I289-V293 PolarHBondContact O-N 3.17Å; F290-V293 PolarHBondContact O-N 2.93Å; I291-V293 PolarHBondContact O-N 3.23Å; V293-S296 PolarHBondContact O-N 2.65Å; V293-L297 WeakPolarHBondContact O-CB 3.33Å; V293-L297 PolarHBondContact O-N 3.27Å; V293-I361 HydrophobicContact CG1-CD1 4.17Å; V293-F363 HydrophobicContact CG1-CE2 4.44Å
294	Y	98.1	Very high	96.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.4	-45.9	-173.6	-179.3	-90.3	0	0	0	112.8	F290 S296 L297 M298 L343 T344 I347 F363 V364 F375 V376	F290-Y294 HydrophobicContact CE2-CD1 4.36Å; F290-Y294 AromaticContact CE2-CD2 4Å; F290-Y294 HydrophobicContact CE2-CD2 4Å; F290-Y294 AromaticContact CE2-CG 3.7Å; F290-Y294 HydrophobicContact CE2-CG 3.7Å; F290-Y294 HydrophobicContact CZ-CD1 4.15Å; F290-Y294 HydrophobicContact CZ-CD2 4.48Å; F290-Y294 AromaticContact CZ-CG 3.96Å; F290-Y294 HydrophobicContact CZ-CG 3.96Å; F290-Y294 WeakPolarHBondContact O-CB 3.49Å; F290-Y294 PolarHBondContact O-N 2.76Å; Y294-S296 VanDerWaalsContact C-N 3.32Å; Y294-S296 PolarHBondContact O-N 2.93Å; Y294-L297 PolarHBondContact O-N 3.35Å; Y294-M298 HydrophobicContact CD1-CG 4.22Å; Y294-M298 HydrophobicContact CD2-CE 4.4Å; Y294-M298 HydrophobicContact CD2-CG 4.43Å; Y294-M298 HydrophobicContact CE1-CG 3.7Å; Y294-M298 HydrophobicContact CE2-CE 3.7Å; Y294-M298 HydrophobicContact CE2-CG 3.95Å; Y294-M298 WeakPolarHBondContact O-CB 3.47Å; Y294-M298 WeakPolarHBondContact O-CG 3.47Å; Y294-M298 PolarHBondContact O-N 3.24Å; Y294-L343 HydrophobicContact CE1-CB 3.97Å; Y294-T344 WeakPolarHBondContact CD1-OG1 3.5Å; Y294-I347 HydrophobicContact CD1-CD1 4.12Å; Y294-I347 HydrophobicContact CD2-CD1 4.29Å; Y294-I347 HydrophobicContact CE1-CD1 3.57Å; Y294-I347 HydrophobicContact CE2-CD1 3.74Å; Y294-I347 HydrophobicContact CG-CD1 4.47Å; Y294-F363 HydrophobicContact CD2-CE2 4.05Å; Y294-F363 HydrophobicContact CD2-CZ 4.21Å; Y294-V364 HydrophobicContact CD2-CG1 4.2Å; Y294-V364 HydrophobicContact CE2-CG1 4.09Å; Y294-F375 WeakPolarHBondContact CE2-O 3.32Å; Y294-F375 PolarHBondContact OH-O 2.92Å; Y294-V376 HydrophobicContact CE2-CG2 4.09Å
295	Y	98.3	Very high	97	Very high	66 Å²	66	19 Å²	19	26%	0.259	10%	0.103	S	C	.	.	H	α-helix	trans	-63.1	-40.7	178.4	-178	-91.4	0	0	0	111.4	I291 S299 W337 P340 F341	I291-Y295 WeakPolarHBondContact O-CB 3.49Å; I291-Y295 PolarHBondContact O-N 3.27Å; Y295-S299 VanDerWaalsContact O-CB 3.29Å; Y295-S299 WeakPolarHBondContact O-CB 3.24Å; Y295-S299 PolarHBondContact O-N 3.49Å; Y295-W337 AromaticContact CE1-CE3 3.96Å; Y295-W337 HydrophobicContact CE1-CE3 3.96Å; Y295-W337 HydrophobicContact CE1-CZ3 4.17Å; Y295-P340 HydrophobicContact CD2-CB 3.6Å; Y295-P340 HydrophobicContact CE2-CB 3.75Å; Y295-P340 HydrophobicContact CG-CB 4.23Å; Y295-F341 HydrophobicContact CE2-CB 4.09Å
296	S	98.1	Very high	96.9	Very high	9 Å²	9	18.7 Å²	18.7	6%	0.063	10%	0.099	C	C	.	.	H	α-helix	trans	-65.2	-43.5	176.9	-63.1	0	0	0	0	112.2	C245 V248 G249 I292 V293 Y294 G300	C245-S296 WeakPolarHBondContact O-CB 3.2Å; V248-S296 WeakPolarHBondContact CG1-OG 3.41Å; G249-S296 PolarHBondContact N-OG 3.32Å; I292-S296 WeakPolarHBondContact O-CB 3.41Å; I292-S296 PolarHBondContact O-OG 2.97Å; V293-S296 PolarHBondContact O-N 2.65Å; Y294-S296 VanDerWaalsContact C-N 3.32Å; Y294-S296 PolarHBondContact O-N 2.93Å; S296-G300 PolarHBondContact O-N 3.46Å
297	L	96.8	Very high	96.8	Very high	19 Å²	19	18.8 Å²	18.8	10%	0.099	10%	0.099	C	C	.	.	H	α-helix	trans	-59.9	-52.1	175.2	177.9	63.3	0	0	0	111	V293 Y294 G300 V301 F363 M497	V293-L297 WeakPolarHBondContact O-CB 3.33Å; V293-L297 PolarHBondContact O-N 3.27Å; Y294-L297 PolarHBondContact O-N 3.35Å; L297-G300 PolarHBondContact O-N 3.06Å; L297-V301 PolarHBondContact O-N 3.24Å; L297-V301 VanDerWaalsContact O-N 3.08Å; L297-F363 HydrophobicContact CD2-CE2 4.41Å; L297-F363 HydrophobicContact CD2-CZ 4.09Å; L297-M497 HydrophobicContact CD1-CE 4.39Å; L297-M497 HydrophobicContact CD1-CG 4.31Å; L297-M497 HydrophobicContact CD1-SD 4.34Å; L297-M497 HydrophobicContact CD2-CE 4.48Å
298	M	97.8	Very high	96.6	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-67	-38.7	-177.1	-69.9	-59.5	150.6	0	0	112.8	Y294 V301 I302 P340 F375 V376 P379	Y294-M298 HydrophobicContact CD1-CG 4.22Å; Y294-M298 HydrophobicContact CD2-CE 4.4Å; Y294-M298 HydrophobicContact CD2-CG 4.43Å; Y294-M298 HydrophobicContact CE1-CG 3.7Å; Y294-M298 HydrophobicContact CE2-CE 3.7Å; Y294-M298 HydrophobicContact CE2-CG 3.95Å; Y294-M298 WeakPolarHBondContact O-CB 3.47Å; Y294-M298 WeakPolarHBondContact O-CG 3.47Å; Y294-M298 PolarHBondContact O-N 3.24Å; M298-V301 VanDerWaalsContact O-CG2 3.32Å; M298-V301 WeakPolarHBondContact O-CG2 3.16Å; M298-V301 HydrophobicContact SD-CG2 4.36Å; M298-I302 VanDerWaalsContact O-CG1 3.29Å; M298-I302 WeakPolarHBondContact O-CG1 3.24Å; M298-I302 PolarHBondContact O-N 2.99Å; M298-P340 HydrophobicContact CB-CB 3.9Å; M298-P340 HydrophobicContact CB-CG 4Å; M298-F375 WeakPolarHBondContact CE-O 3.37Å; M298-V376 HydrophobicContact CE-CB 4.32Å; M298-V376 HydrophobicContact CE-CG1 4.07Å; M298-V376 HydrophobicContact CE-CG2 4.38Å; M298-P379 HydrophobicContact SD-CB 4.08Å
299	S	97.6	Very high	96.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.1	-42.4	172.9	-172.8	0	0	0	0	111.7	C245 Y295 V301 I302 W303 T336 W337	C245-S299 PolarHBondContact SG-OG 2.93Å; Y295-S299 VanDerWaalsContact O-CB 3.29Å; Y295-S299 WeakPolarHBondContact O-CB 3.24Å; Y295-S299 PolarHBondContact O-N 3.49Å; S299-V301 PolarHBondContact O-N 3.33Å; S299-I302 PolarHBondContact O-N 3.31Å; S299-W303 WeakPolarHBondContact O-CB 3.44Å; S299-W303 VanDerWaalsContact O-CD1 3.25Å; S299-W303 PolarHBondContact O-N 3.49Å; S299-W303 VanDerWaalsContact OG-CD1 3.26Å; S299-W303 PolarHBondContact OG-NE1 3.33Å; S299-T336 PolarHBondContact OG-O 3.29Å; S299-W337 VanDerWaalsContact OG-CE3 3.23Å; S299-W337 WeakPolarHBondContact OG-CZ3 3.5Å
300	G	96.6	Very high	96	Very high	4 Å²	4	16.9 Å²	16.9	4%	0.041	8%	0.082	C	C	.	.	H	α-helix	trans	-57.1	-45.4	177.7	0	0	0	0	0	113.4	S296 L297 W303 F304	S296-G300 PolarHBondContact O-N 3.46Å; L297-G300 PolarHBondContact O-N 3.06Å; G300-W303 PolarHBondContact O-N 3.5Å; G300-F304 PolarHBondContact O-N 2.89Å
301	V	96.3	Very high	95.5	Very high	10 Å²	10	17.3 Å²	17.3	6%	0.061	8%	0.084	C	C	.	.	H	α-helix	trans	-71.8	-30.3	179.2	-61	0	0	0	0	113.1	L297 M298 S299 F304 V305 V383 V435	L297-V301 PolarHBondContact O-N 3.24Å; L297-V301 VanDerWaalsContact O-N 3.08Å; M298-V301 VanDerWaalsContact O-CG2 3.32Å; M298-V301 WeakPolarHBondContact O-CG2 3.16Å; M298-V301 HydrophobicContact SD-CG2 4.36Å; S299-V301 PolarHBondContact O-N 3.33Å; V301-F304 WeakPolarHBondContact O-CB 3.16Å; V301-F304 PolarHBondContact O-N 2.94Å; V301-V305 PolarHBondContact O-N 2.83Å; V301-V383 HydrophobicContact CB-CG1 4.17Å; V301-V383 HydrophobicContact CB-CG2 4.31Å; V301-V383 HydrophobicContact CG2-CG2 4.14Å; V301-V383 WeakPolarHBondContact O-CG1 3.38Å; V301-V435 HydrophobicContact CG1-CG2 4.45Å
302	I	96.9	Very high	95.1	Very high	19 Å²	19	15.6 Å²	15.6	10%	0.097	8%	0.075	C	C	.	.	H	α-helix	trans	-76.1	-37.7	174.2	-61.6	169.3	0	0	0	111	M298 S299 F304 V305 M306 V335 T336 I339 P340 V383	M298-I302 VanDerWaalsContact O-CG1 3.29Å; M298-I302 WeakPolarHBondContact O-CG1 3.24Å; M298-I302 PolarHBondContact O-N 2.99Å; S299-I302 PolarHBondContact O-N 3.31Å; I302-F304 VanDerWaalsContact C-N 3.25Å; I302-F304 PolarHBondContact O-N 2.71Å; I302-V305 WeakPolarHBondContact O-CB 3.32Å; I302-V305 PolarHBondContact O-N 3.27Å; I302-M306 PolarHBondContact O-N 3.43Å; I302-V335 HydrophobicContact CG2-CG1 4.24Å; I302-T336 HydrophobicContact CG2-CG2 3.88Å; I302-I339 HydrophobicContact CD1-CB 3.79Å; I302-I339 HydrophobicContact CD1-CG2 3.57Å; I302-P340 HydrophobicContact CD1-CG 3.97Å; I302-V383 HydrophobicContact CG1-CG2 4.49Å
303	W	96.8	Very high	94.4	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.4	-32.4	170.2	-83.9	116.1	0	0	0	112.4	I238 Y241 I242 S299 G300 M306 L307 F332 H333 T336 W337	I238-W303 HydrophobicContact CG1-CE3 4.45Å; I238-W303 HydrophobicContact CG1-CZ3 4.21Å; I238-W303 HydrophobicContact CG2-CE3 3.94Å; Y241-W303 HydrophobicContact CD1-CZ2 4.43Å; Y241-W303 AromaticContact CD2-CH2 3.52Å; Y241-W303 HydrophobicContact CD2-CH2 3.52Å; Y241-W303 AromaticContact CD2-CZ2 3.67Å; Y241-W303 HydrophobicContact CD2-CZ2 3.67Å; Y241-W303 HydrophobicContact CD2-CZ3 4.06Å; Y241-W303 HydrophobicContact CE2-CH2 4.13Å; Y241-W303 HydrophobicContact CE2-CZ2 4.43Å; Y241-W303 HydrophobicContact CG-CH2 4.04Å; Y241-W303 AromaticContact CG-CZ2 3.69Å; Y241-W303 HydrophobicContact CG-CZ2 3.69Å; I242-W303 HydrophobicContact CD1-CB 4.27Å; I242-W303 HydrophobicContact CG1-CB 3.54Å; I242-W303 HydrophobicContact CG1-CG 4.44Å; S299-W303 WeakPolarHBondContact O-CB 3.44Å; S299-W303 VanDerWaalsContact O-CD1 3.25Å; S299-W303 PolarHBondContact O-N 3.49Å; S299-W303 VanDerWaalsContact OG-CD1 3.26Å; S299-W303 PolarHBondContact OG-NE1 3.33Å; G300-W303 PolarHBondContact O-N 3.5Å; W303-M306 HydrophobicContact CE3-CB 4.06Å; W303-M306 HydrophobicContact CE3-CG 4.26Å; W303-M306 WeakPolarHBondContact O-CB 3.48Å; W303-M306 PolarHBondContact O-N 3.45Å; W303-L307 PolarHBondContact O-N 2.79Å; W303-F332 HydrophobicContact CZ3-CB 4.42Å; W303-H333 AromaticContact CH2-CD2 3.78Å; W303-H333 AromaticContact CH2-NE2 3.74Å; W303-T336 HydrophobicContact CD2-CG2 3.48Å; W303-T336 VanDerWaalsContact CD2-CG2 3.48Å; W303-T336 VanDerWaalsContact CE2-OG1 3.23Å; W303-T336 HydrophobicContact CE3-CG2 3.76Å; W303-T336 HydrophobicContact CG-CG2 3.83Å; W303-T336 HydrophobicContact CH2-CG2 4.38Å; W303-T336 HydrophobicContact CZ2-CG2 4.13Å; W303-T336 WeakPolarHBondContact CZ2-OG1 3.35Å; W303-T336 HydrophobicContact CZ3-CG2 4.2Å; W303-T336 PolarHBondContact NE1-OG1 2.91Å; W303-W337 AromaticContact CE2-CZ2 3.77Å; W303-W337 AromaticContact CZ2-CE2 3.89Å; W303-W337 AromaticContact CZ2-CZ2 3.74Å; W303-W337 HydrophobicContact CZ2-CZ2 3.74Å; W303-W337 AromaticContact CZ2-NE1 3.81Å; W303-W337 AromaticContact NE1-CE2 3.71Å; W303-W337 AromaticContact NE1-CH2 3.38Å; W303-W337 AromaticContact NE1-CZ2 3.22Å; W303-W337 AromaticContact NE1-CZ3 3.99Å
304	F	95.5	Very high	93.7	Very high	8 Å²	8	14.9 Å²	14.9	4%	0.035	7%	0.073	C	C	.	.	H	α-helix	trans	-61.6	-40.4	168.5	160.4	-101.3	0	0	0	112.3	G300 V301 I302 M306 L307 T308 V383 L391 G428 A431 F432	G300-F304 PolarHBondContact O-N 2.89Å; V301-F304 WeakPolarHBondContact O-CB 3.16Å; V301-F304 PolarHBondContact O-N 2.94Å; I302-F304 VanDerWaalsContact C-N 3.25Å; I302-F304 PolarHBondContact O-N 2.71Å; F304-M306 VanDerWaalsContact C-N 3.33Å; F304-M306 PolarHBondContact O-N 3.15Å; F304-L307 WeakPolarHBondContact O-CB 2.95Å; F304-L307 PolarHBondContact O-N 3.39Å; F304-T308 HydrophobicContact CD2-CG2 4.18Å; F304-T308 HydrophobicContact CE1-CG2 4.33Å; F304-T308 HydrophobicContact CE2-CG2 3.52Å; F304-T308 HydrophobicContact CZ-CG2 3.61Å; F304-T308 PolarHBondContact O-N 3.49Å; F304-V383 HydrophobicContact CD1-CG1 3.75Å; F304-V383 HydrophobicContact CE1-CG1 4.07Å; F304-L391 HydrophobicContact CZ-CD1 4.34Å; F304-G428 WeakPolarHBondContact CE2-O 3.36Å; F304-A431 HydrophobicContact CD2-CB 3.58Å; F304-A431 HydrophobicContact CE2-CB 3.72Å; F304-F432 HydrophobicContact CE2-CB 4.34Å; F304-F432 HydrophobicContact CZ-CB 3.85Å; F304-F432 HydrophobicContact CZ-CD2 4.07Å; F304-F432 HydrophobicContact CZ-CG 4.48Å
305	V	95.9	Very high	92.6	Very high	21 Å²	21	15 Å²	15	13%	0.127	7%	0.074	C	C	.	.	H	α-helix	trans	-60	-45	171.2	-177.5	0	0	0	0	110.7	V301 I302 L307 T308 Y309 V383 V386 F390	V301-V305 PolarHBondContact O-N 2.83Å; I302-V305 WeakPolarHBondContact O-CB 3.32Å; I302-V305 PolarHBondContact O-N 3.27Å; V305-L307 VanDerWaalsContact C-N 3.27Å; V305-L307 PolarHBondContact O-N 3.46Å; V305-T308 PolarHBondContact O-N 3.33Å; V305-T308 PolarHBondContact O-OG1 2.95Å; V305-Y309 PolarHBondContact O-N 2.93Å; V305-V383 HydrophobicContact CG2-CB 4.05Å; V305-V383 HydrophobicContact CG2-CG1 3.7Å; V305-V383 HydrophobicContact CG2-CG2 3.85Å; V305-V386 HydrophobicContact CG1-CB 4.41Å; V305-V386 HydrophobicContact CG1-CG1 3.67Å; V305-F390 HydrophobicContact CG1-CD2 4.44Å; V305-F390 HydrophobicContact CG1-CE2 4.35Å
306	M	93.7	Very high	91.7	Very high	21 Å²	21	19.2 Å²	19.2	10%	0.103	9%	0.093	C	C	.	.	H	α-helix	trans	-60.5	-36	176.3	-62	-59.8	175.7	0	0	112.5	I302 W303 F304 A310 F332 V335 T336	I302-M306 PolarHBondContact O-N 3.43Å; W303-M306 HydrophobicContact CE3-CB 4.06Å; W303-M306 HydrophobicContact CE3-CG 4.26Å; W303-M306 WeakPolarHBondContact O-CB 3.48Å; W303-M306 PolarHBondContact O-N 3.45Å; F304-M306 VanDerWaalsContact C-N 3.33Å; F304-M306 PolarHBondContact O-N 3.15Å; M306-A310 WeakPolarHBondContact O-CB 3.25Å; M306-A310 PolarHBondContact O-N 3.42Å; M306-F332 HydrophobicContact CE-CD1 4.43Å; M306-F332 HydrophobicContact CG-CG 4.5Å; M306-F332 HydrophobicContact SD-CB 4.21Å; M306-F332 HydrophobicContact SD-CD1 3.67Å; M306-F332 HydrophobicContact SD-CD2 4.49Å; M306-F332 HydrophobicContact SD-CE1 4.12Å; M306-F332 HydrophobicContact SD-CG 3.89Å; M306-V335 HydrophobicContact CE-CB 3.65Å; M306-V335 HydrophobicContact CE-CG1 3.49Å; M306-V335 VanDerWaalsContact CE-CG1 3.49Å; M306-V335 HydrophobicContact CE-CG2 4.47Å; M306-T336 HydrophobicContact CE-CG2 4.1Å; M306-T336 HydrophobicContact CG-CG2 3.65Å
307	L	91.8	Very high	90.5	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-62.2	-48.9	173.9	-172.2	71.2	0	0	0	111.5	I238 L239 I242 W303 F304 V305 A310 W311 L424 M504	I238-L307 HydrophobicContact CB-CD1 4.3Å; I238-L307 HydrophobicContact CG2-CB 3.92Å; I238-L307 HydrophobicContact CG2-CD1 3.93Å; L239-L307 HydrophobicContact CD2-CD1 3.79Å; L239-L307 HydrophobicContact CD2-CD2 3.89Å; L239-L307 HydrophobicContact CG-CD1 3.97Å; I242-L307 HydrophobicContact CD1-CB 4.16Å; I242-L307 HydrophobicContact CD1-CD2 4.01Å; W303-L307 PolarHBondContact O-N 2.79Å; F304-L307 WeakPolarHBondContact O-CB 2.95Å; F304-L307 PolarHBondContact O-N 3.39Å; V305-L307 VanDerWaalsContact C-N 3.27Å; V305-L307 PolarHBondContact O-N 3.46Å; L307-A310 PolarHBondContact O-N 2.95Å; L307-W311 VanDerWaalsContact O-CB 3.28Å; L307-W311 WeakPolarHBondContact O-CB 3.4Å; L307-W311 PolarHBondContact O-N 3.22Å; L307-L424 HydrophobicContact CD1-CD1 3.8Å; L307-M504 HydrophobicContact CD2-SD 4.42Å
308	T	93.3	Very high	89.1	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-38.9	178.7	64.5	0	0	0	0	112.4	F304 V305 W311 H312 L391	F304-T308 HydrophobicContact CD2-CG2 4.18Å; F304-T308 HydrophobicContact CE1-CG2 4.33Å; F304-T308 HydrophobicContact CE2-CG2 3.52Å; F304-T308 HydrophobicContact CZ-CG2 3.61Å; F304-T308 PolarHBondContact O-N 3.49Å; V305-T308 PolarHBondContact O-N 3.33Å; V305-T308 PolarHBondContact O-OG1 2.95Å; T308-W311 PolarHBondContact O-N 3.4Å; T308-H312 PolarHBondContact O-N 2.9Å; T308-L391 HydrophobicContact CG2-CD1 4.01Å; T308-L391 HydrophobicContact CG2-CD2 3.96Å; T308-L391 HydrophobicContact CG2-CG 3.71Å
309	Y	91.9	Very high	87.2	Confident	56 Å²	56	24.8 Å²	24.8	22%	0.22	14%	0.143	C	C	.	.	H	α-helix	trans	-64.2	-47.6	174.4	176	-99.7	0	0	0	111.9	V305 W311 H312 T313 L325 F332 F390	V305-Y309 PolarHBondContact O-N 2.93Å; Y309-W311 VanDerWaalsContact C-N 3.29Å; Y309-W311 PolarHBondContact O-N 3.04Å; Y309-H312 PolarHBondContact O-N 3.46Å; Y309-T313 HydrophobicContact CD1-CG2 4.44Å; Y309-T313 HydrophobicContact CD2-CG2 4.23Å; Y309-T313 HydrophobicContact CE1-CG2 3.98Å; Y309-T313 HydrophobicContact CE2-CG2 3.77Å; Y309-T313 WeakPolarHBondContact O-CB 3.17Å; Y309-T313 WeakPolarHBondContact O-CG2 3.37Å; Y309-T313 PolarHBondContact O-N 3.19Å; Y309-T313 PolarHBondContact O-OG1 3.36Å; Y309-L325 HydrophobicContact CE1-CD2 4.31Å; Y309-F332 AromaticContact CD1-CE1 3.99Å; Y309-F332 HydrophobicContact CD1-CE1 3.99Å; Y309-F332 AromaticContact CD1-CZ 3.66Å; Y309-F332 HydrophobicContact CD1-CZ 3.66Å; Y309-F332 AromaticContact CE1-CE1 3.9Å; Y309-F332 HydrophobicContact CE1-CE1 3.9Å; Y309-F332 AromaticContact CE1-CZ 3.71Å; Y309-F332 HydrophobicContact CE1-CZ 3.71Å; Y309-F390 HydrophobicContact CD2-CD1 4.22Å; Y309-F390 HydrophobicContact CD2-CD2 4.44Å; Y309-F390 AromaticContact CD2-CE1 3.74Å; Y309-F390 HydrophobicContact CD2-CE1 3.74Å; Y309-F390 AromaticContact CD2-CE2 3.97Å; Y309-F390 HydrophobicContact CD2-CE2 3.97Å; Y309-F390 AromaticContact CD2-CZ 3.61Å; Y309-F390 HydrophobicContact CD2-CZ 3.61Å; Y309-F390 HydrophobicContact CE2-CE1 4.35Å; Y309-F390 HydrophobicContact CE2-CZ 4.33Å; Y309-F390 HydrophobicContact CG-CE2 4.49Å
310	A	88.8	Confident	85.6	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-36.5	178.1	0	0	0	0	0	111.7	P235 I238 M306 L307 T313 S314 L325	P235-A310 HydrophobicContact CB-CB 4Å; I238-A310 HydrophobicContact CD1-CB 3.56Å; M306-A310 WeakPolarHBondContact O-CB 3.25Å; M306-A310 PolarHBondContact O-N 3.42Å; L307-A310 PolarHBondContact O-N 2.95Å; A310-T313 WeakPolarHBondContact CA-OG1 3.47Å; A310-T313 PolarHBondContact O-OG1 3.4Å; A310-S314 VanDerWaalsContact O-CB 3.26Å; A310-S314 WeakPolarHBondContact O-CB 3.29Å; A310-S314 PolarHBondContact O-N 3.06Å; A310-S314 PolarHBondContact O-OG 2.85Å; A310-L325 HydrophobicContact CB-CD1 3.94Å; A310-L325 HydrophobicContact CB-CD2 4.43Å
311	W	87.9	Confident	83.7	Confident	10 Å²	10	33.5 Å²	33.5	4%	0.038	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-51.2	174.5	-177.3	69.9	0	0	0	112.5	L307 T308 Y309 T313 S314 F315 L391 V395 M421 G425 F429	L307-W311 VanDerWaalsContact O-CB 3.28Å; L307-W311 WeakPolarHBondContact O-CB 3.4Å; L307-W311 PolarHBondContact O-N 3.22Å; T308-W311 PolarHBondContact O-N 3.4Å; Y309-W311 VanDerWaalsContact C-N 3.29Å; Y309-W311 PolarHBondContact O-N 3.04Å; W311-T313 PolarHBondContact O-N 3.19Å; W311-S314 PolarHBondContact O-N 3.16Å; W311-F315 HydrophobicContact CD2-CD2 4.38Å; W311-F315 HydrophobicContact CD2-CE2 4.31Å; W311-F315 AromaticContact CE2-CE2 3.51Å; W311-F315 HydrophobicContact CH2-CE2 4.43Å; W311-F315 HydrophobicContact CZ2-CD2 4.24Å; W311-F315 AromaticContact CZ2-CE2 3.6Å; W311-F315 HydrophobicContact CZ2-CE2 3.6Å; W311-F315 AromaticContact NE1-CE2 3.47Å; W311-F315 PolarHBondContact O-N 2.79Å; W311-L391 HydrophobicContact CE3-CD2 3.95Å; W311-L391 HydrophobicContact CZ3-CD2 3.88Å; W311-V395 HydrophobicContact CH2-CG2 3.87Å; W311-V395 HydrophobicContact CZ3-CG2 4.43Å; W311-M421 PolarHBondContact NE1-O 3.2Å; W311-G425 VanDerWaalsContact CZ2-CA 3.43Å; W311-G425 VanDerWaalsContact NE1-N 3.12Å; W311-F429 AromaticContact CH2-CE2 3.9Å; W311-F429 HydrophobicContact CH2-CE2 3.9Å; W311-F429 HydrophobicContact CZ3-CE2 4.34Å
312	H	88	Confident	82.1	Confident	29 Å²	29	39.2 Å²	39.2	13%	0.134	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-46.4	177.2	168.7	46.6	0	0	0	112.4	T308 Y309 S314 F315 K316 F390	T308-H312 PolarHBondContact O-N 2.9Å; Y309-H312 PolarHBondContact O-N 3.46Å; H312-S314 PolarHBondContact O-N 3.44Å; H312-F315 PolarHBondContact O-N 3.31Å; H312-K316 PolarHBondContact O-N 3.32Å; H312-K316 VanDerWaalsContact O-N 3.17Å; H312-F390 HydrophobicContact CB-CB 4.42Å
313	T	85.3	Confident	80.6	Confident	17 Å²	17	42.7 Å²	42.7	10%	0.104	24%	0.237	C	C	.	.	H	α-helix	trans	-68.2	-33.5	-179.4	49.7	0	0	0	0	112.7	Y309 A310 W311 F315 K316 A317	Y309-T313 HydrophobicContact CD1-CG2 4.44Å; Y309-T313 HydrophobicContact CD2-CG2 4.23Å; Y309-T313 HydrophobicContact CE1-CG2 3.98Å; Y309-T313 HydrophobicContact CE2-CG2 3.77Å; Y309-T313 WeakPolarHBondContact O-CB 3.17Å; Y309-T313 WeakPolarHBondContact O-CG2 3.37Å; Y309-T313 PolarHBondContact O-N 3.19Å; Y309-T313 PolarHBondContact O-OG1 3.36Å; A310-T313 WeakPolarHBondContact CA-OG1 3.47Å; A310-T313 PolarHBondContact O-OG1 3.4Å; W311-T313 PolarHBondContact O-N 3.19Å; T313-F315 VanDerWaalsContact C-N 3.33Å; T313-F315 PolarHBondContact O-N 3.28Å; T313-K316 PolarHBondContact O-N 2.94Å; T313-A317 PolarHBondContact O-N 3.13Å; T313-A317 VanDerWaalsContact O-N 3.14Å
314	S	81.5	Confident	79.3	Confident	19 Å²	19	44.2 Å²	44.2	13%	0.133	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-41.2	172.3	-61.1	0	0	0	0	111.6	A310 W311 H312 A317 L318	A310-S314 VanDerWaalsContact O-CB 3.26Å; A310-S314 WeakPolarHBondContact O-CB 3.29Å; A310-S314 PolarHBondContact O-N 3.06Å; A310-S314 PolarHBondContact O-OG 2.85Å; W311-S314 PolarHBondContact O-N 3.16Å; H312-S314 PolarHBondContact O-N 3.44Å; S314-A317 PolarHBondContact O-N 3.03Å; S314-L318 PolarHBondContact O-N 2.65Å
315	F	76.8	Confident	78.3	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-40.5	174	-89.4	-59.6	0	0	0	112.8	W311 H312 T313 A317 L318 T397 L398 I401 M421	W311-F315 HydrophobicContact CD2-CD2 4.38Å; W311-F315 HydrophobicContact CD2-CE2 4.31Å; W311-F315 AromaticContact CE2-CE2 3.51Å; W311-F315 HydrophobicContact CH2-CE2 4.43Å; W311-F315 HydrophobicContact CZ2-CD2 4.24Å; W311-F315 AromaticContact CZ2-CE2 3.6Å; W311-F315 HydrophobicContact CZ2-CE2 3.6Å; W311-F315 AromaticContact NE1-CE2 3.47Å; W311-F315 PolarHBondContact O-N 2.79Å; H312-F315 PolarHBondContact O-N 3.31Å; T313-F315 VanDerWaalsContact C-N 3.33Å; T313-F315 PolarHBondContact O-N 3.28Å; F315-A317 PolarHBondContact O-N 3.5Å; F315-L318 HydrophobicContact CD1-CD1 3.64Å; F315-L318 HydrophobicContact CE1-CD1 3.99Å; F315-L318 PolarHBondContact O-N 3.24Å; F315-T397 HydrophobicContact CB-CG2 4.09Å; F315-L398 HydrophobicContact CD1-CB 4.44Å; F315-L398 HydrophobicContact CD1-CD1 4.42Å; F315-L398 HydrophobicContact CE1-CB 4.32Å; F315-L398 HydrophobicContact CE1-CD1 3.7Å; F315-L398 HydrophobicContact CE1-CG 4.42Å; F315-L398 HydrophobicContact CZ-CB 4.36Å; F315-L398 HydrophobicContact CZ-CD1 4Å; F315-L398 HydrophobicContact CZ-CD2 4.13Å; F315-L398 HydrophobicContact CZ-CG 4.39Å; F315-I401 WeakPolarHBondContact O-CD1 3.4Å; F315-M421 HydrophobicContact CB-CE 4.32Å; F315-M421 HydrophobicContact CD1-CE 3.6Å; F315-M421 HydrophobicContact CD2-CE 4.08Å; F315-M421 HydrophobicContact CE1-CB 4.19Å; F315-M421 HydrophobicContact CE1-CE 3.75Å; F315-M421 HydrophobicContact CE1-SD 4.43Å; F315-M421 HydrophobicContact CE2-CB 4.33Å; F315-M421 HydrophobicContact CE2-CE 4.26Å; F315-M421 HydrophobicContact CG-CE 3.74Å; F315-M421 HydrophobicContact CZ-CB 3.77Å; F315-M421 HydrophobicContact CZ-CE 4.09Å
316	K	77.6	Confident	77.1	Confident	155 Å²	155	47.3 Å²	47.3	67%	0.674	27%	0.269	S	S	*	.	H	α-helix	trans	-65.5	-23.7	177.6	-171.4	174.1	178.8	-178.7	0	113.4	H312 T313	H312-K316 PolarHBondContact O-N 3.32Å; H312-K316 VanDerWaalsContact O-N 3.17Å; T313-K316 PolarHBondContact O-N 2.94Å
317	A	73.6	Confident	76.3	Confident	18 Å²	18	49.5 Å²	49.5	15%	0.149	30%	0.297	C	S	.	.	H	α-helix	trans	-88.6	-8.8	178.3	0	0	0	0	0	114.5	T313 S314 F315 G319 T320 P324	T313-A317 PolarHBondContact O-N 3.13Å; T313-A317 VanDerWaalsContact O-N 3.14Å; S314-A317 PolarHBondContact O-N 3.03Å; F315-A317 PolarHBondContact O-N 3.5Å; A317-G319 PolarHBondContact O-N 3.37Å; A317-T320 PolarHBondContact O-N 3.36Å; A317-T320 PolarHBondContact O-OG1 3.27Å; A317-P324 HydrophobicContact CB-CB 4.34Å; A317-P324 HydrophobicContact CB-CG 3.68Å
318	L	67.3	Low	75.9	Confident	52 Å²	52	55.4 Å²	55.4	27%	0.272	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	125.2	176.3	-72.3	-177.6	0	0	0	111	S314 F315 I401 I417 M421	S314-L318 PolarHBondContact O-N 2.65Å; F315-L318 HydrophobicContact CD1-CD1 3.64Å; F315-L318 HydrophobicContact CE1-CD1 3.99Å; F315-L318 PolarHBondContact O-N 3.24Å; L318-I401 HydrophobicContact CB-CD1 4.44Å; L318-I417 HydrophobicContact CD2-CG2 3.93Å; L318-M421 HydrophobicContact CD1-CE 4.08Å; L318-M421 HydrophobicContact CD1-SD 4.06Å; L318-M421 HydrophobicContact CD2-CE 4.32Å; L318-M421 HydrophobicContact CD2-SD 3.78Å; L318-M421 HydrophobicContact CG-CE 4.14Å; L318-M421 HydrophobicContact CG-SD 4.18Å
319	G	57.5	Low	75.4	Confident	76 Å²	76	57.9 Å²	57.9	78%	0.784	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-1.5	-174.6	0	0	0	0	0	114.8	A317	A317-G319 PolarHBondContact O-N 3.37Å
320	T	64.1	Low	75.3	Confident	69 Å²	69	59.2 Å²	59.2	42%	0.423	35%	0.352	S	S	.	.			trans	-112.6	152.1	173.4	73.8	0	0	0	0	111.2	A317 H322	A317-T320 PolarHBondContact O-N 3.36Å; A317-T320 PolarHBondContact O-OG1 3.27Å; T320-H322 VanDerWaalsContact C-N 3.27Å
321	T	58	Low	75.4	Confident	118 Å²	118	66.5 Å²	66.5	72%	0.724	38%	0.381	S	S	*	.	S	Bend	trans	-80.2	-5.5	174.2	47.8	0	0	0	0	113.6	Q323	T321-Q323 PolarHBondContact O-N 3.08Å
322	H	61.5	Low	75.6	Confident	130 Å²	130	66.7 Å²	66.7	60%	0.602	38%	0.382	S	S	*	.			trans	-89.4	108.1	-172	179.4	-66.5	0	0	0	111.6	T320 P324	T320-H322 VanDerWaalsContact C-N 3.27Å; H322-P324 WeakPolarHBondContact O-CD 3.34Å; H322-P324 VanDerWaalsContact O-N 3.14Å
323	Q	65.9	Low	75.9	Confident	92 Å²	92	67.7 Å²	67.7	43%	0.43	39%	0.387	S	S	.	.			trans	-65	108.1	172.6	-63.4	-176.7	8.3	0	0	110.6	T321 L325 S326 F577 D578	T321-Q323 PolarHBondContact O-N 3.08Å; Q323-L325 VanDerWaalsContact C-N 3.26Å; Q323-L325 PolarHBondContact O-N 3.16Å; Q323-S326 PolarHBondContact O-N 3.37Å; Q323-F577 PolarHBondContact NE2-O 3.3Å; Q323-F577 VanDerWaalsContact NE2-O 3.1Å; Q323-D578 PolarHBondContact NE2-OD1 2.96Å
324	P	68.8	Low	76.4	Confident	33 Å²	33	71.8 Å²	71.8	21%	0.214	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-10.9	-166.1	32.4	-37.3	0	0	0	114.5	A317 H322	A317-P324 HydrophobicContact CB-CB 4.34Å; A317-P324 HydrophobicContact CB-CG 3.68Å; H322-P324 WeakPolarHBondContact O-CD 3.34Å; H322-P324 VanDerWaalsContact O-N 3.14Å
325	L	75.2	Confident	77	Confident	12 Å²	12	73.5 Å²	73.5	6%	0.063	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-11.4	-177	-59	176.8	0	0	0	113	P235 Y309 A310 Q323 R328 F332	P235-L325 HydrophobicContact CB-CD1 4.35Å; Y309-L325 HydrophobicContact CE1-CD2 4.31Å; A310-L325 HydrophobicContact CB-CD1 3.94Å; A310-L325 HydrophobicContact CB-CD2 4.43Å; Q323-L325 VanDerWaalsContact C-N 3.26Å; Q323-L325 PolarHBondContact O-N 3.16Å; L325-R328 PolarHBondContact O-N 2.87Å; L325-F332 HydrophobicContact CD2-CE2 4.04Å; L325-F332 HydrophobicContact CD2-CZ 3.75Å
326	S	71.6	Confident	77.9	Confident	81 Å²	81	73.4 Å²	73.4	57%	0.566	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	144.6	179.3	-165.3	0	0	0	0	110.9	Q323 R328	Q323-S326 PolarHBondContact O-N 3.37Å; S326-R328 PolarHBondContact O-N 2.83Å
327	G	76.8	Confident	78.9	Confident	67 Å²	67	69.5 Å²	69.5	69%	0.691	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	-7.1	-174.6	0	0	0	0	0	116.3
328	R	81.9	Confident	80	Confident	127 Å²	127	71.5 Å²	71.5	48%	0.479	41%	0.409	S	S	.	.			trans	-103.6	-4.5	-177.1	-64	-177.3	-179.8	-168.9	-1	114.7	L325 S326 S330 Y331	L325-R328 PolarHBondContact O-N 2.87Å; S326-R328 PolarHBondContact O-N 2.83Å; R328-S330 VanDerWaalsContact C-N 3.33Å; R328-S330 PolarHBondContact O-N 3.48Å; R328-Y331 WeakPolarHBondContact O-CB 3.42Å; R328-Y331 PolarHBondContact O-N 3.01Å; R328-Y331 VanDerWaalsContact O-N 3.16Å
329	T	84.3	Confident	81.4	Confident	52 Å²	52	72.8 Å²	72.8	32%	0.319	42%	0.415	S	S	.	.	H	α-helix	trans	-59.1	-38.6	-172.5	56.1	0	0	0	0	113.5	Y234 Y331 F332 H333	Y234-T329 HydrophobicContact CD2-CG2 3.44Å; Y234-T329 VanDerWaalsContact CD2-CG2 3.44Å; Y234-T329 HydrophobicContact CE2-CG2 3.25Å; Y234-T329 HydrophobicContact CG-CG2 4.2Å; T329-Y331 VanDerWaalsContact C-N 3.33Å; T329-Y331 PolarHBondContact O-N 3.48Å; T329-F332 WeakPolarHBondContact O-CB 3.27Å; T329-F332 PolarHBondContact O-N 3.39Å; T329-F332 VanDerWaalsContact O-N 3.16Å; T329-H333 PolarHBondContact O-CD2 3.23Å; T329-H333 PolarHBondContact O-N 3.23Å
330	S	89.3	Confident	83.3	Confident	85 Å²	85	69.1 Å²	69.1	59%	0.594	38%	0.378	S	S	*	.	H	α-helix	trans	-57.3	-42.9	176.4	179.7	0	0	0	0	112.4	R328 F332 H333 M334	R328-S330 VanDerWaalsContact C-N 3.33Å; R328-S330 PolarHBondContact O-N 3.48Å; S330-F332 VanDerWaalsContact C-N 3.3Å; S330-F332 PolarHBondContact O-N 2.78Å; S330-H333 PolarHBondContact O-N 2.96Å; S330-M334 WeakPolarHBondContact O-CB 3.25Å; S330-M334 PolarHBondContact O-N 3.17Å
331	Y	91.5	Very high	84.9	Confident	152 Å²	152	71.8 Å²	71.8	60%	0.596	38%	0.384	S	S	*	.	H	α-helix	trans	-63.2	-34.4	178	-67.4	-84.3	0	0	0	112.8	R328 T329 M334 V335	R328-Y331 WeakPolarHBondContact O-CB 3.42Å; R328-Y331 PolarHBondContact O-N 3.01Å; R328-Y331 VanDerWaalsContact O-N 3.16Å; T329-Y331 VanDerWaalsContact C-N 3.33Å; T329-Y331 PolarHBondContact O-N 3.48Å; Y331-M334 HydrophobicContact CD1-CE 3.85Å; Y331-M334 HydrophobicContact CE1-CE 4.36Å; Y331-V335 WeakPolarHBondContact O-CB 3.42Å; Y331-V335 VanDerWaalsContact O-CG2 3.31Å; Y331-V335 WeakPolarHBondContact O-CG2 3.46Å; Y331-V335 PolarHBondContact O-N 3.35Å
332	F	92	Very high	86.8	Confident	14 Å²	14	70.7 Å²	70.7	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-63.3	-49.4	176.7	-68.9	0.7	0	0	0	110.5	Y234 I238 W303 M306 Y309 L325 T329 S330 V335 T336	Y234-F332 HydrophobicContact CD1-CD2 4.29Å; Y234-F332 HydrophobicContact CD1-CE2 4.36Å; Y234-F332 AromaticContact CE1-CD2 3.82Å; Y234-F332 HydrophobicContact CE1-CD2 3.82Å; Y234-F332 HydrophobicContact CE1-CE2 4.35Å; I238-F332 HydrophobicContact CD1-CE2 4.48Å; W303-F332 HydrophobicContact CZ3-CB 4.42Å; M306-F332 HydrophobicContact CE-CD1 4.43Å; M306-F332 HydrophobicContact CG-CG 4.5Å; M306-F332 HydrophobicContact SD-CB 4.21Å; M306-F332 HydrophobicContact SD-CD1 3.67Å; M306-F332 HydrophobicContact SD-CD2 4.49Å; M306-F332 HydrophobicContact SD-CE1 4.12Å; M306-F332 HydrophobicContact SD-CG 3.89Å; Y309-F332 AromaticContact CD1-CE1 3.99Å; Y309-F332 HydrophobicContact CD1-CE1 3.99Å; Y309-F332 AromaticContact CD1-CZ 3.66Å; Y309-F332 HydrophobicContact CD1-CZ 3.66Å; Y309-F332 AromaticContact CE1-CE1 3.9Å; Y309-F332 HydrophobicContact CE1-CE1 3.9Å; Y309-F332 AromaticContact CE1-CZ 3.71Å; Y309-F332 HydrophobicContact CE1-CZ 3.71Å; L325-F332 HydrophobicContact CD2-CE2 4.04Å; L325-F332 HydrophobicContact CD2-CZ 3.75Å; T329-F332 WeakPolarHBondContact O-CB 3.27Å; T329-F332 PolarHBondContact O-N 3.39Å; T329-F332 VanDerWaalsContact O-N 3.16Å; S330-F332 VanDerWaalsContact C-N 3.3Å; S330-F332 PolarHBondContact O-N 2.78Å; F332-V335 PolarHBondContact O-N 3.32Å; F332-T336 WeakPolarHBondContact O-CB 3.24Å; F332-T336 VanDerWaalsContact O-CG2 3.24Å; F332-T336 WeakPolarHBondContact O-CG2 3.28Å; F332-T336 PolarHBondContact O-N 3.35Å; F332-T336 PolarHBondContact O-OG1 3.14Å
333	H	93.8	Very high	88.5	Confident	51 Å²	51	66.2 Å²	66.2	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-46.5	177	-79	-113.6	0	0	0	112.2	Y234 Y241 W303 T329 S330 V335 T336 W337	Y234-H333 PolarHBondContact OH-CD2 3.35Å; Y234-H333 VanDerWaalsContact OH-CD2 3.32Å; Y234-H333 PolarHBondContact OH-NE2 3.31Å; Y241-H333 AromaticContact CE2-CE1 3.59Å; Y241-H333 AromaticContact CE2-NE2 3.54Å; Y241-H333 AromaticContact CZ-CE1 3.47Å; Y241-H333 VanDerWaalsContact CZ-CE1 3.47Å; Y241-H333 AromaticContact CZ-NE2 3.88Å; Y241-H333 PolarHBondContact OH-CE1 3.3Å; W303-H333 AromaticContact CH2-CD2 3.78Å; W303-H333 AromaticContact CH2-NE2 3.74Å; T329-H333 PolarHBondContact O-CD2 3.23Å; T329-H333 PolarHBondContact O-N 3.23Å; S330-H333 PolarHBondContact O-N 2.96Å; H333-V335 VanDerWaalsContact C-N 3.31Å; H333-V335 PolarHBondContact O-N 3.05Å; H333-T336 WeakPolarHBondContact CA-OG1 3.25Å; H333-T336 PolarHBondContact O-N 2.95Å; H333-T336 PolarHBondContact O-OG1 3.39Å; H333-W337 AromaticContact ND1-NE1 3.5Å; H333-W337 PolarHBondContact ND1-NE1 3.42Å; H333-W337 PolarHBondContact O-N 3.11Å
334	M	94.8	Very high	90	Very high	103 Å²	103	62.1 Å²	62.1	51%	0.507	34%	0.339	S	S	.	.	H	α-helix	trans	-56.4	-46.9	178.8	-173.9	177.5	68.2	0	0	111.1	S330 Y331 S338	S330-M334 WeakPolarHBondContact O-CB 3.25Å; S330-M334 PolarHBondContact O-N 3.17Å; Y331-M334 HydrophobicContact CD1-CE 3.85Å; Y331-M334 HydrophobicContact CE1-CE 4.36Å; M334-S338 WeakPolarHBondContact O-CB 3.43Å; M334-S338 PolarHBondContact O-N 3.31Å; M334-S338 PolarHBondContact O-OG 3.43Å; M334-S338 VanDerWaalsContact O-OG 3.06Å
335	V	94.9	Very high	91.4	Very high	55 Å²	55	63.9 Å²	63.9	33%	0.333	35%	0.348	S	S	.	.	H	α-helix	trans	-68.9	-43.4	179	172.8	0	0	0	0	112.4	I302 M306 Y331 F332 H333 W337 I339	I302-V335 HydrophobicContact CG2-CG1 4.24Å; M306-V335 HydrophobicContact CE-CB 3.65Å; M306-V335 HydrophobicContact CE-CG1 3.49Å; M306-V335 VanDerWaalsContact CE-CG1 3.49Å; M306-V335 HydrophobicContact CE-CG2 4.47Å; Y331-V335 WeakPolarHBondContact O-CB 3.42Å; Y331-V335 VanDerWaalsContact O-CG2 3.31Å; Y331-V335 WeakPolarHBondContact O-CG2 3.46Å; Y331-V335 PolarHBondContact O-N 3.35Å; F332-V335 PolarHBondContact O-N 3.32Å; H333-V335 VanDerWaalsContact C-N 3.31Å; H333-V335 PolarHBondContact O-N 3.05Å; V335-W337 PolarHBondContact O-N 3.16Å; V335-I339 HydrophobicContact CG1-CD1 3.81Å; V335-I339 PolarHBondContact O-N 3.31Å
336	T	95.6	Very high	92.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-72	-26.2	-175.1	55.5	0	0	0	0	114.1	S299 I302 W303 M306 F332 H333 P340	S299-T336 PolarHBondContact OG-O 3.29Å; I302-T336 HydrophobicContact CG2-CG2 3.88Å; W303-T336 HydrophobicContact CD2-CG2 3.48Å; W303-T336 VanDerWaalsContact CD2-CG2 3.48Å; W303-T336 VanDerWaalsContact CE2-OG1 3.23Å; W303-T336 HydrophobicContact CE3-CG2 3.76Å; W303-T336 HydrophobicContact CG-CG2 3.83Å; W303-T336 HydrophobicContact CH2-CG2 4.38Å; W303-T336 HydrophobicContact CZ2-CG2 4.13Å; W303-T336 WeakPolarHBondContact CZ2-OG1 3.35Å; W303-T336 HydrophobicContact CZ3-CG2 4.2Å; W303-T336 PolarHBondContact NE1-OG1 2.91Å; M306-T336 HydrophobicContact CE-CG2 4.1Å; M306-T336 HydrophobicContact CG-CG2 3.65Å; F332-T336 WeakPolarHBondContact O-CB 3.24Å; F332-T336 VanDerWaalsContact O-CG2 3.24Å; F332-T336 WeakPolarHBondContact O-CG2 3.28Å; F332-T336 PolarHBondContact O-N 3.35Å; F332-T336 PolarHBondContact O-OG1 3.14Å; H333-T336 WeakPolarHBondContact CA-OG1 3.25Å; H333-T336 PolarHBondContact O-N 2.95Å; H333-T336 PolarHBondContact O-OG1 3.39Å; T336-P340 WeakPolarHBondContact O-CD 3.44Å; T336-P340 VanDerWaalsContact O-CG 3.24Å; T336-P340 WeakPolarHBondContact O-CG 3.35Å
337	W	97.6	Very high	93.6	Very high	72 Å²	72	61.1 Å²	61.1	27%	0.273	33%	0.332	S	S	.	.	H	α-helix	trans	-100.7	-37.4	179.8	-53.9	121.2	0	0	0	113	Y241 Y295 S299 W303 H333 V335 F341	Y241-W337 HydrophobicContact CD1-CZ2 4.12Å; Y241-W337 HydrophobicContact CG-CZ2 4.47Å; Y295-W337 AromaticContact CE1-CE3 3.96Å; Y295-W337 HydrophobicContact CE1-CE3 3.96Å; Y295-W337 HydrophobicContact CE1-CZ3 4.17Å; S299-W337 VanDerWaalsContact OG-CE3 3.23Å; S299-W337 WeakPolarHBondContact OG-CZ3 3.5Å; W303-W337 AromaticContact CE2-CZ2 3.77Å; W303-W337 AromaticContact CZ2-CE2 3.89Å; W303-W337 AromaticContact CZ2-CZ2 3.74Å; W303-W337 HydrophobicContact CZ2-CZ2 3.74Å; W303-W337 AromaticContact CZ2-NE1 3.81Å; W303-W337 AromaticContact NE1-CE2 3.71Å; W303-W337 AromaticContact NE1-CH2 3.38Å; W303-W337 AromaticContact NE1-CZ2 3.22Å; W303-W337 AromaticContact NE1-CZ3 3.99Å; H333-W337 AromaticContact ND1-NE1 3.5Å; H333-W337 PolarHBondContact ND1-NE1 3.42Å; H333-W337 PolarHBondContact O-N 3.11Å; V335-W337 PolarHBondContact O-N 3.16Å; W337-F341 WeakPolarHBondContact O-CB 3.45Å; W337-F341 PolarHBondContact O-N 3.21Å
338	S	97	Very high	94.6	Very high	61 Å²	61	60 Å²	60	43%	0.427	31%	0.31	S	S	.	.	H	α-helix	trans	-72.1	-34.4	-178.9	-60.6	0	0	0	0	113.7	M334 F341 V342	M334-S338 WeakPolarHBondContact O-CB 3.43Å; M334-S338 PolarHBondContact O-N 3.31Å; M334-S338 PolarHBondContact O-OG 3.43Å; M334-S338 VanDerWaalsContact O-OG 3.06Å; S338-F341 PolarHBondContact O-N 3.43Å; S338-V342 WeakPolarHBondContact O-CG2 3.29Å; S338-V342 PolarHBondContact O-N 3.47Å
339	I	96.8	Very high	95.2	Very high	78 Å²	78	58 Å²	58	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-67	-50.7	179.4	-65.9	177.3	0	0	0	111.6	I302 V335 F341 V342 L343	I302-I339 HydrophobicContact CD1-CB 3.79Å; I302-I339 HydrophobicContact CD1-CG2 3.57Å; V335-I339 HydrophobicContact CG1-CD1 3.81Å; V335-I339 PolarHBondContact O-N 3.31Å; I339-F341 VanDerWaalsContact C-N 3.27Å; I339-F341 PolarHBondContact O-N 2.87Å; I339-V342 PolarHBondContact O-N 2.84Å; I339-L343 HydrophobicContact CG2-CD1 3.93Å; I339-L343 HydrophobicContact CG2-CG 4.39Å; I339-L343 WeakPolarHBondContact O-CG 3.23Å; I339-L343 PolarHBondContact O-N 2.8Å
340	P	97.8	Very high	95.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-35.8	174.2	-27.2	38.2	0	0	0	113.2	Y295 M298 I302 T336 T344	Y295-P340 HydrophobicContact CD2-CB 3.6Å; Y295-P340 HydrophobicContact CE2-CB 3.75Å; Y295-P340 HydrophobicContact CG-CB 4.23Å; M298-P340 HydrophobicContact CB-CB 3.9Å; M298-P340 HydrophobicContact CB-CG 4Å; I302-P340 HydrophobicContact CD1-CG 3.97Å; T336-P340 WeakPolarHBondContact O-CD 3.44Å; T336-P340 VanDerWaalsContact O-CG 3.24Å; T336-P340 WeakPolarHBondContact O-CG 3.35Å; P340-T344 WeakPolarHBondContact O-CB 3.42Å; P340-T344 PolarHBondContact O-N 3.25Å; P340-T344 PolarHBondContact O-OG1 3.44Å
341	F	97.8	Very high	95.9	Very high	125 Å²	125	56.8 Å²	56.8	55%	0.548	31%	0.31	S	S	.	.	H	α-helix	trans	-61	-52.2	175.2	177.9	-102.8	0	0	0	111.6	Y295 W337 S338 I339 L343 T344 V345	Y295-F341 HydrophobicContact CE2-CB 4.09Å; W337-F341 WeakPolarHBondContact O-CB 3.45Å; W337-F341 PolarHBondContact O-N 3.21Å; S338-F341 PolarHBondContact O-N 3.43Å; I339-F341 VanDerWaalsContact C-N 3.27Å; I339-F341 PolarHBondContact O-N 2.87Å; F341-L343 VanDerWaalsContact C-N 3.35Å; F341-L343 PolarHBondContact O-N 3.05Å; F341-T344 PolarHBondContact O-N 3.23Å; F341-V345 HydrophobicContact CD1-CG2 4.49Å; F341-V345 HydrophobicContact CD2-CG2 4.34Å; F341-V345 HydrophobicContact CE1-CG2 4.13Å; F341-V345 HydrophobicContact CE2-CG2 3.96Å; F341-V345 HydrophobicContact CZ-CG2 3.85Å; F341-V345 WeakPolarHBondContact O-CG2 3.44Å; F341-V345 PolarHBondContact O-N 2.99Å
342	V	98.1	Very high	96	Very high	94 Å²	94	51 Å²	51	57%	0.57	29%	0.288	S	S	*	.	H	α-helix	trans	-61.6	-41.8	179.1	170.8	0	0	0	0	111.6	S338 I339 A346	S338-V342 WeakPolarHBondContact O-CG2 3.29Å; S338-V342 PolarHBondContact O-N 3.47Å; I339-V342 PolarHBondContact O-N 2.84Å; V342-A346 VanDerWaalsContact O-CB 3.31Å; V342-A346 WeakPolarHBondContact O-CB 3.45Å; V342-A346 PolarHBondContact O-N 3.08Å
343	L	97.5	Very high	96.2	Very high	36 Å²	36	50.4 Å²	50.4	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-44.7	175.9	-69	171.6	0	0	0	112	Y294 I339 F341 A346 I347 F375 P379	Y294-L343 HydrophobicContact CE1-CB 3.97Å; I339-L343 HydrophobicContact CG2-CD1 3.93Å; I339-L343 HydrophobicContact CG2-CG 4.39Å; I339-L343 WeakPolarHBondContact O-CG 3.23Å; I339-L343 PolarHBondContact O-N 2.8Å; F341-L343 VanDerWaalsContact C-N 3.35Å; F341-L343 PolarHBondContact O-N 3.05Å; L343-A346 PolarHBondContact O-N 3.26Å; L343-I347 WeakPolarHBondContact O-CD1 3.24Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 3.39Å; L343-I347 VanDerWaalsContact O-N 3.08Å; L343-F375 HydrophobicContact CD2-CD1 4.14Å; L343-F375 HydrophobicContact CD2-CE1 4.49Å; L343-P379 HydrophobicContact CD1-CG 4.46Å
344	T	97.4	Very high	96.2	Very high	7 Å²	7	48 Å²	48	4%	0.043	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-46	178.7	-52.2	0	0	0	0	111.1	F290 I291 Y294 P340 F341 A346 I347 L348	F290-T344 HydrophobicContact CE1-CG2 4.11Å; I291-T344 HydrophobicContact CG1-CG2 3.93Å; I291-T344 HydrophobicContact CG2-CG2 4.48Å; Y294-T344 WeakPolarHBondContact CD1-OG1 3.5Å; P340-T344 WeakPolarHBondContact O-CB 3.42Å; P340-T344 PolarHBondContact O-N 3.25Å; P340-T344 PolarHBondContact O-OG1 3.44Å; F341-T344 PolarHBondContact O-N 3.23Å; T344-A346 VanDerWaalsContact C-N 3.34Å; T344-A346 PolarHBondContact O-N 3.32Å; T344-I347 PolarHBondContact O-N 3.34Å; T344-L348 HydrophobicContact CG2-CD1 4.23Å; T344-L348 WeakPolarHBondContact O-CG 3.39Å; T344-L348 PolarHBondContact O-N 3.25Å; T344-L348 VanDerWaalsContact O-N 3.1Å
345	V	97.5	Very high	96.2	Very high	69 Å²	69	43.1 Å²	43.1	42%	0.418	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-39	177.1	172.3	0	0	0	0	111.5	F341 L348 A349	F341-V345 HydrophobicContact CD1-CG2 4.49Å; F341-V345 HydrophobicContact CD2-CG2 4.34Å; F341-V345 HydrophobicContact CE1-CG2 4.13Å; F341-V345 HydrophobicContact CE2-CG2 3.96Å; F341-V345 HydrophobicContact CZ-CG2 3.85Å; F341-V345 WeakPolarHBondContact O-CG2 3.44Å; F341-V345 PolarHBondContact O-N 2.99Å; V345-L348 PolarHBondContact O-N 2.99Å; V345-A349 WeakPolarHBondContact O-CB 3.48Å; V345-A349 PolarHBondContact O-N 3.4Å
346	A	97.1	Very high	96.2	Very high	34 Å²	34	41.3 Å²	41.3	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-63.2	-40.9	176.7	0	0	0	0	0	112.5	V342 L343 T344 A349 I350 F375	V342-A346 VanDerWaalsContact O-CB 3.31Å; V342-A346 WeakPolarHBondContact O-CB 3.45Å; V342-A346 PolarHBondContact O-N 3.08Å; L343-A346 PolarHBondContact O-N 3.26Å; T344-A346 VanDerWaalsContact C-N 3.34Å; T344-A346 PolarHBondContact O-N 3.32Å; A346-A349 PolarHBondContact O-N 3.07Å; A346-I350 WeakPolarHBondContact O-CG1 3.42Å; A346-I350 PolarHBondContact O-N 2.99Å; A346-F375 HydrophobicContact CB-CE1 3.96Å; A346-F375 HydrophobicContact CB-CZ 4.24Å
347	I	97	Very high	96.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-45.4	176.6	-64.1	159.4	0	0	0	110.8	F290 Y294 L343 T344 A349 I350 A351 V353 V364 F375	F290-I347 HydrophobicContact CE1-CB 4.46Å; F290-I347 HydrophobicContact CE1-CG2 4.08Å; F290-I347 HydrophobicContact CE2-CD1 4.43Å; F290-I347 HydrophobicContact CE2-CG2 4.34Å; F290-I347 HydrophobicContact CZ-CB 3.99Å; F290-I347 HydrophobicContact CZ-CD1 3.82Å; F290-I347 HydrophobicContact CZ-CG2 3.59Å; Y294-I347 HydrophobicContact CD1-CD1 4.12Å; Y294-I347 HydrophobicContact CD2-CD1 4.29Å; Y294-I347 HydrophobicContact CE1-CD1 3.57Å; Y294-I347 HydrophobicContact CE2-CD1 3.74Å; Y294-I347 HydrophobicContact CG-CD1 4.47Å; L343-I347 WeakPolarHBondContact O-CD1 3.24Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 3.39Å; L343-I347 VanDerWaalsContact O-N 3.08Å; T344-I347 PolarHBondContact O-N 3.34Å; I347-A349 VanDerWaalsContact C-N 3.26Å; I347-A349 PolarHBondContact O-N 3.23Å; I347-I350 PolarHBondContact O-N 3.17Å; I347-I350 VanDerWaalsContact O-N 3.15Å; I347-A351 PolarHBondContact O-N 2.97Å; I347-V353 HydrophobicContact CG2-CG2 3.7Å; I347-V364 HydrophobicContact CD1-CB 4.28Å; I347-V364 HydrophobicContact CD1-CG1 4.33Å; I347-V364 HydrophobicContact CD1-CG2 4.23Å; I347-V364 HydrophobicContact CG1-CG2 4.15Å; I347-V364 HydrophobicContact CG2-CB 4.01Å; I347-V364 HydrophobicContact CG2-CG2 3.7Å; I347-F375 HydrophobicContact CD1-CB 3.84Å; I347-F375 HydrophobicContact CD1-CD1 3.99Å; I347-F375 HydrophobicContact CD1-CD2 4.44Å; I347-F375 HydrophobicContact CD1-CG 3.86Å; I347-F375 HydrophobicContact CG1-CB 4.09Å; I347-F375 HydrophobicContact CG1-CD1 3.64Å; I347-F375 HydrophobicContact CG1-CD2 3.74Å; I347-F375 HydrophobicContact CG1-CE1 3.92Å; I347-F375 HydrophobicContact CG1-CE2 4Å; I347-F375 HydrophobicContact CG1-CG 3.55Å; I347-F375 HydrophobicContact CG1-CZ 4.09Å
348	L	95.9	Very high	96	Very high	43 Å²	43	38.4 Å²	38.4	23%	0.225	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-29	177.9	-65.2	173.4	0	0	0	112.9	V287 F290 I291 T344 V345 V353	V287-L348 HydrophobicContact CG1-CD2 3.74Å; F290-L348 HydrophobicContact CD1-CD2 4Å; F290-L348 HydrophobicContact CE1-CD2 3.89Å; F290-L348 HydrophobicContact CE1-CG 4.16Å; I291-L348 HydrophobicContact CD1-CD1 4.03Å; I291-L348 HydrophobicContact CG1-CD1 4.18Å; T344-L348 HydrophobicContact CG2-CD1 4.23Å; T344-L348 WeakPolarHBondContact O-CG 3.39Å; T344-L348 PolarHBondContact O-N 3.25Å; T344-L348 VanDerWaalsContact O-N 3.1Å; V345-L348 PolarHBondContact O-N 2.99Å; L348-V353 HydrophobicContact CD2-CG2 4.3Å
349	A	95.8	Very high	95.8	Very high	87 Å²	87	35.7 Å²	35.7	72%	0.719	21%	0.21	S	C	*	.	H	α-helix	trans	-76	-20.9	175.4	0	0	0	0	0	113.8	V345 A346 I347	V345-A349 WeakPolarHBondContact O-CB 3.48Å; V345-A349 PolarHBondContact O-N 3.4Å; A346-A349 PolarHBondContact O-N 3.07Å; I347-A349 VanDerWaalsContact C-N 3.26Å; I347-A349 PolarHBondContact O-N 3.23Å
350	I	94.4	Very high	95.7	Very high	78 Å²	78	32 Å²	32	40%	0.4	19%	0.191	S	C	.	.	H	α-helix	trans	-93.5	-21.2	174.4	-57.8	166.5	0	0	0	110.8	A346 I347 E352 Y371 F375	A346-I350 WeakPolarHBondContact O-CG1 3.42Å; A346-I350 PolarHBondContact O-N 2.99Å; I347-I350 PolarHBondContact O-N 3.17Å; I347-I350 VanDerWaalsContact O-N 3.15Å; I350-E352 HydrophobicContact CG2-CB 4.49Å; I350-E352 HydrophobicContact CG2-CG 3.65Å; I350-Y371 HydrophobicContact CG2-CE1 3.9Å; I350-F375 HydrophobicContact CD1-CE2 3.91Å; I350-F375 HydrophobicContact CD1-CZ 3.78Å
351	A	93.6	Very high	95.7	Very high	33 Å²	33	32 Å²	32	27%	0.273	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	49.7	-179.8	0	0	0	0	0	113.8	G276 E277 I347	G276-A351 CarbonylContact C-O 3.11Å; G276-A351 VanDerWaalsContact C-O 3.29Å; G276-A351 WeakPolarHBondContact CA-O 3.26Å; E277-A351 CarbonylContact O-C 3.54Å; E277-A351 VanDerWaalsContact O-CA 3.31Å; E277-A351 WeakPolarHBondContact O-CA 3.43Å; I347-A351 PolarHBondContact O-N 2.97Å
352	E	93.6	Very high	95.6	Very high	31 Å²	31	26 Å²	26	15%	0.145	17%	0.165	C	C	.	.			trans	-115.9	41.6	-179.8	-68.8	-84.4	-176.9	0	0	111.2	I350 V364 G365 N368 Y371	I350-E352 HydrophobicContact CG2-CB 4.49Å; I350-E352 HydrophobicContact CG2-CG 3.65Å; E352-V364 WeakPolarHBondContact O-CA 3.24Å; E352-G365 PolarHBondContact O-N 2.84Å; E352-N368 PolarHBondContact OE1-ND2 3.14Å; E352-N368 WeakPolarHBondContact OE2-CB 3.28Å; E352-N368 PolarHBondContact OE2-ND2 3.48Å; E352-Y371 HydrophobicContact CB-CD2 3.87Å; E352-Y371 HydrophobicContact CB-CE2 4.26Å; E352-Y371 HydrophobicContact CB-CG 4.15Å; E352-Y371 VanDerWaalsContact CD-CD2 3.48Å; E352-Y371 HydrophobicContact CG-CD2 3.58Å; E352-Y371 HydrophobicContact CG-CE1 4.41Å; E352-Y371 HydrophobicContact CG-CE2 3.43Å; E352-Y371 VanDerWaalsContact CG-CE2 3.43Å; E352-Y371 HydrophobicContact CG-CG 4.14Å; E352-Y371 WeakPolarHBondContact OE1-CE2 3.39Å
353	V	95.8	Very high	95.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126	171.1	-178.2	0	0	0	0	108.9	G276 E277 F290 I347 L348 C362	G276-V353 PolarHBondContact N-O 3.5Å; E277-V353 HydrophobicContact CB-CB 4.2Å; E277-V353 WeakPolarHBondContact CB-O 3.38Å; E277-V353 PolarHBondContact N-O 3.43Å; E277-V353 WeakPolarHBondContact O-CB 3.49Å; E277-V353 PolarHBondContact O-N 2.99Å; F290-V353 HydrophobicContact CB-CG1 3.74Å; F290-V353 HydrophobicContact CD1-CG1 4.14Å; F290-V353 HydrophobicContact CD1-CG2 3.65Å; F290-V353 HydrophobicContact CD2-CG1 4.04Å; F290-V353 HydrophobicContact CD2-CG2 4.2Å; F290-V353 HydrophobicContact CE1-CG2 3.69Å; F290-V353 HydrophobicContact CE2-CG2 4.22Å; F290-V353 HydrophobicContact CG-CB 4.49Å; F290-V353 HydrophobicContact CG-CG1 3.67Å; F290-V353 HydrophobicContact CG-CG2 3.93Å; F290-V353 HydrophobicContact CZ-CG2 3.98Å; I347-V353 HydrophobicContact CG2-CG2 3.7Å; L348-V353 HydrophobicContact CD2-CG2 4.3Å; V353-C362 HydrophobicContact CG1-CB 3.98Å
354	D	94.8	Very high	95.5	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.011	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.8	-177.2	-57.8	-49.9	0	0	0	110.2	L275 G276 C362 F363 Y366 K367	L275-D354 WeakPolarHBondContact CA-OD1 3.27Å; L275-D354 HydrophobicContact CD2-CB 4.33Å; G276-D354 PolarHBondContact N-OD1 3.21Å; G276-D354 VanDerWaalsContact N-OD1 3.12Å; D354-C362 CarbonylContact O-C 3.42Å; D354-C362 VanDerWaalsContact O-CA 3.22Å; D354-C362 WeakPolarHBondContact O-CA 3.34Å; D354-F363 PolarHBondContact N-O 2.91Å; D354-F363 PolarHBondContact O-N 3.14Å; D354-Y366 HydrophobicContact CB-CD2 4.06Å; D354-Y366 HydrophobicContact CB-CG 4.48Å; D354-Y366 PolarHBondContact OD2-N 3.42Å; D354-K367 WeakPolarHBondContact OD2-CB 3.45Å; D354-K367 PolarHBondContact OD2-N 2.85Å
355	G	94.6	Very high	95.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	142.9	170.6	0	0	0	0	0	112.1	M273 R274	M273-G355 VanDerWaalsContact CE-O 3.25Å; M273-G355 WeakPolarHBondContact CE-O 3.43Å; R274-G355 PolarHBondContact O-N 3.45Å
356	D	94.4	Very high	94.8	Very high	17 Å²	17	18.9 Å²	18.9	9%	0.091	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.5	171.4	163.8	62.9	0	0	0	111.3	N191 V358 S359 G360 I361 Y366	N191-D356 PolarHBondContact ND2-OD1 3.35Å; N191-D356 VanDerWaalsContact ND2-OD1 3.16Å; D356-V358 PolarHBondContact OD1-N 3.3Å; D356-V358 PolarHBondContact OD2-N 2.88Å; D356-S359 PolarHBondContact O-OG 3.09Å; D356-S359 VanDerWaalsContact OD2-CB 3.28Å; D356-S359 WeakPolarHBondContact OD2-CB 3.46Å; D356-S359 PolarHBondContact OD2-N 2.66Å; D356-S359 PolarHBondContact OD2-OG 2.69Å; D356-G360 WeakPolarHBondContact O-CA 3.3Å; D356-G360 PolarHBondContact O-N 3.21Å; D356-I361 PolarHBondContact N-O 2.9Å; D356-I361 VanDerWaalsContact N-O 3.12Å; D356-Y366 HydrophobicContact CB-CD1 4.36Å; D356-Y366 HydrophobicContact CB-CD2 3.97Å; D356-Y366 HydrophobicContact CB-CE1 4.16Å; D356-Y366 HydrophobicContact CB-CE2 3.73Å; D356-Y366 HydrophobicContact CB-CG 4.29Å
357	S	94.5	Very high	94.4	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.021	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-27	-176.5	60.4	0	0	0	0	113.1	N191 H199 H203	N191-S357 VanDerWaalsContact CB-OG 3.23Å; N191-S357 WeakPolarHBondContact CB-OG 3.17Å; N191-S357 PolarHBondContact N-OG 3.35Å; H199-S357 PolarHBondContact NE2-OG 3.22Å; H203-S357 PolarHBondContact CE1-O 3.23Å; H203-S357 PolarHBondContact NE2-O 2.99Å
358	V	94.1	Very high	94.1	Very high	8 Å²	8	24 Å²	24	5%	0.048	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-50.3	-175.7	-178.8	0	0	0	0	110.2	N191 F194 M202 H203 D356 L487	N191-V358 HydrophobicContact CB-CG2 3.9Å; F194-V358 HydrophobicContact CB-CG2 4.48Å; F194-V358 HydrophobicContact CD2-CG2 3.54Å; F194-V358 HydrophobicContact CE2-CG2 4.11Å; F194-V358 HydrophobicContact CG-CG2 4.25Å; M202-V358 HydrophobicContact CB-CG1 4.17Å; M202-V358 HydrophobicContact CE-CG1 4.19Å; M202-V358 HydrophobicContact CG-CG1 3.98Å; M202-V358 VanDerWaalsContact CG-O 3.25Å; M202-V358 WeakPolarHBondContact CG-O 3.48Å; H203-V358 PolarHBondContact CD2-O 2.89Å; H203-V358 VanDerWaalsContact CD2-O 3.31Å; H203-V358 PolarHBondContact NE2-O 3.07Å; D356-V358 PolarHBondContact OD1-N 3.3Å; D356-V358 PolarHBondContact OD2-N 2.88Å; V358-L487 HydrophobicContact CG1-CD2 3.67Å
359	S	93.9	Very high	93.8	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.021	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-29.1	170.9	61	0	0	0	0	112.7	I206 Q256 D356 I361 Y366	I206-S359 VanDerWaalsContact CD1-O 3.27Å; I206-S359 WeakPolarHBondContact CD1-O 3.26Å; Q256-S359 PolarHBondContact NE2-O 2.77Å; D356-S359 PolarHBondContact O-OG 3.09Å; D356-S359 VanDerWaalsContact OD2-CB 3.28Å; D356-S359 WeakPolarHBondContact OD2-CB 3.46Å; D356-S359 PolarHBondContact OD2-N 2.66Å; D356-S359 PolarHBondContact OD2-OG 2.69Å; S359-I361 VanDerWaalsContact C-N 3.34Å; S359-Y366 PolarHBondContact OG-OH 3.24Å
360	G	95	Very high	93.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	20.4	178.3	0	0	0	0	0	114.3	Q256 D356	Q256-G360 WeakPolarHBondContact CB-O 3.43Å; D356-G360 WeakPolarHBondContact O-CA 3.3Å; D356-G360 PolarHBondContact O-N 3.21Å
361	I	96.1	Very high	93.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	174.8	179.7	64.2	158.3	0	0	0	111.4	W253 I289 V293 D356 S359	W253-I361 HydrophobicContact CD2-CD1 4.33Å; W253-I361 HydrophobicContact CD2-CG2 4.42Å; W253-I361 HydrophobicContact CE3-CD1 4.09Å; W253-I361 HydrophobicContact CE3-CG1 4.36Å; W253-I361 HydrophobicContact CE3-CG2 3.82Å; W253-I361 HydrophobicContact CH2-CD1 3.41Å; W253-I361 VanDerWaalsContact CH2-CD1 3.41Å; W253-I361 HydrophobicContact CH2-CG1 4.03Å; W253-I361 HydrophobicContact CZ2-CD1 3.68Å; W253-I361 HydrophobicContact CZ3-CD1 3.64Å; W253-I361 HydrophobicContact CZ3-CG1 3.84Å; W253-I361 HydrophobicContact CZ3-CG2 4.12Å; I289-I361 HydrophobicContact CG2-CB 4.08Å; I289-I361 HydrophobicContact CG2-CG2 4.08Å; V293-I361 HydrophobicContact CG1-CD1 4.17Å; D356-I361 PolarHBondContact N-O 2.9Å; D356-I361 VanDerWaalsContact N-O 3.12Å; S359-I361 VanDerWaalsContact C-N 3.34Å
362	C	96.7	Very high	93.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.3	165.4	-71.6	0	0	0	0	111.6	I265 C286 F290 V353 D354	I265-C362 PolarHBondContact O-SG 3.35Å; C286-C362 WeakPolarHBondContact CA-SG 3.19Å; C286-C362 HydrophobicContact CB-CB 4.11Å; C286-C362 WeakPolarHBondContact CB-SG 3.47Å; C286-C362 WeakPolarHBondContact O-CB 3.32Å; C286-C362 WeakPolarHBondContact SG-CB 3.47Å; C286-C362 CovalentContact SG-SG 2.03Å; C286-C362 PolarHBondContact SG-SG 2.77Å; F290-C362 WeakPolarHBondContact CA-O 3.48Å; F290-C362 HydrophobicContact CB-CB 4.21Å; V353-C362 HydrophobicContact CG1-CB 3.98Å; D354-C362 CarbonylContact O-C 3.42Å; D354-C362 VanDerWaalsContact O-CA 3.22Å; D354-C362 WeakPolarHBondContact O-CA 3.34Å
363	F	96.5	Very high	93.8	Very high	12 Å²	12	25.2 Å²	25.2	5%	0.053	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	167.8	-178	-154.3	-115.1	0	0	0	112.1	V293 Y294 L297 D354 Y366 V376	V293-F363 HydrophobicContact CG1-CE2 4.44Å; Y294-F363 HydrophobicContact CD2-CE2 4.05Å; Y294-F363 HydrophobicContact CD2-CZ 4.21Å; L297-F363 HydrophobicContact CD2-CE2 4.41Å; L297-F363 HydrophobicContact CD2-CZ 4.09Å; D354-F363 PolarHBondContact N-O 2.91Å; D354-F363 PolarHBondContact O-N 3.14Å; F363-Y366 HydrophobicContact CB-CD2 4.14Å; F363-Y366 HydrophobicContact CB-CE2 3.39Å; F363-V376 HydrophobicContact CE1-CG2 3.73Å; F363-V376 HydrophobicContact CZ-CG1 4.48Å; F363-V376 HydrophobicContact CZ-CG2 3.93Å
364	V	95.9	Very high	93.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	126.4	-177.4	56.8	0	0	0	0	112	F290 Y294 I347 E352 R372 F375 V376	F290-V364 HydrophobicContact CE2-CB 4.12Å; Y294-V364 HydrophobicContact CD2-CG1 4.2Å; Y294-V364 HydrophobicContact CE2-CG1 4.09Å; I347-V364 HydrophobicContact CD1-CB 4.28Å; I347-V364 HydrophobicContact CD1-CG1 4.33Å; I347-V364 HydrophobicContact CD1-CG2 4.23Å; I347-V364 HydrophobicContact CG1-CG2 4.15Å; I347-V364 HydrophobicContact CG2-CB 4.01Å; I347-V364 HydrophobicContact CG2-CG2 3.7Å; E352-V364 WeakPolarHBondContact O-CA 3.24Å; V364-R372 WeakPolarHBondContact O-CB 3.46Å; V364-R372 WeakPolarHBondContact O-CG 3.42Å; V364-F375 HydrophobicContact CG1-CB 4.41Å; V364-F375 HydrophobicContact CG2-CB 4.42Å; V364-F375 HydrophobicContact CG2-CD2 4.29Å; V364-V376 HydrophobicContact CG1-CG2 3.61Å
365	G	91.3	Very high	93.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	50.4	168.2	0	0	0	0	0	115.9	E352	E352-G365 PolarHBondContact O-N 2.84Å
366	Y	89.9	Confident	94	Very high	43 Å²	43	28.8 Å²	28.8	17%	0.169	14%	0.144	C	C	.	.	S	Bend	trans	-70.1	-36.6	162.8	-75	-67.8	0	0	0	110.8	D354 D356 S359 F363 Q449	D354-Y366 HydrophobicContact CB-CD2 4.06Å; D354-Y366 HydrophobicContact CB-CG 4.48Å; D354-Y366 PolarHBondContact OD2-N 3.42Å; D356-Y366 HydrophobicContact CB-CD1 4.36Å; D356-Y366 HydrophobicContact CB-CD2 3.97Å; D356-Y366 HydrophobicContact CB-CE1 4.16Å; D356-Y366 HydrophobicContact CB-CE2 3.73Å; D356-Y366 HydrophobicContact CB-CG 4.29Å; S359-Y366 PolarHBondContact OG-OH 3.24Å; F363-Y366 HydrophobicContact CB-CD2 4.14Å; F363-Y366 HydrophobicContact CB-CE2 3.39Å; Y366-Q449 PolarHBondContact O-NE2 3.48Å; Y366-Q449 VanDerWaalsContact O-NE2 3.11Å
367	K	87.8	Confident	94	Very high	80 Å²	80	29 Å²	29	35%	0.348	14%	0.144	S	C	.	.	S	Bend	trans	-83.7	-36.3	177.4	-175.7	68.1	-135.7	80.8	0	112.6	L275 D354 E453	L275-K367 HydrophobicContact CD2-CB 3.98Å; L275-K367 HydrophobicContact CD2-CD 4.49Å; L275-K367 HydrophobicContact CD2-CG 4.35Å; D354-K367 WeakPolarHBondContact OD2-CB 3.45Å; D354-K367 PolarHBondContact OD2-N 2.85Å; K367-E453 IonicContact NZ-OE1 3.67Å; K367-E453 PolarHBondContact NZ-OE1 2.88Å; K367-E453 IonicContact NZ-OE2 2.66Å; K367-E453 PolarHBondContact NZ-OE2 2.69Å
368	N	90.7	Very high	94.1	Very high	62 Å²	62	31.4 Å²	31.4	33%	0.332	17%	0.165	S	C	.	.			trans	-120.7	83.8	-177.1	-74	-43.4	0	0	0	110.9	E352 H370 Y371	E352-N368 PolarHBondContact OE1-ND2 3.14Å; E352-N368 WeakPolarHBondContact OE2-CB 3.28Å; E352-N368 PolarHBondContact OE2-ND2 3.48Å; N368-H370 PolarHBondContact O-N 3.41Å; N368-Y371 HydrophobicContact CB-CD2 3.57Å; N368-Y371 HydrophobicContact CB-CE2 3.83Å; N368-Y371 PolarHBondContact O-N 2.84Å
369	Y	90.8	Very high	94.3	Very high	61 Å²	61	32.4 Å²	32.4	24%	0.239	17%	0.172	C	C	.	.	H	α-helix	trans	-54.8	-23.9	-174.3	71.3	-74.2	0	0	0	115.4	Y371 R372 A373 F446 Q449	Y369-Y371 VanDerWaalsContact C-N 3.28Å; Y369-Y371 PolarHBondContact O-N 3.46Å; Y369-R372 PolarHBondContact O-N 3.44Å; Y369-A373 PolarHBondContact O-N 3.41Å; Y369-F446 AromaticContact CD2-CD2 3.61Å; Y369-F446 HydrophobicContact CD2-CD2 3.61Å; Y369-F446 AromaticContact CD2-CE2 3.73Å; Y369-F446 HydrophobicContact CD2-CE2 3.73Å; Y369-F446 HydrophobicContact CE2-CD2 4.08Å; Y369-F446 AromaticContact CE2-CE2 3.78Å; Y369-F446 HydrophobicContact CE2-CE2 3.78Å; Y369-F446 HydrophobicContact CE2-CZ 4.46Å; Y369-Q449 HydrophobicContact CD1-CB 4.44Å; Y369-Q449 HydrophobicContact CD1-CG 3.93Å; Y369-Q449 HydrophobicContact CD2-CB 4.4Å; Y369-Q449 HydrophobicContact CG-CB 4.09Å; Y369-Q449 HydrophobicContact CG-CG 3.9Å
370	H	92.9	Very high	94.4	Very high	116 Å²	116	32.3 Å²	32.3	54%	0.537	17%	0.171	S	C	.	.	H	α-helix	trans	-57	-38.2	173.1	-63.6	-58	0	0	0	112.8	N368 A373 G374	N368-H370 PolarHBondContact O-N 3.41Å; H370-A373 PolarHBondContact O-N 2.86Å; H370-G374 PolarHBondContact O-N 3.33Å
371	Y	95.3	Very high	94.6	Very high	77 Å²	77	33.1 Å²	33.1	30%	0.302	18%	0.179	S	C	.	.	H	α-helix	trans	-76.3	-37.5	178.3	-59.1	-69.8	0	0	0	112	I350 E352 N368 Y369 A373 G374 F375	I350-Y371 HydrophobicContact CG2-CE1 3.9Å; E352-Y371 HydrophobicContact CB-CD2 3.87Å; E352-Y371 HydrophobicContact CB-CE2 4.26Å; E352-Y371 HydrophobicContact CB-CG 4.15Å; E352-Y371 VanDerWaalsContact CD-CD2 3.48Å; E352-Y371 HydrophobicContact CG-CD2 3.58Å; E352-Y371 HydrophobicContact CG-CE1 4.41Å; E352-Y371 HydrophobicContact CG-CE2 3.43Å; E352-Y371 VanDerWaalsContact CG-CE2 3.43Å; E352-Y371 HydrophobicContact CG-CG 4.14Å; E352-Y371 WeakPolarHBondContact OE1-CE2 3.39Å; N368-Y371 HydrophobicContact CB-CD2 3.57Å; N368-Y371 HydrophobicContact CB-CE2 3.83Å; N368-Y371 PolarHBondContact O-N 2.84Å; Y369-Y371 VanDerWaalsContact C-N 3.28Å; Y369-Y371 PolarHBondContact O-N 3.46Å; Y371-A373 PolarHBondContact O-N 2.92Å; Y371-G374 PolarHBondContact O-N 3.48Å; Y371-F375 HydrophobicContact CD1-CE2 4.16Å; Y371-F375 WeakPolarHBondContact O-CB 3.48Å; Y371-F375 WeakPolarHBondContact O-CD2 3.38Å; Y371-F375 PolarHBondContact O-N 3Å
372	R	94.1	Very high	94.6	Very high	26 Å²	26	37.6 Å²	37.6	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-37.1	171.4	-163.8	164.8	173	-116	0.1	110.8	V364 Y369 V376 L377 H442 D445	V364-R372 WeakPolarHBondContact O-CB 3.46Å; V364-R372 WeakPolarHBondContact O-CG 3.42Å; Y369-R372 PolarHBondContact O-N 3.44Å; R372-V376 HydrophobicContact CG-CG2 4.34Å; R372-V376 WeakPolarHBondContact O-CA 3.35Å; R372-V376 WeakPolarHBondContact O-CB 3.39Å; R372-V376 PolarHBondContact O-N 3.43Å; R372-L377 PolarHBondContact O-N 3.5Å; R372-H442 PolarHBondContact NH2-ND1 3.39Å; R372-D445 IonicContact CZ-OD2 3.75Å; R372-D445 VanDerWaalsContact CZ-OD2 3.24Å; R372-D445 IonicContact NH1-OD2 3.64Å; R372-D445 PolarHBondContact NH1-OD2 3.07Å; R372-D445 IonicContact NH2-OD2 2.66Å; R372-D445 PolarHBondContact NH2-OD2 2.95Å
373	A	93.9	Very high	94.6	Very high	17 Å²	17	38.1 Å²	38.1	14%	0.14	21%	0.209	C	C	.	.	I	π-helix	trans	-65.3	-49.7	171.8	0	0	0	0	0	112.9	Y369 H370 Y371 L377 A378 F446	Y369-A373 PolarHBondContact O-N 3.41Å; H370-A373 PolarHBondContact O-N 2.86Å; Y371-A373 PolarHBondContact O-N 2.92Å; A373-L377 WeakPolarHBondContact O-CB 3.33Å; A373-L377 PolarHBondContact O-N 3.2Å; A373-A378 PolarHBondContact O-N 3.1Å; A373-F446 HydrophobicContact CB-CD2 3.52Å; A373-F446 HydrophobicContact CB-CE2 3.59Å; A373-F446 HydrophobicContact CB-CG 4.42Å
374	G	95.8	Very high	94.7	Very high	44 Å²	44	38.3 Å²	38.3	45%	0.454	21%	0.211	S	C	.	.	I	π-helix	trans	-66.6	-38.8	-178.4	0	0	0	0	0	114.4	H370 Y371 P379	H370-G374 PolarHBondContact O-N 3.33Å; Y371-G374 PolarHBondContact O-N 3.48Å; G374-P379 WeakPolarHBondContact O-CD 3.39Å
375	F	97.3	Very high	94.8	Very high	34 Å²	34	43.5 Å²	43.5	15%	0.149	24%	0.243	C	C	.	.	I	π-helix	trans	-102	-9	-173.3	-70.4	-69.2	0	0	0	115.1	Y294 M298 L343 A346 I347 I350 V364 Y371	Y294-F375 WeakPolarHBondContact CE2-O 3.32Å; Y294-F375 PolarHBondContact OH-O 2.92Å; M298-F375 WeakPolarHBondContact CE-O 3.37Å; L343-F375 HydrophobicContact CD2-CD1 4.14Å; L343-F375 HydrophobicContact CD2-CE1 4.49Å; A346-F375 HydrophobicContact CB-CE1 3.96Å; A346-F375 HydrophobicContact CB-CZ 4.24Å; I347-F375 HydrophobicContact CD1-CB 3.84Å; I347-F375 HydrophobicContact CD1-CD1 3.99Å; I347-F375 HydrophobicContact CD1-CD2 4.44Å; I347-F375 HydrophobicContact CD1-CG 3.86Å; I347-F375 HydrophobicContact CG1-CB 4.09Å; I347-F375 HydrophobicContact CG1-CD1 3.64Å; I347-F375 HydrophobicContact CG1-CD2 3.74Å; I347-F375 HydrophobicContact CG1-CE1 3.92Å; I347-F375 HydrophobicContact CG1-CE2 4Å; I347-F375 HydrophobicContact CG1-CG 3.55Å; I347-F375 HydrophobicContact CG1-CZ 4.09Å; I350-F375 HydrophobicContact CD1-CE2 3.91Å; I350-F375 HydrophobicContact CD1-CZ 3.78Å; V364-F375 HydrophobicContact CG1-CB 4.41Å; V364-F375 HydrophobicContact CG2-CB 4.42Å; V364-F375 HydrophobicContact CG2-CD2 4.29Å; Y371-F375 HydrophobicContact CD1-CE2 4.16Å; Y371-F375 WeakPolarHBondContact O-CB 3.48Å; Y371-F375 WeakPolarHBondContact O-CD2 3.38Å; Y371-F375 PolarHBondContact O-N 3Å
376	V	96.3	Very high	95.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-125.5	-58.6	178	-170.9	0	0	0	0	111.1	Y294 M298 F363 V364 R372 A378 P379 I380	Y294-V376 HydrophobicContact CE2-CG2 4.09Å; M298-V376 HydrophobicContact CE-CB 4.32Å; M298-V376 HydrophobicContact CE-CG1 4.07Å; M298-V376 HydrophobicContact CE-CG2 4.38Å; F363-V376 HydrophobicContact CE1-CG2 3.73Å; F363-V376 HydrophobicContact CZ-CG1 4.48Å; F363-V376 HydrophobicContact CZ-CG2 3.93Å; V364-V376 HydrophobicContact CG1-CG2 3.61Å; R372-V376 HydrophobicContact CG-CG2 4.34Å; R372-V376 WeakPolarHBondContact O-CA 3.35Å; R372-V376 WeakPolarHBondContact O-CB 3.39Å; R372-V376 PolarHBondContact O-N 3.43Å; V376-A378 PolarHBondContact O-N 3.47Å; V376-P379 WeakPolarHBondContact O-CD 3.35Å; V376-I380 HydrophobicContact CG1-CD1 3.74Å; V376-I380 WeakPolarHBondContact O-CB 3.36Å; V376-I380 VanDerWaalsContact O-CG1 3.24Å; V376-I380 WeakPolarHBondContact O-CG1 3.11Å; V376-I380 PolarHBondContact O-N 3.23Å; V376-I380 VanDerWaalsContact O-N 3.14Å
377	L	96.1	Very high	95.3	Very high	20 Å²	20	44 Å²	44	11%	0.105	25%	0.25	C	C	.	.	I	π-helix	trans	-64.2	-45	-174.9	-172.1	65.8	0	0	0	112.2	R372 A373 G381 F439 H442 F443 F446	R372-L377 PolarHBondContact O-N 3.5Å; A373-L377 WeakPolarHBondContact O-CB 3.33Å; A373-L377 PolarHBondContact O-N 3.2Å; L377-G381 PolarHBondContact O-N 2.88Å; L377-F439 HydrophobicContact CD1-CD2 3.53Å; L377-F439 HydrophobicContact CD1-CE2 3.46Å; L377-F439 VanDerWaalsContact CD1-CE2 3.46Å; L377-F439 HydrophobicContact CD1-CG 4.13Å; L377-F439 HydrophobicContact CD1-CZ 4Å; L377-F439 HydrophobicContact CG-CD2 4.38Å; L377-F439 HydrophobicContact CG-CE2 3.92Å; L377-F439 HydrophobicContact CG-CZ 4.47Å; L377-F439 WeakPolarHBondContact O-CE2 3.3Å; L377-H442 HydrophobicContact CD1-CB 3.84Å; L377-F443 HydrophobicContact CD1-CB 4.13Å; L377-F443 HydrophobicContact CD2-CD2 4.4Å; L377-F446 HydrophobicContact CD2-CB 4.27Å; L377-F446 HydrophobicContact CD2-CG 4.38Å
378	A	96.9	Very high	95.8	Very high	55 Å²	55	40.7 Å²	40.7	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-47.9	-179.8	0	0	0	0	0	113.6	A373 V376 I380 G381 V382	A373-A378 PolarHBondContact O-N 3.1Å; V376-A378 PolarHBondContact O-N 3.47Å; A378-I380 PolarHBondContact O-N 2.92Å; A378-G381 PolarHBondContact O-N 3.14Å; A378-V382 WeakPolarHBondContact O-CG2 3.32Å; A378-V382 PolarHBondContact O-N 3.37Å
379	P	97.2	Very high	96.1	Very high	29 Å²	29	43.2 Å²	43.2	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-57.4	-42.8	173	-29.2	37	0	0	0	113.8	M298 L343 G374 V376 V382 V383	M298-P379 HydrophobicContact SD-CB 4.08Å; L343-P379 HydrophobicContact CD1-CG 4.46Å; G374-P379 WeakPolarHBondContact O-CD 3.39Å; V376-P379 WeakPolarHBondContact O-CD 3.35Å; P379-V382 PolarHBondContact O-N 3.01Å; P379-V383 WeakPolarHBondContact O-CG2 3.45Å; P379-V383 PolarHBondContact O-N 3.46Å
380	I	97.1	Very high	96.2	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-40.1	177.3	-66	174.5	0	0	0	110.8	V376 A378 V383 L384 V435 T438 F439	V376-I380 HydrophobicContact CG1-CD1 3.74Å; V376-I380 WeakPolarHBondContact O-CB 3.36Å; V376-I380 VanDerWaalsContact O-CG1 3.24Å; V376-I380 WeakPolarHBondContact O-CG1 3.11Å; V376-I380 PolarHBondContact O-N 3.23Å; V376-I380 VanDerWaalsContact O-N 3.14Å; A378-I380 PolarHBondContact O-N 2.92Å; I380-V383 PolarHBondContact O-N 3.04Å; I380-L384 HydrophobicContact CG2-CD1 4.16Å; I380-L384 WeakPolarHBondContact O-CG 3.32Å; I380-L384 PolarHBondContact O-N 3.02Å; I380-V435 HydrophobicContact CG2-CG1 3.8Å; I380-T438 HydrophobicContact CD1-CG2 4.09Å; I380-F439 HydrophobicContact CB-CD2 4.48Å; I380-F439 HydrophobicContact CG2-CB 3.9Å; I380-F439 HydrophobicContact CG2-CD2 4.1Å
381	G	97.6	Very high	96.3	Very high	17 Å²	17	36.7 Å²	36.7	18%	0.175	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-44.4	173.5	0	0	0	0	0	113	L377 A378 L384 V385	L377-G381 PolarHBondContact O-N 2.88Å; A378-G381 PolarHBondContact O-N 3.14Å; G381-L384 PolarHBondContact O-N 3.26Å; G381-V385 WeakPolarHBondContact O-CG2 3.27Å; G381-V385 PolarHBondContact O-N 3.21Å
382	V	97.4	Very high	96.2	Very high	94 Å²	94	37.7 Å²	37.7	57%	0.57	23%	0.225	S	C	*	.	H	α-helix	trans	-63.3	-43.6	174.9	172.7	0	0	0	0	111.2	A378 P379 L384 V385 V386	A378-V382 WeakPolarHBondContact O-CG2 3.32Å; A378-V382 PolarHBondContact O-N 3.37Å; P379-V382 PolarHBondContact O-N 3.01Å; V382-L384 VanDerWaalsContact C-N 3.32Å; V382-L384 PolarHBondContact O-N 2.69Å; V382-V385 PolarHBondContact O-N 3.09Å; V382-V386 HydrophobicContact CG1-CG2 4.35Å; V382-V386 WeakPolarHBondContact O-CG2 3.37Å; V382-V386 PolarHBondContact O-N 3.1Å
383	V	96.5	Very high	96.1	Very high	11 Å²	11	41.8 Å²	41.8	7%	0.067	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-43	174.4	160.9	0	0	0	0	111.7	V301 I302 F304 V305 P379 I380 G387 V435	V301-V383 HydrophobicContact CB-CG1 4.17Å; V301-V383 HydrophobicContact CB-CG2 4.31Å; V301-V383 HydrophobicContact CG2-CG2 4.14Å; V301-V383 WeakPolarHBondContact O-CG1 3.38Å; I302-V383 HydrophobicContact CG1-CG2 4.49Å; F304-V383 HydrophobicContact CD1-CG1 3.75Å; F304-V383 HydrophobicContact CE1-CG1 4.07Å; V305-V383 HydrophobicContact CG2-CB 4.05Å; V305-V383 HydrophobicContact CG2-CG1 3.7Å; V305-V383 HydrophobicContact CG2-CG2 3.85Å; P379-V383 WeakPolarHBondContact O-CG2 3.45Å; P379-V383 PolarHBondContact O-N 3.46Å; I380-V383 PolarHBondContact O-N 3.04Å; V383-G387 WeakPolarHBondContact O-CA 3.18Å; V383-G387 PolarHBondContact O-N 3.31Å; V383-V435 HydrophobicContact CG1-CG1 4.42Å
384	L	97.6	Very high	95.8	Very high	16 Å²	16	41 Å²	41	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-43.3	177.8	-75.5	168.1	0	0	0	112.1	I380 G381 V382 G388 F432 V435 F436 F439	I380-L384 HydrophobicContact CG2-CD1 4.16Å; I380-L384 WeakPolarHBondContact O-CG 3.32Å; I380-L384 PolarHBondContact O-N 3.02Å; G381-L384 PolarHBondContact O-N 3.26Å; V382-L384 VanDerWaalsContact C-N 3.32Å; V382-L384 PolarHBondContact O-N 2.69Å; L384-G388 WeakPolarHBondContact O-CA 3.4Å; L384-G388 PolarHBondContact O-N 2.89Å; L384-F432 HydrophobicContact CB-CE2 4.4Å; L384-F432 HydrophobicContact CD2-CD2 3.82Å; L384-F432 HydrophobicContact CD2-CE2 3.59Å; L384-F432 HydrophobicContact CD2-CG 4.46Å; L384-F432 HydrophobicContact CD2-CZ 4.05Å; L384-F432 WeakPolarHBondContact O-CE2 3.33Å; L384-V435 HydrophobicContact CD1-CG1 4.4Å; L384-V435 HydrophobicContact CD2-CB 4.06Å; L384-V435 HydrophobicContact CD2-CG1 3.78Å; L384-V435 HydrophobicContact CG-CG1 3.92Å; L384-F436 HydrophobicContact CD1-CD2 4.36Å; L384-F436 HydrophobicContact CD2-CB 4.1Å; L384-F439 HydrophobicContact CD1-CB 3.52Å; L384-F439 HydrophobicContact CD1-CD1 4.42Å; L384-F439 HydrophobicContact CD1-CD2 4.11Å; L384-F439 HydrophobicContact CD1-CG 3.77Å
385	V	98	Very high	95.4	Very high	110 Å²	110	40.8 Å²	40.8	67%	0.667	22%	0.224	S	C	*	.	H	α-helix	trans	-62.3	-47.3	176.9	172	0	0	0	0	111.3	G381 V382 Y389	G381-V385 WeakPolarHBondContact O-CG2 3.27Å; G381-V385 PolarHBondContact O-N 3.21Å; V382-V385 PolarHBondContact O-N 3.09Å; V385-Y389 WeakPolarHBondContact O-CB 3.41Å; V385-Y389 PolarHBondContact O-N 3.31Å
386	V	97.4	Very high	95	Very high	55 Å²	55	44.5 Å²	44.5	33%	0.333	24%	0.243	S	C	.	.	H	α-helix	trans	-73.5	-44.4	-176.9	178.6	0	0	0	0	111.9	V305 V382 Y389 F390	V305-V386 HydrophobicContact CG1-CB 4.41Å; V305-V386 HydrophobicContact CG1-CG1 3.67Å; V382-V386 HydrophobicContact CG1-CG2 4.35Å; V382-V386 WeakPolarHBondContact O-CG2 3.37Å; V382-V386 PolarHBondContact O-N 3.1Å; V386-Y389 PolarHBondContact O-N 3Å; V386-F390 HydrophobicContact CG1-CD2 4.01Å; V386-F390 HydrophobicContact CG1-CE2 3.52Å; V386-F390 HydrophobicContact CG1-CZ 4.37Å; V386-F390 VanDerWaalsContact O-CD2 3.27Å; V386-F390 WeakPolarHBondContact O-CD2 3.44Å; V386-F390 PolarHBondContact O-N 3.44Å; V386-F390 VanDerWaalsContact O-N 3.13Å
387	G	95.9	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.8	0	0	0	0	0	112.4	V383 F390 L391	V383-G387 WeakPolarHBondContact O-CA 3.18Å; V383-G387 PolarHBondContact O-N 3.31Å; G387-F390 PolarHBondContact O-N 3.23Å; G387-L391 WeakPolarHBondContact O-CB 3.43Å; G387-L391 WeakPolarHBondContact O-CG 3.5Å; G387-L391 PolarHBondContact O-N 2.94Å
388	G	96.3	Very high	93.7	Very high	10 Å²	10	47.6 Å²	47.6	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-42.9	173.4	0	0	0	0	0	112.3	L384 F390 L391 I392	L384-G388 WeakPolarHBondContact O-CA 3.4Å; L384-G388 PolarHBondContact O-N 2.89Å; G388-F390 PolarHBondContact O-N 3.04Å; G388-L391 PolarHBondContact O-N 2.81Å; G388-I392 WeakPolarHBondContact O-CB 3.48Å; G388-I392 VanDerWaalsContact O-CG1 3.28Å; G388-I392 WeakPolarHBondContact O-CG1 3.47Å; G388-I392 PolarHBondContact O-N 2.98Å
389	Y	96.9	Very high	93	Very high	114 Å²	114	51.3 Å²	51.3	45%	0.447	27%	0.266	S	S	.	.	H	α-helix	trans	-57.5	-47.7	173.3	173.3	-98.3	0	0	0	112.3	V385 V386 I392 R393	V385-Y389 WeakPolarHBondContact O-CB 3.41Å; V385-Y389 PolarHBondContact O-N 3.31Å; V386-Y389 PolarHBondContact O-N 3Å; Y389-I392 PolarHBondContact O-N 3.43Å; Y389-R393 HydrophobicContact CD1-CG 4.39Å; Y389-R393 HydrophobicContact CD2-CG 4.34Å; Y389-R393 HydrophobicContact CE1-CG 4Å; Y389-R393 HydrophobicContact CE2-CG 3.93Å; Y389-R393 WeakPolarHBondContact O-CB 3.42Å; Y389-R393 VanDerWaalsContact O-CG 3.27Å; Y389-R393 WeakPolarHBondContact O-CG 3.23Å; Y389-R393 PolarHBondContact O-N 3.29Å; Y389-R393 PolarHBondContact OH-NE 3.41Å; Y389-R393 PolarHBondContact OH-NH2 3.19Å
390	F	94.9	Very high	92.3	Very high	37 Å²	37	52.6 Å²	52.6	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-35.7	177.9	-67.7	-49.2	0	0	0	113	V305 Y309 H312 V386 G387 G388 R393 G394	V305-F390 HydrophobicContact CG1-CD2 4.44Å; V305-F390 HydrophobicContact CG1-CE2 4.35Å; Y309-F390 HydrophobicContact CD2-CD1 4.22Å; Y309-F390 HydrophobicContact CD2-CD2 4.44Å; Y309-F390 AromaticContact CD2-CE1 3.74Å; Y309-F390 HydrophobicContact CD2-CE1 3.74Å; Y309-F390 AromaticContact CD2-CE2 3.97Å; Y309-F390 HydrophobicContact CD2-CE2 3.97Å; Y309-F390 AromaticContact CD2-CZ 3.61Å; Y309-F390 HydrophobicContact CD2-CZ 3.61Å; Y309-F390 HydrophobicContact CE2-CE1 4.35Å; Y309-F390 HydrophobicContact CE2-CZ 4.33Å; Y309-F390 HydrophobicContact CG-CE2 4.49Å; H312-F390 HydrophobicContact CB-CB 4.42Å; V386-F390 HydrophobicContact CG1-CD2 4.01Å; V386-F390 HydrophobicContact CG1-CE2 3.52Å; V386-F390 HydrophobicContact CG1-CZ 4.37Å; V386-F390 VanDerWaalsContact O-CD2 3.27Å; V386-F390 WeakPolarHBondContact O-CD2 3.44Å; V386-F390 PolarHBondContact O-N 3.44Å; V386-F390 VanDerWaalsContact O-N 3.13Å; G387-F390 PolarHBondContact O-N 3.23Å; G388-F390 PolarHBondContact O-N 3.04Å; F390-R393 PolarHBondContact O-N 2.9Å; F390-G394 PolarHBondContact O-N 3.05Å
391	L	93.6	Very high	91.3	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-47.1	174.1	-75.4	169.8	0	0	0	111.8	F304 T308 W311 G387 G388 G394 V395 F429 F432	F304-L391 HydrophobicContact CZ-CD1 4.34Å; T308-L391 HydrophobicContact CG2-CD1 4.01Å; T308-L391 HydrophobicContact CG2-CD2 3.96Å; T308-L391 HydrophobicContact CG2-CG 3.71Å; W311-L391 HydrophobicContact CE3-CD2 3.95Å; W311-L391 HydrophobicContact CZ3-CD2 3.88Å; G387-L391 WeakPolarHBondContact O-CB 3.43Å; G387-L391 WeakPolarHBondContact O-CG 3.5Å; G387-L391 PolarHBondContact O-N 2.94Å; G388-L391 PolarHBondContact O-N 2.81Å; L391-G394 PolarHBondContact O-N 3.49Å; L391-V395 WeakPolarHBondContact O-CG2 3.33Å; L391-V395 PolarHBondContact O-N 3.19Å; L391-F429 HydrophobicContact CB-CE1 3.86Å; L391-F429 HydrophobicContact CB-CZ 3.82Å; L391-F429 HydrophobicContact CD1-CD1 4.21Å; L391-F429 HydrophobicContact CD1-CE1 4.2Å; L391-F429 HydrophobicContact CD2-CD1 4.49Å; L391-F429 HydrophobicContact CD2-CD2 4.25Å; L391-F429 HydrophobicContact CD2-CE1 4.31Å; L391-F429 HydrophobicContact CD2-CE2 4.05Å; L391-F429 HydrophobicContact CD2-CG 4.45Å; L391-F429 HydrophobicContact CD2-CZ 4.07Å; L391-F429 HydrophobicContact CG-CE1 4.35Å; L391-F429 HydrophobicContact CG-CZ 4.41Å; L391-F432 HydrophobicContact CD1-CB 3.67Å; L391-F432 HydrophobicContact CD1-CD2 3.86Å; L391-F432 HydrophobicContact CD1-CG 3.86Å
392	I	93.6	Very high	90.1	Very high	99 Å²	99	61.4 Å²	61.4	51%	0.508	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-46.5	176.7	-67.5	165.1	0	0	0	110.5	G388 Y389 G394 V395 M396	G388-I392 WeakPolarHBondContact O-CB 3.48Å; G388-I392 VanDerWaalsContact O-CG1 3.28Å; G388-I392 WeakPolarHBondContact O-CG1 3.47Å; G388-I392 PolarHBondContact O-N 2.98Å; Y389-I392 PolarHBondContact O-N 3.43Å; I392-G394 VanDerWaalsContact C-N 3.34Å; I392-G394 PolarHBondContact O-N 3.4Å; I392-V395 PolarHBondContact O-N 3.32Å; I392-M396 HydrophobicContact CG2-CE 3.72Å; I392-M396 HydrophobicContact CG2-CG 4.5Å; I392-M396 HydrophobicContact CG2-SD 4.07Å; I392-M396 WeakPolarHBondContact O-CG 3.18Å; I392-M396 PolarHBondContact O-N 2.84Å
393	R	91.8	Very high	89.1	Confident	112 Å²	112	60.7 Å²	60.7	42%	0.423	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-38.2	176	-73.4	-66	-161.9	-175.3	2.7	112.7	Y389 F390 T397	Y389-R393 HydrophobicContact CD1-CG 4.39Å; Y389-R393 HydrophobicContact CD2-CG 4.34Å; Y389-R393 HydrophobicContact CE1-CG 4Å; Y389-R393 HydrophobicContact CE2-CG 3.93Å; Y389-R393 WeakPolarHBondContact O-CB 3.42Å; Y389-R393 VanDerWaalsContact O-CG 3.27Å; Y389-R393 WeakPolarHBondContact O-CG 3.23Å; Y389-R393 PolarHBondContact O-N 3.29Å; Y389-R393 PolarHBondContact OH-NE 3.41Å; Y389-R393 PolarHBondContact OH-NH2 3.19Å; F390-R393 PolarHBondContact O-N 2.9Å; R393-T397 WeakPolarHBondContact O-CB 3.48Å; R393-T397 PolarHBondContact O-N 2.96Å; R393-T397 PolarHBondContact O-OG1 3.23Å
394	G	88.6	Confident	87.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-48.2	174.9	0	0	0	0	0	112.1	F390 L391 I392 T397 L398	F390-G394 PolarHBondContact O-N 3.05Å; L391-G394 PolarHBondContact O-N 3.49Å; I392-G394 VanDerWaalsContact C-N 3.34Å; I392-G394 PolarHBondContact O-N 3.4Å; G394-T397 PolarHBondContact O-N 2.87Å; G394-L398 PolarHBondContact O-N 3.07Å
395	V	87.6	Confident	86.4	Confident	40 Å²	40	69.2 Å²	69.2	24%	0.242	35%	0.352	C	S	.	.	H	α-helix	trans	-62.2	-45.3	176	171.2	0	0	0	0	112.2	W311 L391 I392 T397 L398 F399 F429	W311-V395 HydrophobicContact CH2-CG2 3.87Å; W311-V395 HydrophobicContact CZ3-CG2 4.43Å; L391-V395 WeakPolarHBondContact O-CG2 3.33Å; L391-V395 PolarHBondContact O-N 3.19Å; I392-V395 PolarHBondContact O-N 3.32Å; V395-T397 VanDerWaalsContact C-N 3.29Å; V395-T397 PolarHBondContact O-N 3.02Å; V395-L398 PolarHBondContact O-N 2.94Å; V395-F399 HydrophobicContact CG1-CD2 3.59Å; V395-F399 HydrophobicContact CG1-CE2 3.39Å; V395-F399 VanDerWaalsContact O-CD2 3.31Å; V395-F399 WeakPolarHBondContact O-CD2 3.33Å; V395-F399 PolarHBondContact O-N 3.15Å; V395-F429 HydrophobicContact CG2-CE2 3.62Å; V395-F429 HydrophobicContact CG2-CZ 3.49Å; V395-F429 VanDerWaalsContact CG2-CZ 3.49Å
396	M	88.2	Confident	84.5	Confident	111 Å²	111	69.7 Å²	69.7	55%	0.547	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-41	174.9	-72.3	176.5	171.7	0	0	112.1	I392 S400	I392-M396 HydrophobicContact CG2-CE 3.72Å; I392-M396 HydrophobicContact CG2-CG 4.5Å; I392-M396 HydrophobicContact CG2-SD 4.07Å; I392-M396 WeakPolarHBondContact O-CG 3.18Å; I392-M396 PolarHBondContact O-N 2.84Å; M396-S400 WeakPolarHBondContact O-CB 3.45Å; M396-S400 PolarHBondContact O-N 3.18Å
397	T	84.6	Confident	82.5	Confident	32 Å²	32	70.8 Å²	70.8	20%	0.196	38%	0.38	C	S	.	.	H	α-helix	trans	-65.9	-45.4	177.9	-53.1	0	0	0	0	111	F315 R393 G394 V395 F399 S400 I401	F315-T397 HydrophobicContact CB-CG2 4.09Å; R393-T397 WeakPolarHBondContact O-CB 3.48Å; R393-T397 PolarHBondContact O-N 2.96Å; R393-T397 PolarHBondContact O-OG1 3.23Å; G394-T397 PolarHBondContact O-N 2.87Å; V395-T397 VanDerWaalsContact C-N 3.29Å; V395-T397 PolarHBondContact O-N 3.02Å; T397-F399 PolarHBondContact O-N 2.99Å; T397-S400 PolarHBondContact O-N 3.4Å; T397-I401 HydrophobicContact CG2-CD1 3.94Å; T397-I401 WeakPolarHBondContact O-CG1 3.32Å; T397-I401 PolarHBondContact O-N 2.94Å
398	L	80.3	Confident	80.4	Confident	53 Å²	53	77.5 Å²	77.5	28%	0.277	42%	0.415	S	S	.	.	H	α-helix	trans	-59	-45.8	176.4	170.5	59.6	0	0	0	112.2	F315 G394 V395 I401 K402	F315-L398 HydrophobicContact CD1-CB 4.44Å; F315-L398 HydrophobicContact CD1-CD1 4.42Å; F315-L398 HydrophobicContact CE1-CB 4.32Å; F315-L398 HydrophobicContact CE1-CD1 3.7Å; F315-L398 HydrophobicContact CE1-CG 4.42Å; F315-L398 HydrophobicContact CZ-CB 4.36Å; F315-L398 HydrophobicContact CZ-CD1 4Å; F315-L398 HydrophobicContact CZ-CD2 4.13Å; F315-L398 HydrophobicContact CZ-CG 4.39Å; G394-L398 PolarHBondContact O-N 3.07Å; V395-L398 PolarHBondContact O-N 2.94Å; L398-I401 PolarHBondContact O-N 3.4Å; L398-K402 WeakPolarHBondContact O-CB 3.44Å; L398-K402 PolarHBondContact O-N 3.05Å; L398-K402 VanDerWaalsContact O-N 3.1Å
399	F	81.2	Confident	78.5	Confident	133 Å²	133	81.2 Å²	81.2	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-64.3	-43.1	176	-77.9	-58.1	0	0	0	112.2	V395 T397 I401 K402 S403	V395-F399 HydrophobicContact CG1-CD2 3.59Å; V395-F399 HydrophobicContact CG1-CE2 3.39Å; V395-F399 VanDerWaalsContact O-CD2 3.31Å; V395-F399 WeakPolarHBondContact O-CD2 3.33Å; V395-F399 PolarHBondContact O-N 3.15Å; T397-F399 PolarHBondContact O-N 2.99Å; F399-I401 PolarHBondContact O-N 2.94Å; F399-K402 PolarHBondContact O-N 2.68Å; F399-S403 PolarHBondContact O-N 2.95Å; F399-S403 PolarHBondContact O-OG 3.44Å
400	S	82.6	Confident	76.4	Confident	56 Å²	56	80.1 Å²	80.1	39%	0.392	44%	0.441	S	S	.	.	H	α-helix	trans	-64.6	-35.7	178.5	-173.6	0	0	0	0	113.2	M396 T397 S403 N404	M396-S400 WeakPolarHBondContact O-CB 3.45Å; M396-S400 PolarHBondContact O-N 3.18Å; T397-S400 PolarHBondContact O-N 3.4Å; S400-S403 WeakPolarHBondContact CA-OG 3.36Å; S400-S403 PolarHBondContact O-OG 3.49Å; S400-S403 VanDerWaalsContact O-OG 3.09Å; S400-N404 WeakPolarHBondContact O-CB 3.27Å; S400-N404 PolarHBondContact O-N 3.33Å; S400-N404 VanDerWaalsContact O-N 3.08Å; S400-N404 PolarHBondContact O-ND2 3.2Å; S400-N404 PolarHBondContact O-OD1 3.28Å; S400-N404 PolarHBondContact OG-ND2 3.15Å
401	I	75.8	Confident	74.6	Confident	42 Å²	42	86.5 Å²	86.5	22%	0.215	47%	0.471	C	S	.	.	H	α-helix	trans	-66.9	-43.3	174.4	-68.9	166.8	0	0	0	109.8	F315 L318 T397 L398 F399 S403 N404 H405	F315-I401 WeakPolarHBondContact O-CD1 3.4Å; L318-I401 HydrophobicContact CB-CD1 4.44Å; T397-I401 HydrophobicContact CG2-CD1 3.94Å; T397-I401 WeakPolarHBondContact O-CG1 3.32Å; T397-I401 PolarHBondContact O-N 2.94Å; L398-I401 PolarHBondContact O-N 3.4Å; F399-I401 PolarHBondContact O-N 2.94Å; I401-S403 PolarHBondContact O-N 3.35Å; I401-N404 PolarHBondContact O-N 3.03Å; I401-H405 PolarHBondContact O-N 2.98Å
402	K	73.6	Confident	72.7	Confident	162 Å²	162	95.3 Å²	95.3	70%	0.704	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-36.8	178.6	-172.9	-178.3	177.5	-174.3	0	112.9	L398 F399	L398-K402 WeakPolarHBondContact O-CB 3.44Å; L398-K402 PolarHBondContact O-N 3.05Å; L398-K402 VanDerWaalsContact O-N 3.1Å; F399-K402 PolarHBondContact O-N 2.68Å
403	S	75.8	Confident	70.6	Confident	79 Å²	79	93.2 Å²	93.2	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-76.6	-39	177.5	57.5	0	0	0	0	113.1	F399 S400 I401	F399-S403 PolarHBondContact O-N 2.95Å; F399-S403 PolarHBondContact O-OG 3.44Å; S400-S403 WeakPolarHBondContact CA-OG 3.36Å; S400-S403 PolarHBondContact O-OG 3.49Å; S400-S403 VanDerWaalsContact O-OG 3.09Å; I401-S403 PolarHBondContact O-N 3.35Å
404	N	71.3	Confident	68.8	Low	96 Å²	96	88.6 Å²	88.6	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-92.5	-21.3	-165.2	-59.7	-0.1	0	0	0	113.7	S400 I401 P406	S400-N404 WeakPolarHBondContact O-CB 3.27Å; S400-N404 PolarHBondContact O-N 3.33Å; S400-N404 VanDerWaalsContact O-N 3.08Å; S400-N404 PolarHBondContact O-ND2 3.2Å; S400-N404 PolarHBondContact O-OD1 3.28Å; S400-N404 PolarHBondContact OG-ND2 3.15Å; I401-N404 PolarHBondContact O-N 3.03Å; N404-P406 VanDerWaalsContact C-CD 3.42Å
405	H	65.7	Low	67.4	Low	110 Å²	110	91.8 Å²	91.8	51%	0.509	52%	0.515	S	S	.	.			trans	-128.9	53.3	-176.9	-58.1	-53.2	0	0	0	114.1	I401 G407	I401-H405 PolarHBondContact O-N 2.98Å; H405-G407 PolarHBondContact O-N 3.36Å; H405-G407 VanDerWaalsContact O-N 3.1Å
406	P	59	Low	65.9	Low	119 Å²	119	94.8 Å²	94.8	77%	0.773	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.3	-173.5	27.9	-36.6	0	0	0	115.4	N404	N404-P406 VanDerWaalsContact C-CD 3.42Å
407	G	55.6	Low	64.6	Low	79 Å²	79	92.5 Å²	92.5	81%	0.814	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	0.4	-174.4	0	0	0	0	0	116.8	H405	H405-G407 PolarHBondContact O-N 3.36Å; H405-G407 VanDerWaalsContact O-N 3.1Å
408	L	51.5	Low	63.6	Low	140 Å²	140	93.9 Å²	93.9	73%	0.733	52%	0.521	S	S	*	.	S	Bend	trans	-98.4	-10.8	-168.7	-117.5	169.9	0	0	0	115
409	L	55.4	Low	63.3	Low	89 Å²	89	97.3 Å²	97.3	47%	0.466	54%	0.535	S	S	.	.	S	Bend	trans	-110.9	114.7	179.3	-58.5	175	0	0	0	109.5	E411 A414	L409-E411 PolarHBondContact O-N 3.21Å; L409-E411 VanDerWaalsContact O-N 3.14Å; L409-A414 HydrophobicContact CB-CB 3.62Å
410	S	52.9	Low	62.7	Low	91 Å²	91	91.9 Å²	91.9	64%	0.636	51%	0.513	S	S	*	.			trans	-54.6	119.9	176.1	179.5	0	0	0	0	110.2	K412 A413 A414	S410-K412 PolarHBondContact O-N 3.08Å; S410-A413 PolarHBondContact O-N 3.4Å; S410-A414 WeakPolarHBondContact O-CB 3.48Å; S410-A414 PolarHBondContact O-N 2.76Å
411	E	58.8	Low	62.2	Low	171 Å²	171	90 Å²	90	80%	0.799	50%	0.498	S	S	*	.	H	α-helix	trans	-46.3	-38.2	-169.1	-62	179.9	112.4	0	0	113.5	L409 S415	L409-E411 PolarHBondContact O-N 3.21Å; L409-E411 VanDerWaalsContact O-N 3.14Å; E411-S415 WeakPolarHBondContact O-CB 3.06Å; E411-S415 PolarHBondContact O-N 2.9Å; E411-S415 PolarHBondContact O-OG 2.94Å
412	K	52.1	Low	62.2	Low	187 Å²	187	92.6 Å²	92.6	81%	0.813	51%	0.512	S	S	*	.	H	α-helix	trans	-81.2	-17.8	-173.9	-147.9	163.9	-167.9	163.3	0	114.7	S410	S410-K412 PolarHBondContact O-N 3.08Å
413	A	50	Low	62.7	Low	56 Å²	56	87.6 Å²	87.6	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-97.3	-40.7	169.3	0	0	0	0	0	110.8	S410 K416 I417	S410-A413 PolarHBondContact O-N 3.4Å; A413-K416 PolarHBondContact O-N 3.21Å; A413-I417 PolarHBondContact O-N 2.98Å
414	A	53.8	Low	62.9	Low	14 Å²	14	84.3 Å²	84.3	12%	0.116	47%	0.465	C	S	.	.	H	α-helix	trans	-55	-53.2	176.7	0	0	0	0	0	112	L409 S410 K416 I417 N418	L409-A414 HydrophobicContact CB-CB 3.62Å; S410-A414 WeakPolarHBondContact O-CB 3.48Å; S410-A414 PolarHBondContact O-N 2.76Å; A414-K416 VanDerWaalsContact C-N 3.31Å; A414-K416 PolarHBondContact O-N 3.26Å; A414-I417 PolarHBondContact O-N 3.32Å; A414-N418 VanDerWaalsContact O-CB 3.24Å; A414-N418 WeakPolarHBondContact O-CB 3.34Å; A414-N418 PolarHBondContact O-N 3.28Å; A414-N418 PolarHBondContact O-ND2 3.48Å
415	S	59.6	Low	63.5	Low	68 Å²	68	79.9 Å²	79.9	48%	0.476	44%	0.442	S	S	.	.	H	α-helix	trans	-54.3	-43.3	-179.1	46.4	0	0	0	0	113.1	E411 N418 E419	E411-S415 WeakPolarHBondContact O-CB 3.06Å; E411-S415 PolarHBondContact O-N 2.9Å; E411-S415 PolarHBondContact O-OG 2.94Å; S415-N418 PolarHBondContact O-N 2.96Å; S415-E419 WeakPolarHBondContact O-CB 3.35Å; S415-E419 PolarHBondContact O-N 3.34Å
416	K	56.9	Low	64.6	Low	103 Å²	103	79.3 Å²	79.3	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-74.6	-36.3	-175.7	-167.4	175.5	176.9	-174.1	0	113.4	A413 A414 D569	A413-K416 PolarHBondContact O-N 3.21Å; A414-K416 VanDerWaalsContact C-N 3.31Å; A414-K416 PolarHBondContact O-N 3.26Å; K416-D569 VanDerWaalsContact NZ-CG 3.34Å; K416-D569 IonicContact NZ-OD1 3.82Å; K416-D569 PolarHBondContact NZ-OD1 3.14Å; K416-D569 IonicContact NZ-OD2 2.77Å
417	I	60.1	Low	65.9	Low	62 Å²	62	74.3 Å²	74.3	32%	0.318	41%	0.408	S	S	.	.	H	α-helix	trans	-67.4	-48.7	171.7	-66.3	172	0	0	0	109	L318 A413 A414 E419 T420 M421	L318-I417 HydrophobicContact CD2-CG2 3.93Å; A413-I417 PolarHBondContact O-N 2.98Å; A414-I417 PolarHBondContact O-N 3.32Å; I417-E419 VanDerWaalsContact C-N 3.32Å; I417-E419 PolarHBondContact O-N 2.91Å; I417-T420 PolarHBondContact O-N 2.87Å; I417-T420 PolarHBondContact O-OG1 2.81Å; I417-M421 HydrophobicContact CG2-SD 3.85Å; I417-M421 PolarHBondContact O-N 3.05Å
418	N	64.8	Low	67.5	Low	62 Å²	62	70.7 Å²	70.7	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-56.9	-41.1	177.1	-71.1	-15.7	0	0	0	112.3	A414 S415 T420 M421 L422	A414-N418 VanDerWaalsContact O-CB 3.24Å; A414-N418 WeakPolarHBondContact O-CB 3.34Å; A414-N418 PolarHBondContact O-N 3.28Å; A414-N418 PolarHBondContact O-ND2 3.48Å; S415-N418 PolarHBondContact O-N 2.96Å; N418-T420 PolarHBondContact O-N 2.89Å; N418-M421 PolarHBondContact O-N 3.43Å; N418-L422 WeakPolarHBondContact O-CB 3.39Å; N418-L422 PolarHBondContact O-N 2.91Å
419	E	72.5	Confident	69.4	Low	125 Å²	125	68.2 Å²	68.2	58%	0.584	35%	0.354	S	S	*	.	H	α-helix	trans	-55.2	-50.4	177.4	-174.8	-173.1	165.7	0	0	111.6	S415 I417 R423	S415-E419 WeakPolarHBondContact O-CB 3.35Å; S415-E419 PolarHBondContact O-N 3.34Å; I417-E419 VanDerWaalsContact C-N 3.32Å; I417-E419 PolarHBondContact O-N 2.91Å; E419-R423 VanDerWaalsContact O-CB 3.25Å; E419-R423 WeakPolarHBondContact O-CB 3.23Å; E419-R423 PolarHBondContact O-N 2.91Å
420	T	68.9	Low	71.2	Confident	19 Å²	19	67.5 Å²	67.5	12%	0.117	35%	0.35	C	S	.	.	H	α-helix	trans	-69.4	-36.8	-177.9	63.4	0	0	0	0	113.1	I417 N418 L424 P571	I417-T420 PolarHBondContact O-N 2.87Å; I417-T420 PolarHBondContact O-OG1 2.81Å; N418-T420 PolarHBondContact O-N 2.89Å; T420-L424 PolarHBondContact O-N 2.94Å; T420-P571 HydrophobicContact CG2-CB 4.43Å
421	M	72.1	Confident	73.1	Confident	17 Å²	17	63.2 Å²	63.2	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-77.1	-35.2	179.2	-65	-178.5	66.7	0	0	112.7	W311 F315 L318 I417 N418 L424 G425	W311-M421 PolarHBondContact NE1-O 3.2Å; F315-M421 HydrophobicContact CB-CE 4.32Å; F315-M421 HydrophobicContact CD1-CE 3.6Å; F315-M421 HydrophobicContact CD2-CE 4.08Å; F315-M421 HydrophobicContact CE1-CB 4.19Å; F315-M421 HydrophobicContact CE1-CE 3.75Å; F315-M421 HydrophobicContact CE1-SD 4.43Å; F315-M421 HydrophobicContact CE2-CB 4.33Å; F315-M421 HydrophobicContact CE2-CE 4.26Å; F315-M421 HydrophobicContact CG-CE 3.74Å; F315-M421 HydrophobicContact CZ-CB 3.77Å; F315-M421 HydrophobicContact CZ-CE 4.09Å; L318-M421 HydrophobicContact CD1-CE 4.08Å; L318-M421 HydrophobicContact CD1-SD 4.06Å; L318-M421 HydrophobicContact CD2-CE 4.32Å; L318-M421 HydrophobicContact CD2-SD 3.78Å; L318-M421 HydrophobicContact CG-CE 4.14Å; L318-M421 HydrophobicContact CG-SD 4.18Å; I417-M421 HydrophobicContact CG2-SD 3.85Å; I417-M421 PolarHBondContact O-N 3.05Å; N418-M421 PolarHBondContact O-N 3.43Å; M421-L424 PolarHBondContact O-N 3.49Å; M421-G425 PolarHBondContact O-N 3.31Å
422	L	76.9	Confident	74.9	Confident	96 Å²	96	57.8 Å²	57.8	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-41.5	171.6	-177.9	147.6	0	0	0	110.4	N418 L424 G425 I426	N418-L422 WeakPolarHBondContact O-CB 3.39Å; N418-L422 PolarHBondContact O-N 2.91Å; L422-L424 PolarHBondContact O-N 3.31Å; L422-G425 WeakPolarHBondContact O-CA 3.48Å; L422-G425 PolarHBondContact O-N 3.42Å; L422-G425 VanDerWaalsContact O-N 3.1Å; L422-I426 HydrophobicContact CD2-CD1 3.62Å; L422-I426 HydrophobicContact CD2-CG1 4.3Å; L422-I426 WeakPolarHBondContact O-CG1 3.44Å; L422-I426 PolarHBondContact O-N 2.85Å
423	R	82.8	Confident	77.1	Confident	56 Å²	56	50.3 Å²	50.3	21%	0.211	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-44	173	-173.3	176.2	-173.4	-115.9	2.2	112.2	E419 G425 I426 F427 T506 W507	E419-R423 VanDerWaalsContact O-CB 3.25Å; E419-R423 WeakPolarHBondContact O-CB 3.23Å; E419-R423 PolarHBondContact O-N 2.91Å; R423-G425 PolarHBondContact O-N 2.77Å; R423-I426 PolarHBondContact O-N 3.39Å; R423-F427 HydrophobicContact CG-CD2 4.15Å; R423-F427 HydrophobicContact CG-CE2 3.76Å; R423-F427 WeakPolarHBondContact O-CD2 3.25Å; R423-F427 PolarHBondContact O-N 3.21Å; R423-F427 VanDerWaalsContact O-N 3.17Å; R423-T506 PolarHBondContact NH2-O 3.04Å; R423-W507 HydrophobicContact CB-CZ3 4.42Å; R423-W507 HydrophobicContact CG-CE3 4.45Å; R423-W507 HydrophobicContact CG-CZ3 3.98Å; R423-W507 VanDerWaalsContact CZ-O 3.28Å; R423-W507 VanDerWaalsContact NH1-CE3 3.34Å; R423-W507 PolarHBondContact NH1-O 3.42Å; R423-W507 PolarHBondContact NH2-O 3.05Å
424	L	80.8	Confident	79.3	Confident	10 Å²	10	49 Å²	49	5%	0.052	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-34.3	174.2	-168.9	61.9	0	0	0	111.8	P235 L239 L307 T420 M421 L422 F427 G428 W507	P235-L424 HydrophobicContact CB-CD2 4.27Å; P235-L424 HydrophobicContact CG-CD2 3.84Å; L239-L424 HydrophobicContact CD1-CD1 3.93Å; L307-L424 HydrophobicContact CD1-CD1 3.8Å; T420-L424 PolarHBondContact O-N 2.94Å; M421-L424 PolarHBondContact O-N 3.49Å; L422-L424 PolarHBondContact O-N 3.31Å; L424-F427 PolarHBondContact O-N 2.93Å; L424-G428 PolarHBondContact O-N 2.9Å; L424-W507 HydrophobicContact CB-CZ3 4.4Å; L424-W507 HydrophobicContact CD1-CH2 4.5Å; L424-W507 HydrophobicContact CD1-CZ3 4.25Å
425	G	83.9	Confident	81.3	Confident	3 Å²	3	48.8 Å²	48.8	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-43.2	175.5	0	0	0	0	0	113.7	W311 M421 L422 R423 F427 G428 F429	W311-G425 VanDerWaalsContact CZ2-CA 3.43Å; W311-G425 VanDerWaalsContact NE1-N 3.12Å; M421-G425 PolarHBondContact O-N 3.31Å; L422-G425 WeakPolarHBondContact O-CA 3.48Å; L422-G425 PolarHBondContact O-N 3.42Å; L422-G425 VanDerWaalsContact O-N 3.1Å; R423-G425 PolarHBondContact O-N 2.77Å; G425-F427 VanDerWaalsContact C-N 3.26Å; G425-F427 PolarHBondContact O-N 3.5Å; G425-G428 WeakPolarHBondContact O-CA 3.41Å; G425-G428 PolarHBondContact O-N 3.05Å; G425-G428 VanDerWaalsContact O-N 3.08Å; G425-F429 VanDerWaalsContact O-CD2 3.29Å; G425-F429 WeakPolarHBondContact O-CD2 3.43Å; G425-F429 PolarHBondContact O-N 2.91Å
426	I	87.5	Confident	83.1	Confident	99 Å²	99	51.3 Å²	51.3	51%	0.508	25%	0.253	S	S	.	.	H	α-helix	trans	-56.4	-43.7	173.4	-69.4	170.2	0	0	0	110.1	L422 R423 F429 L430	L422-I426 HydrophobicContact CD2-CD1 3.62Å; L422-I426 HydrophobicContact CD2-CG1 4.3Å; L422-I426 WeakPolarHBondContact O-CG1 3.44Å; L422-I426 PolarHBondContact O-N 2.85Å; R423-I426 PolarHBondContact O-N 3.39Å; I426-F429 PolarHBondContact O-N 2.95Å; I426-L430 VanDerWaalsContact O-CB 3.26Å; I426-L430 WeakPolarHBondContact O-CB 3.17Å; I426-L430 PolarHBondContact O-N 3.15Å
427	F	86.3	Confident	85	Confident	14 Å²	14	49.6 Å²	49.6	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-38.5	174.9	-72.7	-57.3	0	0	0	113.1	R423 L424 G425 L430 A431 A503 M504 T506 W507	R423-F427 HydrophobicContact CG-CD2 4.15Å; R423-F427 HydrophobicContact CG-CE2 3.76Å; R423-F427 WeakPolarHBondContact O-CD2 3.25Å; R423-F427 PolarHBondContact O-N 3.21Å; R423-F427 VanDerWaalsContact O-N 3.17Å; L424-F427 PolarHBondContact O-N 2.93Å; G425-F427 VanDerWaalsContact C-N 3.26Å; G425-F427 PolarHBondContact O-N 3.5Å; F427-L430 PolarHBondContact O-N 3.27Å; F427-A431 VanDerWaalsContact O-CB 3.3Å; F427-A431 WeakPolarHBondContact O-CB 3.44Å; F427-A431 PolarHBondContact O-N 3.28Å; F427-A503 VanDerWaalsContact CE1-O 3.32Å; F427-A503 WeakPolarHBondContact CE1-O 3.42Å; F427-M504 HydrophobicContact CB-CE 3.9Å; F427-M504 HydrophobicContact CB-SD 4.33Å; F427-M504 HydrophobicContact CD1-CE 3.74Å; F427-M504 HydrophobicContact CG-CE 4.24Å; F427-M504 WeakPolarHBondContact O-CE 3.45Å; F427-T506 WeakPolarHBondContact CE1-OG1 3.4Å; F427-T506 VanDerWaalsContact CZ-OG1 3.27Å; F427-T506 WeakPolarHBondContact CZ-OG1 3.34Å; F427-W507 AromaticContact CD2-CE3 3.69Å; F427-W507 HydrophobicContact CD2-CE3 3.69Å; F427-W507 HydrophobicContact CD2-CZ3 4.21Å; F427-W507 AromaticContact CE2-CE3 3.7Å; F427-W507 HydrophobicContact CE2-CE3 3.7Å; F427-W507 HydrophobicContact CE2-CZ3 4.39Å
428	G	89.2	Confident	86.7	Confident	2 Å²	2	47 Å²	47	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-46.5	171.6	0	0	0	0	0	113.3	F304 L424 G425 F432	F304-G428 WeakPolarHBondContact CE2-O 3.36Å; L424-G428 PolarHBondContact O-N 2.9Å; G425-G428 WeakPolarHBondContact O-CA 3.41Å; G425-G428 PolarHBondContact O-N 3.05Å; G425-G428 VanDerWaalsContact O-N 3.08Å; G428-F432 WeakPolarHBondContact O-CB 3.4Å; G428-F432 PolarHBondContact O-N 3.44Å
429	F	92.8	Very high	88.2	Confident	89 Å²	89	46.5 Å²	46.5	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-70.5	-36.6	177.6	-79	-69.6	0	0	0	113.4	W311 L391 V395 G425 I426 F432 G433	W311-F429 AromaticContact CH2-CE2 3.9Å; W311-F429 HydrophobicContact CH2-CE2 3.9Å; W311-F429 HydrophobicContact CZ3-CE2 4.34Å; L391-F429 HydrophobicContact CB-CE1 3.86Å; L391-F429 HydrophobicContact CB-CZ 3.82Å; L391-F429 HydrophobicContact CD1-CD1 4.21Å; L391-F429 HydrophobicContact CD1-CE1 4.2Å; L391-F429 HydrophobicContact CD2-CD1 4.49Å; L391-F429 HydrophobicContact CD2-CD2 4.25Å; L391-F429 HydrophobicContact CD2-CE1 4.31Å; L391-F429 HydrophobicContact CD2-CE2 4.05Å; L391-F429 HydrophobicContact CD2-CG 4.45Å; L391-F429 HydrophobicContact CD2-CZ 4.07Å; L391-F429 HydrophobicContact CG-CE1 4.35Å; L391-F429 HydrophobicContact CG-CZ 4.41Å; V395-F429 HydrophobicContact CG2-CE2 3.62Å; V395-F429 HydrophobicContact CG2-CZ 3.49Å; V395-F429 VanDerWaalsContact CG2-CZ 3.49Å; G425-F429 VanDerWaalsContact O-CD2 3.29Å; G425-F429 WeakPolarHBondContact O-CD2 3.43Å; G425-F429 PolarHBondContact O-N 2.91Å; I426-F429 PolarHBondContact O-N 2.95Å; F429-F432 PolarHBondContact O-N 2.96Å; F429-G433 PolarHBondContact O-N 3.25Å
430	L	93.4	Very high	89.4	Confident	73 Å²	73	42.2 Å²	42.2	38%	0.382	22%	0.22	S	C	.	.	H	α-helix	trans	-67	-43.9	176.7	-177.5	56.8	0	0	0	111.5	I426 F427 G433 F434 A503	I426-L430 VanDerWaalsContact O-CB 3.26Å; I426-L430 WeakPolarHBondContact O-CB 3.17Å; I426-L430 PolarHBondContact O-N 3.15Å; F427-L430 PolarHBondContact O-N 3.27Å; L430-G433 PolarHBondContact O-N 2.88Å; L430-F434 HydrophobicContact CD1-CD2 4.24Å; L430-F434 HydrophobicContact CD1-CE2 3.64Å; L430-F434 HydrophobicContact CD1-CZ 4.23Å; L430-F434 HydrophobicContact CG-CD2 4.28Å; L430-F434 HydrophobicContact CG-CE2 3.84Å; L430-F434 WeakPolarHBondContact O-CD2 3.26Å; L430-F434 PolarHBondContact O-N 3.47Å; L430-A503 HydrophobicContact CD2-CB 3.73Å; L430-A503 HydrophobicContact CG-CB 4.15Å
431	A	92.9	Very high	90.7	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-43.1	172.7	0	0	0	0	0	111.9	F304 F427 G433 F434 V435 T500 M504	F304-A431 HydrophobicContact CD2-CB 3.58Å; F304-A431 HydrophobicContact CE2-CB 3.72Å; F427-A431 VanDerWaalsContact O-CB 3.3Å; F427-A431 WeakPolarHBondContact O-CB 3.44Å; F427-A431 PolarHBondContact O-N 3.28Å; A431-G433 VanDerWaalsContact C-N 3.31Å; A431-G433 PolarHBondContact O-N 3.01Å; A431-F434 PolarHBondContact O-N 3.29Å; A431-V435 WeakPolarHBondContact O-CG2 3.41Å; A431-V435 PolarHBondContact O-N 2.9Å; A431-T500 HydrophobicContact CB-CG2 4.48Å; A431-M504 HydrophobicContact CB-CE 3.9Å; A431-M504 HydrophobicContact CB-SD 4.23Å
432	F	96.1	Very high	91.7	Very high	57 Å²	57	41.3 Å²	41.3	25%	0.25	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-43.6	174.9	-177.4	-91.7	0	0	0	112.1	F304 L384 L391 G428 F429 F434 V435 F436	F304-F432 HydrophobicContact CE2-CB 4.34Å; F304-F432 HydrophobicContact CZ-CB 3.85Å; F304-F432 HydrophobicContact CZ-CD2 4.07Å; F304-F432 HydrophobicContact CZ-CG 4.48Å; L384-F432 HydrophobicContact CB-CE2 4.4Å; L384-F432 HydrophobicContact CD2-CD2 3.82Å; L384-F432 HydrophobicContact CD2-CE2 3.59Å; L384-F432 HydrophobicContact CD2-CG 4.46Å; L384-F432 HydrophobicContact CD2-CZ 4.05Å; L384-F432 WeakPolarHBondContact O-CE2 3.33Å; L391-F432 HydrophobicContact CD1-CB 3.67Å; L391-F432 HydrophobicContact CD1-CD2 3.86Å; L391-F432 HydrophobicContact CD1-CG 3.86Å; G428-F432 WeakPolarHBondContact O-CB 3.4Å; G428-F432 PolarHBondContact O-N 3.44Å; F429-F432 PolarHBondContact O-N 2.96Å; F432-F434 PolarHBondContact O-N 2.85Å; F432-V435 PolarHBondContact O-N 3.47Å; F432-F436 VanDerWaalsContact O-CB 3.28Å; F432-F436 WeakPolarHBondContact O-CB 3.5Å; F432-F436 PolarHBondContact O-N 2.97Å
433	G	97.1	Very high	92.6	Very high	29 Å²	29	41.3 Å²	41.3	30%	0.299	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-45.4	177.3	0	0	0	0	0	112.9	F429 L430 A431 F436 I437	F429-G433 PolarHBondContact O-N 3.25Å; L430-G433 PolarHBondContact O-N 2.88Å; A431-G433 VanDerWaalsContact C-N 3.31Å; A431-G433 PolarHBondContact O-N 3.01Å; G433-F436 PolarHBondContact O-N 2.61Å; G433-I437 WeakPolarHBondContact O-CG1 3.41Å; G433-I437 PolarHBondContact O-N 3.19Å
434	F	97.1	Very high	93.2	Very high	28 Å²	28	42.6 Å²	42.6	12%	0.123	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-45.7	175.8	-70.8	-60	0	0	0	112.9	L430 A431 F432 F436 I437 T438 F495 S496 T500 A503	L430-F434 HydrophobicContact CD1-CD2 4.24Å; L430-F434 HydrophobicContact CD1-CE2 3.64Å; L430-F434 HydrophobicContact CD1-CZ 4.23Å; L430-F434 HydrophobicContact CG-CD2 4.28Å; L430-F434 HydrophobicContact CG-CE2 3.84Å; L430-F434 WeakPolarHBondContact O-CD2 3.26Å; L430-F434 PolarHBondContact O-N 3.47Å; A431-F434 PolarHBondContact O-N 3.29Å; F432-F434 PolarHBondContact O-N 2.85Å; F434-F436 PolarHBondContact O-N 3.28Å; F434-I437 PolarHBondContact O-N 3.04Å; F434-T438 PolarHBondContact O-N 3.46Å; F434-F495 HydrophobicContact CE1-CE1 4.05Å; F434-S496 VanDerWaalsContact C-OG 3.22Å; F434-S496 WeakPolarHBondContact CA-OG 3.24Å; F434-S496 WeakPolarHBondContact CB-OG 3.42Å; F434-S496 WeakPolarHBondContact CD1-OG 3.41Å; F434-S496 PolarHBondContact O-OG 3.16Å; F434-T500 WeakPolarHBondContact CB-OG1 3.23Å; F434-A503 HydrophobicContact CE2-CB 3.93Å
435	V	95.8	Very high	93.7	Very high	10 Å²	10	42.9 Å²	42.9	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-33.2	177.3	179	0	0	0	0	111	V301 I380 V383 L384 A431 F432 F439	V301-V435 HydrophobicContact CG1-CG2 4.45Å; I380-V435 HydrophobicContact CG2-CG1 3.8Å; V383-V435 HydrophobicContact CG1-CG1 4.42Å; L384-V435 HydrophobicContact CD1-CG1 4.4Å; L384-V435 HydrophobicContact CD2-CB 4.06Å; L384-V435 HydrophobicContact CD2-CG1 3.78Å; L384-V435 HydrophobicContact CG-CG1 3.92Å; A431-V435 WeakPolarHBondContact O-CG2 3.41Å; A431-V435 PolarHBondContact O-N 2.9Å; F432-V435 PolarHBondContact O-N 3.47Å; V435-F439 PolarHBondContact O-N 2.7Å
436	F	97.5	Very high	94.1	Very high	121 Å²	121	46 Å²	46	53%	0.531	23%	0.231	S	C	.	.	H	α-helix	trans	-68.5	-40.1	173.4	-176.7	-94.6	0	0	0	113.1	L384 F432 G433 F434 F439 G440	L384-F436 HydrophobicContact CD1-CD2 4.36Å; L384-F436 HydrophobicContact CD2-CB 4.1Å; F432-F436 VanDerWaalsContact O-CB 3.28Å; F432-F436 WeakPolarHBondContact O-CB 3.5Å; F432-F436 PolarHBondContact O-N 2.97Å; G433-F436 PolarHBondContact O-N 2.61Å; F434-F436 PolarHBondContact O-N 3.28Å; F436-F439 PolarHBondContact O-N 2.69Å; F436-G440 PolarHBondContact O-N 2.94Å
437	I	97.6	Very high	94.3	Very high	68 Å²	68	47.7 Å²	47.7	35%	0.349	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-45.6	173.5	-69.2	162.5	0	0	0	110.7	G433 F434 F439 G440 C441 I492	G433-I437 WeakPolarHBondContact O-CG1 3.41Å; G433-I437 PolarHBondContact O-N 3.19Å; F434-I437 PolarHBondContact O-N 3.04Å; I437-F439 VanDerWaalsContact C-N 3.34Å; I437-F439 PolarHBondContact O-N 2.92Å; I437-G440 WeakPolarHBondContact O-CA 3.48Å; I437-G440 PolarHBondContact O-N 3.31Å; I437-C441 PolarHBondContact O-N 3.42Å; I437-I492 HydrophobicContact CG2-CG2 3.61Å
438	T	95.5	Very high	94.6	Very high	8 Å²	8	49.5 Å²	49.5	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-40	176.3	-72.7	0	0	0	0	112.1	I380 F434 G440 C441 H442 N493 S496	I380-T438 HydrophobicContact CD1-CG2 4.09Å; F434-T438 PolarHBondContact O-N 3.46Å; T438-G440 VanDerWaalsContact C-N 3.34Å; T438-C441 PolarHBondContact O-N 3.4Å; T438-H442 PolarHBondContact O-CD2 3.31Å; T438-H442 PolarHBondContact O-N 3.17Å; T438-N493 WeakPolarHBondContact CG2-OD1 3.43Å; T438-N493 PolarHBondContact OG1-OD1 2.96Å; T438-S496 WeakPolarHBondContact OG1-CB 3.33Å; T438-S496 PolarHBondContact OG1-OG 2.72Å
439	F	96.7	Very high	94.6	Very high	50 Å²	50	50.7 Å²	50.7	22%	0.219	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-43.5	170.6	-179.3	-90.6	0	0	0	111.8	L377 I380 L384 V435 F436 I437 C441 H442 F443	L377-F439 HydrophobicContact CD1-CD2 3.53Å; L377-F439 HydrophobicContact CD1-CE2 3.46Å; L377-F439 VanDerWaalsContact CD1-CE2 3.46Å; L377-F439 HydrophobicContact CD1-CG 4.13Å; L377-F439 HydrophobicContact CD1-CZ 4Å; L377-F439 HydrophobicContact CG-CD2 4.38Å; L377-F439 HydrophobicContact CG-CE2 3.92Å; L377-F439 HydrophobicContact CG-CZ 4.47Å; L377-F439 WeakPolarHBondContact O-CE2 3.3Å; I380-F439 HydrophobicContact CB-CD2 4.48Å; I380-F439 HydrophobicContact CG2-CB 3.9Å; I380-F439 HydrophobicContact CG2-CD2 4.1Å; L384-F439 HydrophobicContact CD1-CB 3.52Å; L384-F439 HydrophobicContact CD1-CD1 4.42Å; L384-F439 HydrophobicContact CD1-CD2 4.11Å; L384-F439 HydrophobicContact CD1-CG 3.77Å; V435-F439 PolarHBondContact O-N 2.7Å; F436-F439 PolarHBondContact O-N 2.69Å; I437-F439 VanDerWaalsContact C-N 3.34Å; I437-F439 PolarHBondContact O-N 2.92Å; F439-C441 PolarHBondContact O-N 2.99Å; F439-H442 PolarHBondContact O-N 2.98Å; F439-F443 HydrophobicContact CE1-CD2 4.24Å; F439-F443 HydrophobicContact CZ-CD2 4.37Å; F439-F443 VanDerWaalsContact O-CB 3.23Å; F439-F443 WeakPolarHBondContact O-CB 3.37Å; F439-F443 PolarHBondContact O-N 3.03Å
440	G	96.8	Very high	94.4	Very high	35 Å²	35	48.7 Å²	48.7	36%	0.361	25%	0.25	S	S	.	.	H	α-helix	trans	-59.3	-43.2	175.9	0	0	0	0	0	113.6	F436 I437 T438 F443 Y444	F436-G440 PolarHBondContact O-N 2.94Å; I437-G440 WeakPolarHBondContact O-CA 3.48Å; I437-G440 PolarHBondContact O-N 3.31Å; T438-G440 VanDerWaalsContact C-N 3.34Å; G440-F443 PolarHBondContact O-N 3.44Å; G440-Y444 PolarHBondContact O-N 3.02Å
441	C	96	Very high	94.3	Very high	8 Å²	8	49 Å²	49	5%	0.054	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-50.4	175.1	-67	0	0	0	0	111.9	I437 T438 F439 F443 Y444 D445 V489 N493	I437-C441 PolarHBondContact O-N 3.42Å; T438-C441 PolarHBondContact O-N 3.4Å; F439-C441 PolarHBondContact O-N 2.99Å; C441-F443 VanDerWaalsContact C-N 3.26Å; C441-F443 PolarHBondContact O-N 3.19Å; C441-Y444 WeakPolarHBondContact O-CB 3.27Å; C441-Y444 PolarHBondContact O-N 3.34Å; C441-Y444 VanDerWaalsContact O-N 3.15Å; C441-D445 PolarHBondContact O-N 3.03Å; C441-V489 HydrophobicContact CB-CG1 3.89Å; C441-V489 PolarHBondContact SG-O 3.12Å; C441-V489 VanDerWaalsContact SG-O 3.35Å; C441-N493 HydrophobicContact CB-CB 3.74Å
442	H	94	Very high	94.1	Very high	9 Å²	9	49.7 Å²	49.7	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-65.1	-28.8	178.2	-69.8	-44.5	0	0	0	113.3	R372 L377 T438 F439 F446 N493	R372-H442 PolarHBondContact NH2-ND1 3.39Å; L377-H442 HydrophobicContact CD1-CB 3.84Å; T438-H442 PolarHBondContact O-CD2 3.31Å; T438-H442 PolarHBondContact O-N 3.17Å; F439-H442 PolarHBondContact O-N 2.98Å; H442-F446 WeakPolarHBondContact O-CB 3.44Å; H442-F446 PolarHBondContact O-N 2.96Å; H442-F446 VanDerWaalsContact O-N 3.11Å; H442-N493 PolarHBondContact CE1-ND2 2.93Å; H442-N493 VanDerWaalsContact CE1-ND2 3.32Å
443	F	95.6	Very high	93.7	Very high	96 Å²	96	50.4 Å²	50.4	42%	0.421	26%	0.256	S	S	.	.	H	α-helix	trans	-70.4	-41.8	172.5	-173.4	-86.6	0	0	0	111.5	L377 F439 G440 C441 F446 F447	L377-F443 HydrophobicContact CD1-CB 4.13Å; L377-F443 HydrophobicContact CD2-CD2 4.4Å; F439-F443 HydrophobicContact CE1-CD2 4.24Å; F439-F443 HydrophobicContact CZ-CD2 4.37Å; F439-F443 VanDerWaalsContact O-CB 3.23Å; F439-F443 WeakPolarHBondContact O-CB 3.37Å; F439-F443 PolarHBondContact O-N 3.03Å; G440-F443 PolarHBondContact O-N 3.44Å; C441-F443 VanDerWaalsContact C-N 3.26Å; C441-F443 PolarHBondContact O-N 3.19Å; F443-F446 PolarHBondContact O-N 3.45Å; F443-F447 AromaticContact CD1-CD2 3.96Å; F443-F447 HydrophobicContact CD1-CD2 3.96Å; F443-F447 HydrophobicContact CD1-CE2 4.2Å; F443-F447 HydrophobicContact CD2-CE2 4.21Å; F443-F447 AromaticContact CE1-CD2 3.66Å; F443-F447 HydrophobicContact CE1-CD2 3.66Å; F443-F447 AromaticContact CE1-CE2 3.57Å; F443-F447 HydrophobicContact CE1-CE2 3.57Å; F443-F447 HydrophobicContact CE1-CZ 4.33Å; F443-F447 HydrophobicContact CE2-CD2 4.26Å; F443-F447 AromaticContact CE2-CE2 3.59Å; F443-F447 HydrophobicContact CE2-CE2 3.59Å; F443-F447 HydrophobicContact CE2-CZ 4.45Å; F443-F447 HydrophobicContact CG-CD2 4.38Å; F443-F447 HydrophobicContact CG-CE2 4.5Å; F443-F447 AromaticContact CZ-CD2 3.84Å; F443-F447 HydrophobicContact CZ-CD2 3.84Å; F443-F447 AromaticContact CZ-CE2 3.23Å; F443-F447 HydrophobicContact CZ-CE2 3.23Å; F443-F447 AromaticContact CZ-CZ 3.87Å; F443-F447 HydrophobicContact CZ-CZ 3.87Å; F443-F447 WeakPolarHBondContact O-CD2 3.32Å; F443-F447 PolarHBondContact O-N 3.01Å
444	Y	94.8	Very high	93.2	Very high	83 Å²	83	54.7 Å²	54.7	33%	0.325	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-48.3	173.3	172.6	-91.9	0	0	0	111.5	G440 C441 F446 F447 N448 W452 V489	G440-Y444 PolarHBondContact O-N 3.02Å; C441-Y444 WeakPolarHBondContact O-CB 3.27Å; C441-Y444 PolarHBondContact O-N 3.34Å; C441-Y444 VanDerWaalsContact O-N 3.15Å; Y444-F446 PolarHBondContact O-N 3.06Å; Y444-F447 PolarHBondContact O-N 3.09Å; Y444-N448 WeakPolarHBondContact CE2-ND2 3.26Å; Y444-N448 PolarHBondContact O-N 2.63Å; Y444-N448 PolarHBondContact O-ND2 3.23Å; Y444-W452 HydrophobicContact CD1-CH2 4.09Å; Y444-W452 HydrophobicContact CD1-CZ2 4.48Å; Y444-W452 AromaticContact CE1-CH2 3.64Å; Y444-W452 HydrophobicContact CE1-CH2 3.64Å; Y444-W452 AromaticContact CE1-CZ2 3.65Å; Y444-W452 HydrophobicContact CE1-CZ2 3.65Å; Y444-V489 HydrophobicContact CD1-CB 4.17Å; Y444-V489 HydrophobicContact CD1-CG1 3.74Å; Y444-V489 HydrophobicContact CD1-CG2 3.99Å; Y444-V489 HydrophobicContact CE1-CB 4.26Å; Y444-V489 HydrophobicContact CE1-CG1 4.33Å; Y444-V489 HydrophobicContact CE1-CG2 3.84Å; Y444-V489 HydrophobicContact CG-CG1 4.28Å
445	D	90.9	Very high	92.8	Very high	16 Å²	16	53.5 Å²	53.5	9%	0.086	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-48.2	177.1	-68.8	-5.7	0	0	0	111.4	R372 C441 F447 N448 Q449 W452	R372-D445 IonicContact CZ-OD2 3.75Å; R372-D445 VanDerWaalsContact CZ-OD2 3.24Å; R372-D445 IonicContact NH1-OD2 3.64Å; R372-D445 PolarHBondContact NH1-OD2 3.07Å; R372-D445 IonicContact NH2-OD2 2.66Å; R372-D445 PolarHBondContact NH2-OD2 2.95Å; C441-D445 PolarHBondContact O-N 3.03Å; D445-F447 VanDerWaalsContact C-N 3.3Å; D445-F447 PolarHBondContact O-N 3.3Å; D445-N448 PolarHBondContact O-N 2.66Å; D445-Q449 PolarHBondContact O-N 3.02Å; D445-W452 HydrophobicContact CB-CZ3 4.49Å
446	F	92.8	Very high	92.4	Very high	70 Å²	70	54.2 Å²	54.2	31%	0.307	26%	0.261	S	S	.	.	H	α-helix	trans	-57.3	-39.5	-179.4	176.1	-102.1	0	0	0	113.2	Y369 A373 L377 H442 F443 Y444	Y369-F446 AromaticContact CD2-CD2 3.61Å; Y369-F446 HydrophobicContact CD2-CD2 3.61Å; Y369-F446 AromaticContact CD2-CE2 3.73Å; Y369-F446 HydrophobicContact CD2-CE2 3.73Å; Y369-F446 HydrophobicContact CE2-CD2 4.08Å; Y369-F446 AromaticContact CE2-CE2 3.78Å; Y369-F446 HydrophobicContact CE2-CE2 3.78Å; Y369-F446 HydrophobicContact CE2-CZ 4.46Å; A373-F446 HydrophobicContact CB-CD2 3.52Å; A373-F446 HydrophobicContact CB-CE2 3.59Å; A373-F446 HydrophobicContact CB-CG 4.42Å; L377-F446 HydrophobicContact CD2-CB 4.27Å; L377-F446 HydrophobicContact CD2-CG 4.38Å; H442-F446 WeakPolarHBondContact O-CB 3.44Å; H442-F446 PolarHBondContact O-N 2.96Å; H442-F446 VanDerWaalsContact O-N 3.11Å; F443-F446 PolarHBondContact O-N 3.45Å; Y444-F446 PolarHBondContact O-N 3.06Å
447	F	92.6	Very high	91.7	Very high	133 Å²	133	52.6 Å²	52.6	58%	0.583	25%	0.251	S	S	*	.	H	α-helix	trans	-76.9	-27	-179.6	-91.6	-96.6	0	0	0	114	F443 Y444 D445	F443-F447 AromaticContact CD1-CD2 3.96Å; F443-F447 HydrophobicContact CD1-CD2 3.96Å; F443-F447 HydrophobicContact CD1-CE2 4.2Å; F443-F447 HydrophobicContact CD2-CE2 4.21Å; F443-F447 AromaticContact CE1-CD2 3.66Å; F443-F447 HydrophobicContact CE1-CD2 3.66Å; F443-F447 AromaticContact CE1-CE2 3.57Å; F443-F447 HydrophobicContact CE1-CE2 3.57Å; F443-F447 HydrophobicContact CE1-CZ 4.33Å; F443-F447 HydrophobicContact CE2-CD2 4.26Å; F443-F447 AromaticContact CE2-CE2 3.59Å; F443-F447 HydrophobicContact CE2-CE2 3.59Å; F443-F447 HydrophobicContact CE2-CZ 4.45Å; F443-F447 HydrophobicContact CG-CD2 4.38Å; F443-F447 HydrophobicContact CG-CE2 4.5Å; F443-F447 AromaticContact CZ-CD2 3.84Å; F443-F447 HydrophobicContact CZ-CD2 3.84Å; F443-F447 AromaticContact CZ-CE2 3.23Å; F443-F447 HydrophobicContact CZ-CE2 3.23Å; F443-F447 AromaticContact CZ-CZ 3.87Å; F443-F447 HydrophobicContact CZ-CZ 3.87Å; F443-F447 WeakPolarHBondContact O-CD2 3.32Å; F443-F447 PolarHBondContact O-N 3.01Å; Y444-F447 PolarHBondContact O-N 3.09Å; D445-F447 VanDerWaalsContact C-N 3.3Å; D445-F447 PolarHBondContact O-N 3.3Å
448	N	92.4	Very high	91.1	Very high	53 Å²	53	52.8 Å²	52.8	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-103.5	-19.1	-172.2	-67.7	-87.5	0	0	0	114.2	Y444 D445 A450 E451 W452	Y444-N448 WeakPolarHBondContact CE2-ND2 3.26Å; Y444-N448 PolarHBondContact O-N 2.63Å; Y444-N448 PolarHBondContact O-ND2 3.23Å; D445-N448 PolarHBondContact O-N 2.66Å; N448-A450 VanDerWaalsContact C-N 3.31Å; N448-A450 PolarHBondContact O-N 3.13Å; N448-A450 VanDerWaalsContact O-N 3.17Å; N448-E451 WeakPolarHBondContact O-CB 3.35Å; N448-E451 PolarHBondContact O-N 2.95Å; N448-W452 HydrophobicContact CB-CD2 4.14Å; N448-W452 HydrophobicContact CB-CE3 4.44Å; N448-W452 HydrophobicContact CB-CH2 3.68Å; N448-W452 HydrophobicContact CB-CZ2 3.3Å; N448-W452 HydrophobicContact CB-CZ3 4.23Å; N448-W452 PolarHBondContact O-N 3.39Å
449	Q	88.2	Confident	90.5	Very high	27 Å²	27	54.8 Å²	54.8	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-47.8	-47.5	-177.8	-176.8	88.2	0.9	0	0	113.7	Y366 Y369 D445 E451 W452 E453	Y366-Q449 PolarHBondContact O-NE2 3.48Å; Y366-Q449 VanDerWaalsContact O-NE2 3.11Å; Y369-Q449 HydrophobicContact CD1-CB 4.44Å; Y369-Q449 HydrophobicContact CD1-CG 3.93Å; Y369-Q449 HydrophobicContact CD2-CB 4.4Å; Y369-Q449 HydrophobicContact CG-CB 4.09Å; Y369-Q449 HydrophobicContact CG-CG 3.9Å; D445-Q449 PolarHBondContact O-N 3.02Å; Q449-E451 PolarHBondContact O-N 3.47Å; Q449-W452 HydrophobicContact CB-CE3 4.47Å; Q449-W452 PolarHBondContact O-N 3.02Å; Q449-W452 VanDerWaalsContact O-N 3.1Å; Q449-E453 HydrophobicContact CG-CG 4.32Å; Q449-E453 WeakPolarHBondContact CG-OE1 3.4Å; Q449-E453 PolarHBondContact NE2-OE1 2.84Å; Q449-E453 PolarHBondContact O-N 2.91Å
450	A	88.6	Confident	89.8	Confident	47 Å²	47	53.3 Å²	53.3	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-24.5	-176.4	0	0	0	0	0	113.3	N448 R454	N448-A450 VanDerWaalsContact C-N 3.31Å; N448-A450 PolarHBondContact O-N 3.13Å; N448-A450 VanDerWaalsContact O-N 3.17Å; A450-R454 PolarHBondContact O-N 3.28Å
451	E	90.4	Very high	88.9	Confident	80 Å²	80	54.5 Å²	54.5	37%	0.374	25%	0.25	S	S	.	.	H	α-helix	trans	-82.3	-37.3	175.1	-159.1	59.1	-128.1	0	0	111.7	N448 Q449 R454 S455	N448-E451 WeakPolarHBondContact O-CB 3.35Å; N448-E451 PolarHBondContact O-N 2.95Å; Q449-E451 PolarHBondContact O-N 3.47Å; E451-R454 PolarHBondContact O-N 3.5Å; E451-R454 IonicContact OE1-CZ 3.4Å; E451-R454 IonicContact OE1-NH1 2.87Å; E451-R454 PolarHBondContact OE1-NH1 3.42Å; E451-R454 IonicContact OE2-CZ 2.63Å; E451-R454 IonicContact OE2-NH1 2.75Å; E451-R454 PolarHBondContact OE2-NH1 3.39Å; E451-S455 WeakPolarHBondContact O-CB 3.31Å; E451-S455 PolarHBondContact O-N 2.99Å; E451-S455 PolarHBondContact O-OG 2.89Å
452	W	90.5	Very high	88.1	Confident	16 Å²	16	55.7 Å²	55.7	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-43.4	174.2	-58	-30.1	0	0	0	111.8	Y444 D445 N448 Q449 R454 S455 F456 R484 P485	Y444-W452 HydrophobicContact CD1-CH2 4.09Å; Y444-W452 HydrophobicContact CD1-CZ2 4.48Å; Y444-W452 AromaticContact CE1-CH2 3.64Å; Y444-W452 HydrophobicContact CE1-CH2 3.64Å; Y444-W452 AromaticContact CE1-CZ2 3.65Å; Y444-W452 HydrophobicContact CE1-CZ2 3.65Å; D445-W452 HydrophobicContact CB-CZ3 4.49Å; N448-W452 HydrophobicContact CB-CD2 4.14Å; N448-W452 HydrophobicContact CB-CE3 4.44Å; N448-W452 HydrophobicContact CB-CH2 3.68Å; N448-W452 HydrophobicContact CB-CZ2 3.3Å; N448-W452 HydrophobicContact CB-CZ3 4.23Å; N448-W452 PolarHBondContact O-N 3.39Å; Q449-W452 HydrophobicContact CB-CE3 4.47Å; Q449-W452 PolarHBondContact O-N 3.02Å; Q449-W452 VanDerWaalsContact O-N 3.1Å; W452-R454 VanDerWaalsContact C-N 3.34Å; W452-R454 PolarHBondContact O-N 2.77Å; W452-S455 PolarHBondContact O-N 3.41Å; W452-F456 WeakPolarHBondContact O-CB 3.39Å; W452-F456 PolarHBondContact O-N 3.45Å; W452-R484 PolarHBondContact NE1-O 2.87Å; W452-P485 HydrophobicContact CD2-CB 4.14Å; W452-P485 HydrophobicContact CD2-CG 3.82Å; W452-P485 HydrophobicContact CE3-CB 3.89Å; W452-P485 HydrophobicContact CE3-CG 3.64Å; W452-P485 HydrophobicContact CG-CG 4.22Å; W452-P485 HydrophobicContact CH2-CB 4.09Å; W452-P485 HydrophobicContact CZ2-CB 4.31Å; W452-P485 HydrophobicContact CZ3-CB 3.87Å; W452-P485 HydrophobicContact CZ3-CG 4.13Å
453	E	86.2	Confident	87.2	Confident	71 Å²	71	57.9 Å²	57.9	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-35.8	176.7	-72.2	-166.5	-140.2	0	0	112.6	K367 Q449 R457	K367-E453 IonicContact NZ-OE1 3.67Å; K367-E453 PolarHBondContact NZ-OE1 2.88Å; K367-E453 IonicContact NZ-OE2 2.66Å; K367-E453 PolarHBondContact NZ-OE2 2.69Å; Q449-E453 HydrophobicContact CG-CG 4.32Å; Q449-E453 WeakPolarHBondContact CG-OE1 3.4Å; Q449-E453 PolarHBondContact NE2-OE1 2.84Å; Q449-E453 PolarHBondContact O-N 2.91Å; E453-R457 PolarHBondContact O-N 3.31Å; E453-R457 VanDerWaalsContact O-N 3.14Å
454	R	87.6	Confident	86	Confident	119 Å²	119	55 Å²	55	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-66	-48.8	171.6	-170	-176	-55.5	110	7.3	111.1	A450 E451 W452 F456 R457 E458	A450-R454 PolarHBondContact O-N 3.28Å; E451-R454 PolarHBondContact O-N 3.5Å; E451-R454 IonicContact OE1-CZ 3.4Å; E451-R454 IonicContact OE1-NH1 2.87Å; E451-R454 PolarHBondContact OE1-NH1 3.42Å; E451-R454 IonicContact OE2-CZ 2.63Å; E451-R454 IonicContact OE2-NH1 2.75Å; E451-R454 PolarHBondContact OE2-NH1 3.39Å; W452-R454 VanDerWaalsContact C-N 3.34Å; W452-R454 PolarHBondContact O-N 2.77Å; R454-F456 VanDerWaalsContact C-N 3.31Å; R454-F456 PolarHBondContact O-N 3.24Å; R454-R457 PolarHBondContact O-N 2.94Å; R454-E458 WeakPolarHBondContact O-CG 3.38Å; R454-E458 PolarHBondContact O-N 3.49Å
455	S	88.9	Confident	84.9	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.028	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-40.5	-179.7	-60.7	0	0	0	0	112.1	E451 W452 E458 Y459 N483	E451-S455 WeakPolarHBondContact O-CB 3.31Å; E451-S455 PolarHBondContact O-N 2.99Å; E451-S455 PolarHBondContact O-OG 2.89Å; W452-S455 PolarHBondContact O-N 3.41Å; S455-E458 PolarHBondContact O-N 3.1Å; S455-Y459 WeakPolarHBondContact O-CB 3.42Å; S455-Y459 PolarHBondContact O-N 2.91Å; S455-N483 VanDerWaalsContact CB-O 3.25Å; S455-N483 WeakPolarHBondContact CB-O 3.42Å
456	F	85.9	Confident	83.8	Confident	24 Å²	24	55 Å²	55	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-66.7	-43.7	175.4	-179.6	-117.4	0	0	0	112.5	P168 Y179 I187 P192 L193 W452 R454 E458 Y459 V460	P168-F456 HydrophobicContact CG-CE2 4.46Å; P168-F456 HydrophobicContact CG-CZ 4.37Å; Y179-F456 HydrophobicContact CE2-CE1 4.25Å; I187-F456 HydrophobicContact CD1-CE1 3.87Å; I187-F456 HydrophobicContact CD1-CZ 3.7Å; P192-F456 HydrophobicContact CG-CE2 3.7Å; P192-F456 HydrophobicContact CG-CZ 3.85Å; L193-F456 HydrophobicContact CD2-CB 4.23Å; L193-F456 HydrophobicContact CD2-CD2 3.64Å; L193-F456 HydrophobicContact CD2-CE2 4.43Å; L193-F456 HydrophobicContact CD2-CG 4.23Å; L193-F456 HydrophobicContact CG-CD2 4.31Å; W452-F456 WeakPolarHBondContact O-CB 3.39Å; W452-F456 PolarHBondContact O-N 3.45Å; R454-F456 VanDerWaalsContact C-N 3.31Å; R454-F456 PolarHBondContact O-N 3.24Å; F456-E458 VanDerWaalsContact C-N 3.33Å; F456-E458 PolarHBondContact O-N 3.33Å; F456-Y459 PolarHBondContact O-N 2.89Å; F456-V460 HydrophobicContact CD2-CG2 4.23Å; F456-V460 HydrophobicContact CE1-CG2 4.1Å; F456-V460 HydrophobicContact CE2-CG2 3.71Å; F456-V460 HydrophobicContact CZ-CG2 3.63Å; F456-V460 WeakPolarHBondContact O-CG2 3.48Å; F456-V460 PolarHBondContact O-N 3.38Å
457	R	84.4	Confident	82.4	Confident	87 Å²	87	52.8 Å²	52.8	33%	0.328	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-39.4	175.8	179.1	174.2	168	-82.5	-3.7	111.9	E134 E453 R454 L461	E134-R457 IonicContact OE1-CZ 2.61Å; E134-R457 IonicContact OE1-NH2 2.63Å; E134-R457 PolarHBondContact OE1-NH2 3.47Å; E134-R457 IonicContact OE2-CZ 2.98Å; E134-R457 IonicContact OE2-NH2 2.71Å; E134-R457 PolarHBondContact OE2-NH2 3.4Å; E453-R457 PolarHBondContact O-N 3.31Å; E453-R457 VanDerWaalsContact O-N 3.14Å; R454-R457 PolarHBondContact O-N 2.94Å; R457-L461 HydrophobicContact CG-CD1 4.07Å; R457-L461 WeakPolarHBondContact O-CB 3.28Å; R457-L461 VanDerWaalsContact O-CG 3.29Å; R457-L461 WeakPolarHBondContact O-CG 3.39Å; R457-L461 PolarHBondContact O-N 3.43Å; R457-L461 VanDerWaalsContact O-N 3.15Å
458	E	84.7	Confident	81.1	Confident	73 Å²	73	47.5 Å²	47.5	34%	0.341	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-40.3	174.5	-73.3	178.9	-159	0	0	112	R454 S455 F456 L461 C462 K482	R454-E458 WeakPolarHBondContact O-CG 3.38Å; R454-E458 PolarHBondContact O-N 3.49Å; S455-E458 PolarHBondContact O-N 3.1Å; F456-E458 VanDerWaalsContact C-N 3.33Å; F456-E458 PolarHBondContact O-N 3.33Å; E458-L461 PolarHBondContact O-N 2.91Å; E458-C462 WeakPolarHBondContact O-CB 3.42Å; E458-C462 PolarHBondContact O-N 2.65Å; E458-K482 IonicContact OE2-NZ 3.86Å; E458-K482 PolarHBondContact OE2-NZ 3.3Å
459	Y	83.6	Confident	79.6	Confident	50 Å²	50	45.4 Å²	45.4	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-61.9	-50	175.8	176.2	-112.7	0	0	0	112.5	S455 F456 L461 C462 E463 C479 I481	S455-Y459 WeakPolarHBondContact O-CB 3.42Å; S455-Y459 PolarHBondContact O-N 2.91Å; F456-Y459 PolarHBondContact O-N 2.89Å; Y459-L461 VanDerWaalsContact C-N 3.3Å; Y459-L461 PolarHBondContact O-N 3.49Å; Y459-C462 WeakPolarHBondContact O-CA 3.45Å; Y459-C462 VanDerWaalsContact O-CB 3.31Å; Y459-C462 WeakPolarHBondContact O-CB 3.27Å; Y459-C462 PolarHBondContact O-N 2.99Å; Y459-E463 HydrophobicContact CD2-CG 4.36Å; Y459-E463 HydrophobicContact CE1-CG 4.14Å; Y459-E463 HydrophobicContact CE2-CG 3.71Å; Y459-E463 WeakPolarHBondContact CE2-OE1 3.39Å; Y459-E463 PolarHBondContact O-N 3.41Å; Y459-E463 PolarHBondContact OH-OE1 3.28Å; Y459-C479 HydrophobicContact CD2-CB 4.11Å; Y459-C479 HydrophobicContact CE2-CB 3.89Å; Y459-I481 HydrophobicContact CD1-CD1 4.1Å; Y459-I481 HydrophobicContact CD1-CG1 3.91Å; Y459-I481 HydrophobicContact CD2-CG1 3.79Å; Y459-I481 HydrophobicContact CE1-CD1 4.25Å; Y459-I481 HydrophobicContact CE1-CG1 4.37Å; Y459-I481 HydrophobicContact CE2-CG1 4.28Å; Y459-I481 HydrophobicContact CG-CD1 4.32Å; Y459-I481 HydrophobicContact CG-CG1 3.62Å
460	V	80.1	Confident	78.2	Confident	19 Å²	19	47.3 Å²	47.3	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-36.8	178.4	174.7	0	0	0	0	112.2	P168 F456 C462 A464	P168-V460 HydrophobicContact CG-CG2 4.07Å; F456-V460 HydrophobicContact CD2-CG2 4.23Å; F456-V460 HydrophobicContact CE1-CG2 4.1Å; F456-V460 HydrophobicContact CE2-CG2 3.71Å; F456-V460 HydrophobicContact CZ-CG2 3.63Å; F456-V460 WeakPolarHBondContact O-CG2 3.48Å; F456-V460 PolarHBondContact O-N 3.38Å; V460-C462 VanDerWaalsContact C-N 3.34Å; V460-A464 WeakPolarHBondContact O-CB 3.36Å; V460-A464 PolarHBondContact O-N 3.39Å; V460-A464 VanDerWaalsContact O-N 3.16Å
461	L	78.2	Confident	77	Confident	59 Å²	59	48.8 Å²	48.8	31%	0.309	24%	0.244	S	C	.	.	H	α-helix	trans	-70.5	-29.3	174.3	-70.8	170.6	0	0	0	112.8	E134 R457 E458 Y459 N465	E134-L461 HydrophobicContact CG-CD2 4.26Å; R457-L461 HydrophobicContact CG-CD1 4.07Å; R457-L461 WeakPolarHBondContact O-CB 3.28Å; R457-L461 VanDerWaalsContact O-CG 3.29Å; R457-L461 WeakPolarHBondContact O-CG 3.39Å; R457-L461 PolarHBondContact O-N 3.43Å; R457-L461 VanDerWaalsContact O-N 3.15Å; E458-L461 PolarHBondContact O-N 2.91Å; Y459-L461 VanDerWaalsContact C-N 3.3Å; Y459-L461 PolarHBondContact O-N 3.49Å; L461-N465 PolarHBondContact O-N 3.4Å
462	C	79.4	Confident	75.6	Confident	34 Å²	34	46.4 Å²	46.4	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-69.4	-50.4	174.7	-171.3	0	0	0	0	111.3	E458 Y459 V460 A464 N465 V466 C479	E458-C462 WeakPolarHBondContact O-CB 3.42Å; E458-C462 PolarHBondContact O-N 2.65Å; Y459-C462 WeakPolarHBondContact O-CA 3.45Å; Y459-C462 VanDerWaalsContact O-CB 3.31Å; Y459-C462 WeakPolarHBondContact O-CB 3.27Å; Y459-C462 PolarHBondContact O-N 2.99Å; V460-C462 VanDerWaalsContact C-N 3.34Å; C462-A464 VanDerWaalsContact C-N 3.32Å; C462-A464 PolarHBondContact O-N 3.2Å; C462-N465 CarbonylContact O-C 3.52Å; C462-N465 WeakPolarHBondContact O-CA 3.22Å; C462-N465 WeakPolarHBondContact O-CB 3.43Å; C462-N465 PolarHBondContact O-N 2.99Å; C462-V466 PolarHBondContact O-N 3.05Å; C462-C479 HydrophobicContact CB-CB 3.77Å; C462-C479 WeakPolarHBondContact CB-SG 3.48Å; C462-C479 PolarHBondContact O-SG 2.97Å; C462-C479 WeakPolarHBondContact SG-CA 3.46Å; C462-C479 WeakPolarHBondContact SG-CB 3.47Å; C462-C479 CovalentContact SG-SG 2.04Å; C462-C479 PolarHBondContact SG-SG 3.33Å
463	E	75.1	Confident	74.2	Confident	55 Å²	55	53.2 Å²	53.2	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-58.9	-42.4	177.4	-68.2	-64.1	171.1	0	0	111.8	Y459 N465 V466 T467 C479	Y459-E463 HydrophobicContact CD2-CG 4.36Å; Y459-E463 HydrophobicContact CE1-CG 4.14Å; Y459-E463 HydrophobicContact CE2-CG 3.71Å; Y459-E463 WeakPolarHBondContact CE2-OE1 3.39Å; Y459-E463 PolarHBondContact O-N 3.41Å; Y459-E463 PolarHBondContact OH-OE1 3.28Å; E463-N465 PolarHBondContact O-N 3.16Å; E463-V466 WeakPolarHBondContact O-CB 3.35Å; E463-V466 PolarHBondContact O-N 3.29Å; E463-T467 PolarHBondContact O-N 2.91Å; E463-C479 HydrophobicContact CG-CB 4.42Å
464	A	70.9	Confident	73.1	Confident	36 Å²	36	54.4 Å²	54.4	30%	0.298	28%	0.277	S	S	.	.	H	α-helix	trans	-56.8	-35.3	172.6	0	0	0	0	0	112.4	V460 C462 T467	V460-A464 WeakPolarHBondContact O-CB 3.36Å; V460-A464 PolarHBondContact O-N 3.39Å; V460-A464 VanDerWaalsContact O-N 3.16Å; C462-A464 VanDerWaalsContact C-N 3.32Å; C462-A464 PolarHBondContact O-N 3.2Å; A464-T467 PolarHBondContact O-OG1 2.81Å
465	N	70.5	Confident	72.1	Confident	69 Å²	69	54.6 Å²	54.6	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-77.8	-27.8	176.5	-165.4	58.4	0	0	0	113.4	L461 C462 E463 T467 I468 A469	L461-N465 PolarHBondContact O-N 3.4Å; C462-N465 CarbonylContact O-C 3.52Å; C462-N465 WeakPolarHBondContact O-CA 3.22Å; C462-N465 WeakPolarHBondContact O-CB 3.43Å; C462-N465 PolarHBondContact O-N 2.99Å; E463-N465 PolarHBondContact O-N 3.16Å; N465-T467 VanDerWaalsContact C-N 3.3Å; N465-T467 PolarHBondContact O-N 2.84Å; N465-I468 WeakPolarHBondContact O-CB 3.48Å; N465-I468 PolarHBondContact O-N 3.05Å; N465-I468 VanDerWaalsContact O-N 3.12Å; N465-A469 PolarHBondContact O-N 3.36Å
466	V	68.8	Low	71.1	Confident	30 Å²	30	60 Å²	60	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-42.8	170.3	171.8	0	0	0	0	110.8	C462 E463 I468 A469 S470 I476 P477 C479	C462-V466 PolarHBondContact O-N 3.05Å; E463-V466 WeakPolarHBondContact O-CB 3.35Å; E463-V466 PolarHBondContact O-N 3.29Å; V466-I468 PolarHBondContact O-N 3.16Å; V466-I468 VanDerWaalsContact O-N 3.16Å; V466-A469 PolarHBondContact O-N 3.41Å; V466-A469 VanDerWaalsContact O-N 3.11Å; V466-S470 PolarHBondContact O-N 2.74Å; V466-S470 PolarHBondContact O-OG 3.15Å; V466-I476 HydrophobicContact CG1-CG2 4.04Å; V466-I476 HydrophobicContact CG2-CG2 4.31Å; V466-P477 HydrophobicContact CG2-CG 3.83Å; V466-C479 WeakPolarHBondContact CG2-SG 3.36Å
467	T	64.1	Low	70.2	Confident	23 Å²	23	60.9 Å²	60.9	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-20.9	177.2	72.3	0	0	0	0	114	N88 E166 E463 A464 N465 S470 Q471	N88-T467 PolarHBondContact ND2-OG1 3.39Å; E166-T467 HydrophobicContact CG-CG2 4.06Å; E463-T467 PolarHBondContact O-N 2.91Å; A464-T467 PolarHBondContact O-OG1 2.81Å; N465-T467 VanDerWaalsContact C-N 3.3Å; N465-T467 PolarHBondContact O-N 2.84Å; T467-S470 PolarHBondContact O-OG 3.02Å; T467-Q471 PolarHBondContact O-NE2 2.8Å
468	I	65.1	Low	69.5	Low	22 Å²	22	65.1 Å²	65.1	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-86.4	-42.3	173.9	-54.8	174.9	0	0	0	110.1	N465 V466 S470 Q471 T472	N465-I468 WeakPolarHBondContact O-CB 3.48Å; N465-I468 PolarHBondContact O-N 3.05Å; N465-I468 VanDerWaalsContact O-N 3.12Å; V466-I468 PolarHBondContact O-N 3.16Å; V466-I468 VanDerWaalsContact O-N 3.16Å; I468-S470 PolarHBondContact O-N 2.96Å; I468-Q471 PolarHBondContact O-N 3.3Å; I468-T472 HydrophobicContact CG2-CG2 4.43Å; I468-T472 WeakPolarHBondContact O-CB 3.28Å; I468-T472 WeakPolarHBondContact O-CG2 3.26Å; I468-T472 PolarHBondContact O-N 2.92Å; I468-T472 PolarHBondContact O-OG1 3.15Å
469	A	60.2	Low	69.1	Low	8 Å²	8	62.8 Å²	62.8	7%	0.066	34%	0.344	C	S	.	.	H	α-helix	trans	-60.2	-44.7	178.4	0	0	0	0	0	111.8	N465 V466 T472 N473 K474	N465-A469 PolarHBondContact O-N 3.36Å; V466-A469 PolarHBondContact O-N 3.41Å; V466-A469 VanDerWaalsContact O-N 3.11Å; A469-T472 CarbonylContact O-C 3.57Å; A469-T472 PolarHBondContact O-N 2.56Å; A469-T472 VanDerWaalsContact O-N 3.17Å; A469-T472 PolarHBondContact O-OG1 3.39Å; A469-N473 PolarHBondContact O-N 3.31Å; A469-K474 HydrophobicContact CB-CB 4.49Å; A469-K474 PolarHBondContact O-N 3.32Å
470	S	60.2	Low	68.8	Low	68 Å²	68	65 Å²	65	48%	0.476	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-39.3	177.5	63.7	0	0	0	0	113.1	V466 T467 I468 T472	V466-S470 PolarHBondContact O-N 2.74Å; V466-S470 PolarHBondContact O-OG 3.15Å; T467-S470 PolarHBondContact O-OG 3.02Å; I468-S470 PolarHBondContact O-N 2.96Å; S470-T472 VanDerWaalsContact C-N 3.28Å; S470-T472 PolarHBondContact O-N 3.29Å
471	Q	61.7	Low	68.9	Low	77 Å²	77	66.5 Å²	66.5	36%	0.36	37%	0.37	S	S	.	.	H	α-helix	trans	-73.1	-16.7	175	-76.7	178.4	92.5	0	0	113.7	T467 I468	T467-Q471 PolarHBondContact O-NE2 2.8Å; I468-Q471 PolarHBondContact O-N 3.3Å
472	T	61.1	Low	69.1	Low	30 Å²	30	70.4 Å²	70.4	18%	0.184	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	7.8	-177.4	55.1	0	0	0	0	114.2	T81 I468 A469 S470 K474	T81-T472 HydrophobicContact CG2-CG2 3.86Å; I468-T472 HydrophobicContact CG2-CG2 4.43Å; I468-T472 WeakPolarHBondContact O-CB 3.28Å; I468-T472 WeakPolarHBondContact O-CG2 3.26Å; I468-T472 PolarHBondContact O-N 2.92Å; I468-T472 PolarHBondContact O-OG1 3.15Å; A469-T472 CarbonylContact O-C 3.57Å; A469-T472 PolarHBondContact O-N 2.56Å; A469-T472 VanDerWaalsContact O-N 3.17Å; A469-T472 PolarHBondContact O-OG1 3.39Å; S470-T472 VanDerWaalsContact C-N 3.28Å; S470-T472 PolarHBondContact O-N 3.29Å; T472-K474 PolarHBondContact O-N 2.61Å; T472-K474 WeakPolarHBondContact OG1-CD 3.28Å
473	N	61.2	Low	69.4	Low	159 Å²	159	72.6 Å²	72.6	85%	0.85	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	32.1	-174.3	-68.6	-43.6	0	0	0	113.7	A469	A469-N473 PolarHBondContact O-N 3.31Å
474	K	63.6	Low	70	Confident	96 Å²	96	74.7 Å²	74.7	42%	0.417	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-93.4	152.1	176.7	-72.7	173.5	-171.6	172.8	0	109.4	E78 A469 T472 I476	E78-K474 IonicContact OE1-NZ 2.78Å; E78-K474 PolarHBondContact OE1-NZ 3.28Å; A469-K474 HydrophobicContact CB-CB 4.49Å; A469-K474 PolarHBondContact O-N 3.32Å; T472-K474 PolarHBondContact O-N 2.61Å; T472-K474 WeakPolarHBondContact OG1-CD 3.28Å; K474-I476 PolarHBondContact O-N 3.24Å
475	P	66.8	Low	70.9	Confident	123 Å²	123	74.6 Å²	74.6	80%	0.799	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-56.4	129.5	-178.5	23	-34	0	0	0	110.5	P477	P475-P477 WeakPolarHBondContact O-CD 3.46Å
476	I	67.5	Low	71.9	Confident	117 Å²	117	73.4 Å²	73.4	60%	0.6	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-68.9	123.1	-177.1	-64.3	167.4	0	0	0	108.5	V466 K474	V466-I476 HydrophobicContact CG1-CG2 4.04Å; V466-I476 HydrophobicContact CG2-CG2 4.31Å; K474-I476 PolarHBondContact O-N 3.24Å
477	P	66.4	Low	73	Confident	43 Å²	43	73.3 Å²	73.3	28%	0.279	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-72.3	135.8	173.2	29.8	-32.8	0	0	0	110.2	V466 P475 C479	V466-P477 HydrophobicContact CG2-CG 3.83Å; P475-P477 WeakPolarHBondContact O-CD 3.46Å; P477-C479 PolarHBondContact O-N 2.86Å
478	E	70.8	Confident	74.4	Confident	177 Å²	177	78.2 Å²	78.2	83%	0.827	41%	0.414	S	S	*	.			trans	-79.6	100.6	177.6	-168.8	178.5	-176.9	0	0	110.3	T480	E478-T480 HydrophobicContact CG-CG2 4.28Å; E478-T480 PolarHBondContact O-N 3.39Å
479	C	75.9	Confident	75.8	Confident	24 Å²	24	78.3 Å²	78.3	16%	0.162	42%	0.416	C	S	.	.			trans	-82.1	110.3	-176.8	-61.5	0	0	0	0	111.4	Y459 C462 E463 V466 P477	Y459-C479 HydrophobicContact CD2-CB 4.11Å; Y459-C479 HydrophobicContact CE2-CB 3.89Å; C462-C479 HydrophobicContact CB-CB 3.77Å; C462-C479 WeakPolarHBondContact CB-SG 3.48Å; C462-C479 PolarHBondContact O-SG 2.97Å; C462-C479 WeakPolarHBondContact SG-CA 3.46Å; C462-C479 WeakPolarHBondContact SG-CB 3.47Å; C462-C479 CovalentContact SG-SG 2.04Å; C462-C479 PolarHBondContact SG-SG 3.33Å; E463-C479 HydrophobicContact CG-CB 4.42Å; V466-C479 WeakPolarHBondContact CG2-SG 3.36Å; P477-C479 PolarHBondContact O-N 2.86Å
480	T	78.2	Confident	77.4	Confident	95 Å²	95	79.5 Å²	79.5	58%	0.583	42%	0.42	S	S	*	.			trans	-124.1	138.6	-178.5	49.6	0	0	0	0	111.8	E478 K482	E478-T480 HydrophobicContact CG-CG2 4.28Å; E478-T480 PolarHBondContact O-N 3.39Å; T480-K482 PolarHBondContact O-N 2.9Å
481	I	81.3	Confident	79.1	Confident	51 Å²	51	77.6 Å²	77.6	26%	0.262	40%	0.403	S	S	.	.			trans	-79.9	105.5	178	-59.6	168.3	0	0	0	108.7	L193 Y459 R484	L193-I481 HydrophobicContact CD2-CD1 4.16Å; L193-I481 HydrophobicContact CD2-CG2 4.31Å; Y459-I481 HydrophobicContact CD1-CD1 4.1Å; Y459-I481 HydrophobicContact CD1-CG1 3.91Å; Y459-I481 HydrophobicContact CD2-CG1 3.79Å; Y459-I481 HydrophobicContact CE1-CD1 4.25Å; Y459-I481 HydrophobicContact CE1-CG1 4.37Å; Y459-I481 HydrophobicContact CE2-CG1 4.28Å; Y459-I481 HydrophobicContact CG-CD1 4.32Å; Y459-I481 HydrophobicContact CG-CG1 3.62Å; I481-R484 HydrophobicContact CG2-CB 4.01Å
482	K	81.8	Confident	80.8	Confident	142 Å²	142	77.4 Å²	77.4	62%	0.617	40%	0.404	S	S	*	.	S	Bend	trans	-59.7	-52	-175.3	-64.2	172.8	-177.8	169.4	0	113.5	E458 T480	E458-K482 IonicContact OE2-NZ 3.86Å; E458-K482 PolarHBondContact OE2-NZ 3.3Å; T480-K482 PolarHBondContact O-N 2.9Å
483	N	86.2	Confident	82.5	Confident	80 Å²	80	76 Å²	76	43%	0.428	40%	0.395	S	S	.	.			trans	-134.6	133.9	178.6	-64.1	-59.7	0	0	0	109.2	S455	S455-N483 VanDerWaalsContact CB-O 3.25Å; S455-N483 WeakPolarHBondContact CB-O 3.42Å
484	R	87.3	Confident	84.2	Confident	98 Å²	98	68.5 Å²	68.5	37%	0.37	36%	0.355	S	S	.	.			trans	-136.3	161.3	173.8	65.1	177.2	-179.5	145.6	8.5	111.1	L193 F194 E198 W452 I481	L193-R484 WeakPolarHBondContact O-CD 3.31Å; L193-R484 PolarHBondContact O-NH1 3.35Å; F194-R484 VanDerWaalsContact CD1-NH1 3.34Å; E198-R484 IonicContact OE1-CZ 2.76Å; E198-R484 IonicContact OE1-NH1 3.73Å; E198-R484 PolarHBondContact OE1-NH1 2.84Å; E198-R484 IonicContact OE1-NH2 2.98Å; E198-R484 PolarHBondContact OE1-NH2 3.12Å; E198-R484 IonicContact OE2-CZ 3.77Å; E198-R484 IonicContact OE2-NH1 2.9Å; E198-R484 PolarHBondContact OE2-NH1 3.29Å; E198-R484 IonicContact OE2-NH2 3.28Å; W452-R484 PolarHBondContact NE1-O 2.87Å; I481-R484 HydrophobicContact CG2-CB 4.01Å
485	P	90.1	Very high	85.8	Confident	35 Å²	35	68.2 Å²	68.2	23%	0.227	35%	0.354	C	S	.	.			trans	-59	143.9	177.7	-17.1	27.7	0	0	0	112	L193 F194 W452 L487	L193-P485 HydrophobicContact CD1-CG 4.31Å; F194-P485 WeakPolarHBondContact CE1-O 3.19Å; F194-P485 HydrophobicContact CZ-CB 4.07Å; F194-P485 HydrophobicContact CZ-CG 4.19Å; F194-P485 WeakPolarHBondContact CZ-O 3.47Å; W452-P485 HydrophobicContact CD2-CB 4.14Å; W452-P485 HydrophobicContact CD2-CG 3.82Å; W452-P485 HydrophobicContact CE3-CB 3.89Å; W452-P485 HydrophobicContact CE3-CG 3.64Å; W452-P485 HydrophobicContact CG-CG 4.22Å; W452-P485 HydrophobicContact CH2-CB 4.09Å; W452-P485 HydrophobicContact CZ2-CB 4.31Å; W452-P485 HydrophobicContact CZ3-CB 3.87Å; W452-P485 HydrophobicContact CZ3-CG 4.13Å; P485-L487 PolarHBondContact O-N 3.37Å
486	S	91.9	Very high	87.2	Confident	44 Å²	44	62.3 Å²	62.3	31%	0.308	32%	0.316	S	S	.	.			trans	-89.1	107.3	-176.4	-177.6	0	0	0	0	111.4	M488 V489 E490	S486-M488 PolarHBondContact O-N 2.97Å; S486-M488 VanDerWaalsContact O-N 3.09Å; S486-V489 PolarHBondContact O-N 3.45Å; S486-E490 PolarHBondContact O-N 3.07Å
487	L	91.8	Very high	88.6	Confident	28 Å²	28	57.7 Å²	57.7	15%	0.147	29%	0.291	C	S	.	.	H	α-helix	trans	-54.4	-28.3	174.5	-62.4	175.6	0	0	0	112.9	F194 E198 M202 V358 P485 K491	F194-L487 HydrophobicContact CD1-CD1 3.68Å; F194-L487 HydrophobicContact CD1-CD2 3.75Å; F194-L487 HydrophobicContact CD1-CG 3.76Å; F194-L487 HydrophobicContact CE1-CD1 4.01Å; F194-L487 HydrophobicContact CE1-CD2 3.59Å; F194-L487 HydrophobicContact CE1-CG 3.57Å; F194-L487 HydrophobicContact CE2-CD2 4.34Å; F194-L487 HydrophobicContact CG-CD1 4.5Å; F194-L487 HydrophobicContact CG-CD2 4.21Å; F194-L487 HydrophobicContact CZ-CD2 3.89Å; F194-L487 HydrophobicContact CZ-CG 4.31Å; E198-L487 HydrophobicContact CB-CD1 3.7Å; E198-L487 HydrophobicContact CG-CD1 3.81Å; M202-L487 HydrophobicContact CE-CB 4.14Å; M202-L487 HydrophobicContact CE-CD2 3.83Å; V358-L487 HydrophobicContact CG1-CD2 3.67Å; P485-L487 PolarHBondContact O-N 3.37Å; L487-K491 WeakPolarHBondContact O-CB 3.39Å; L487-K491 WeakPolarHBondContact O-CG 3.47Å; L487-K491 PolarHBondContact O-N 2.8Å
488	M	93.6	Very high	90	Very high	125 Å²	125	55.8 Å²	55.8	62%	0.616	28%	0.279	S	S	*	.	H	α-helix	trans	-66.7	-36.7	175.1	-173.2	60.9	69.7	0	0	112.1	S486 K491 I492	S486-M488 PolarHBondContact O-N 2.97Å; S486-M488 VanDerWaalsContact O-N 3.09Å; M488-K491 PolarHBondContact O-N 2.87Å; M488-I492 HydrophobicContact CG-CD1 4.17Å; M488-I492 WeakPolarHBondContact O-CD1 3.46Å; M488-I492 VanDerWaalsContact O-CG1 3.23Å; M488-I492 WeakPolarHBondContact O-CG1 3.35Å; M488-I492 PolarHBondContact O-N 2.83Å
489	V	95.1	Very high	91.3	Very high	25 Å²	25	47.8 Å²	47.8	15%	0.152	24%	0.244	C	C	.	.	H	α-helix	trans	-70.4	-39.7	178.3	178.2	0	0	0	0	110.8	C441 Y444 S486 I492 N493	C441-V489 HydrophobicContact CB-CG1 3.89Å; C441-V489 PolarHBondContact SG-O 3.12Å; C441-V489 VanDerWaalsContact SG-O 3.35Å; Y444-V489 HydrophobicContact CD1-CB 4.17Å; Y444-V489 HydrophobicContact CD1-CG1 3.74Å; Y444-V489 HydrophobicContact CD1-CG2 3.99Å; Y444-V489 HydrophobicContact CE1-CB 4.26Å; Y444-V489 HydrophobicContact CE1-CG1 4.33Å; Y444-V489 HydrophobicContact CE1-CG2 3.84Å; Y444-V489 HydrophobicContact CG-CG1 4.28Å; S486-V489 PolarHBondContact O-N 3.45Å; V489-I492 PolarHBondContact O-N 3.27Å; V489-N493 PolarHBondContact O-N 3.43Å
490	E	92.8	Very high	92.2	Very high	32 Å²	32	47.1 Å²	47.1	15%	0.15	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-34.9	175	-171.6	66.6	164.2	0	0	111.9	M202 S486 I492 N493 L494	M202-E490 HydrophobicContact CE-CB 4.41Å; S486-E490 PolarHBondContact O-N 3.07Å; E490-I492 VanDerWaalsContact C-N 3.33Å; E490-I492 PolarHBondContact O-N 2.92Å; E490-N493 WeakPolarHBondContact O-CB 3.47Å; E490-N493 PolarHBondContact O-N 2.81Å; E490-N493 VanDerWaalsContact O-N 3.14Å; E490-N493 WeakPolarHBondContact OE2-CB 3.32Å; E490-N493 PolarHBondContact OE2-ND2 2.99Å; E490-L494 HydrophobicContact CG-CD1 4.3Å; E490-L494 HydrophobicContact CG-CG 4.47Å; E490-L494 WeakPolarHBondContact O-CB 3.3Å; E490-L494 VanDerWaalsContact O-CG 3.27Å; E490-L494 WeakPolarHBondContact O-CG 3.22Å; E490-L494 PolarHBondContact O-N 3.03Å
491	K	96.5	Very high	93	Very high	29 Å²	29	42.6 Å²	42.6	13%	0.126	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-40.5	168.1	-80.6	-178.7	167.8	-175.5	0	112.6	D201 M202 Y205 L487 M488 N493 F495	D201-K491 IonicContact OD1-NZ 2.73Å; D201-K491 PolarHBondContact OD1-NZ 3.1Å; D201-K491 IonicContact OD2-NZ 2.71Å; D201-K491 PolarHBondContact OD2-NZ 2.68Å; M202-K491 HydrophobicContact CE-CG 3.94Å; M202-K491 HydrophobicContact SD-CG 3.86Å; Y205-K491 HydrophobicContact CD1-CG 4.03Å; Y205-K491 HydrophobicContact CD2-CD 4.1Å; Y205-K491 HydrophobicContact CD2-CG 4.31Å; Y205-K491 HydrophobicContact CE1-CB 4.11Å; Y205-K491 HydrophobicContact CE1-CG 4.07Å; Y205-K491 HydrophobicContact CE2-CD 4.23Å; Y205-K491 HydrophobicContact CE2-CG 4.33Å; Y205-K491 HydrophobicContact CG-CD 4.33Å; Y205-K491 HydrophobicContact CG-CG 4.16Å; Y205-K491 PolarHBondContact OH-O 3.45Å; L487-K491 WeakPolarHBondContact O-CB 3.39Å; L487-K491 WeakPolarHBondContact O-CG 3.47Å; L487-K491 PolarHBondContact O-N 2.8Å; M488-K491 PolarHBondContact O-N 2.87Å; K491-N493 VanDerWaalsContact C-N 3.34Å; K491-F495 VanDerWaalsContact O-CB 3.26Å; K491-F495 WeakPolarHBondContact O-CB 3.18Å; K491-F495 PolarHBondContact O-N 3.48Å
492	I	97.4	Very high	93.8	Very high	73 Å²	73	42 Å²	42	37%	0.374	21%	0.208	S	C	.	.	H	α-helix	trans	-65.4	-38.1	173.8	-70	162.9	0	0	0	111.1	I437 M488 V489 E490 S496	I437-I492 HydrophobicContact CG2-CG2 3.61Å; M488-I492 HydrophobicContact CG-CD1 4.17Å; M488-I492 WeakPolarHBondContact O-CD1 3.46Å; M488-I492 VanDerWaalsContact O-CG1 3.23Å; M488-I492 WeakPolarHBondContact O-CG1 3.35Å; M488-I492 PolarHBondContact O-N 2.83Å; V489-I492 PolarHBondContact O-N 3.27Å; E490-I492 VanDerWaalsContact C-N 3.33Å; E490-I492 PolarHBondContact O-N 2.92Å; I492-S496 WeakPolarHBondContact O-CB 3.44Å; I492-S496 PolarHBondContact O-N 2.93Å
493	N	96	Very high	94.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-50.1	175.8	-169.4	20.2	0	0	0	111.7	T438 C441 H442 V489 E490 K491 S496 M497	T438-N493 WeakPolarHBondContact CG2-OD1 3.43Å; T438-N493 PolarHBondContact OG1-OD1 2.96Å; C441-N493 HydrophobicContact CB-CB 3.74Å; H442-N493 PolarHBondContact CE1-ND2 2.93Å; H442-N493 VanDerWaalsContact CE1-ND2 3.32Å; V489-N493 PolarHBondContact O-N 3.43Å; E490-N493 WeakPolarHBondContact O-CB 3.47Å; E490-N493 PolarHBondContact O-N 2.81Å; E490-N493 VanDerWaalsContact O-N 3.14Å; E490-N493 WeakPolarHBondContact OE2-CB 3.32Å; E490-N493 PolarHBondContact OE2-ND2 2.99Å; K491-N493 VanDerWaalsContact C-N 3.34Å; N493-S496 WeakPolarHBondContact O-CB 3.34Å; N493-S496 PolarHBondContact O-N 3.33Å; N493-S496 VanDerWaalsContact O-N 3.14Å; N493-M497 PolarHBondContact O-N 3.25Å
494	L	96.5	Very high	94.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-45.6	176	-68.3	168	0	0	0	111.6	M202 Y205 I206 W253 E490 S496 M497 F498	M202-L494 HydrophobicContact SD-CD1 3.66Å; Y205-L494 HydrophobicContact CD1-CB 4.5Å; Y205-L494 HydrophobicContact CD1-CD1 4.41Å; Y205-L494 HydrophobicContact CE1-CB 4.16Å; I206-L494 HydrophobicContact CD1-CD1 4.15Å; I206-L494 HydrophobicContact CG1-CD1 3.82Å; W253-L494 HydrophobicContact CE3-CD2 4.37Å; W253-L494 HydrophobicContact CH2-CD2 3.47Å; W253-L494 VanDerWaalsContact CH2-CD2 3.47Å; W253-L494 HydrophobicContact CZ2-CD2 3.76Å; W253-L494 HydrophobicContact CZ3-CD2 3.8Å; E490-L494 HydrophobicContact CG-CD1 4.3Å; E490-L494 HydrophobicContact CG-CG 4.47Å; E490-L494 WeakPolarHBondContact O-CB 3.3Å; E490-L494 VanDerWaalsContact O-CG 3.27Å; E490-L494 WeakPolarHBondContact O-CG 3.22Å; E490-L494 PolarHBondContact O-N 3.03Å; L494-S496 PolarHBondContact O-N 2.81Å; L494-M497 PolarHBondContact O-N 3.28Å; L494-F498 HydrophobicContact CB-CD2 4.3Å; L494-F498 HydrophobicContact CB-CE2 4.33Å; L494-F498 HydrophobicContact CD2-CE2 4.07Å; L494-F498 WeakPolarHBondContact O-CB 3.19Å; L494-F498 WeakPolarHBondContact O-CD2 3.39Å; L494-F498 PolarHBondContact O-N 3.3Å
495	F	97.5	Very high	95.1	Very high	90 Å²	90	27.2 Å²	27.2	40%	0.395	15%	0.145	S	C	.	.	H	α-helix	trans	-54.6	-42.4	173	175.5	-104.3	0	0	0	111.8	F209 F434 K491 G499	F209-F495 AromaticContact CE1-CD2 3.81Å; F209-F495 HydrophobicContact CE1-CD2 3.81Å; F209-F495 HydrophobicContact CE1-CE2 4.16Å; F209-F495 AromaticContact CZ-CD2 3.92Å; F209-F495 HydrophobicContact CZ-CD2 3.92Å; F209-F495 HydrophobicContact CZ-CE2 4.39Å; F434-F495 HydrophobicContact CE1-CE1 4.05Å; K491-F495 VanDerWaalsContact O-CB 3.26Å; K491-F495 WeakPolarHBondContact O-CB 3.18Å; K491-F495 PolarHBondContact O-N 3.48Å; F495-G499 WeakPolarHBondContact O-CA 3.33Å; F495-G499 PolarHBondContact O-N 3.45Å
496	S	97.1	Very high	95.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-69.9	-43	179.9	-161.5	0	0	0	0	112.5	F434 T438 I492 N493 L494 T500	F434-S496 VanDerWaalsContact C-OG 3.22Å; F434-S496 WeakPolarHBondContact CA-OG 3.24Å; F434-S496 WeakPolarHBondContact CB-OG 3.42Å; F434-S496 WeakPolarHBondContact CD1-OG 3.41Å; F434-S496 PolarHBondContact O-OG 3.16Å; T438-S496 WeakPolarHBondContact OG1-CB 3.33Å; T438-S496 PolarHBondContact OG1-OG 2.72Å; I492-S496 WeakPolarHBondContact O-CB 3.44Å; I492-S496 PolarHBondContact O-N 2.93Å; N493-S496 WeakPolarHBondContact O-CB 3.34Å; N493-S496 PolarHBondContact O-N 3.33Å; N493-S496 VanDerWaalsContact O-N 3.14Å; L494-S496 PolarHBondContact O-N 2.81Å; S496-T500 PolarHBondContact O-N 2.93Å; S496-T500 PolarHBondContact O-OG1 3.22Å
497	M	95.6	Very high	95.2	Very high	19 Å²	19	25.8 Å²	25.8	9%	0.094	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-54.3	178.4	-167.1	-173.4	-56.2	0	0	111.5	F246 W253 L297 N493 L494 T500	F246-M497 VanDerWaalsContact CE1-O 3.24Å; F246-M497 WeakPolarHBondContact CE1-O 3.37Å; W253-M497 HydrophobicContact CZ2-CE 4.18Å; W253-M497 HydrophobicContact CZ2-SD 4.13Å; L297-M497 HydrophobicContact CD1-CE 4.39Å; L297-M497 HydrophobicContact CD1-CG 4.31Å; L297-M497 HydrophobicContact CD1-SD 4.34Å; L297-M497 HydrophobicContact CD2-CE 4.48Å; N493-M497 PolarHBondContact O-N 3.25Å; L494-M497 PolarHBondContact O-N 3.28Å; M497-T500 PolarHBondContact O-N 3.22Å
498	F	97.6	Very high	95.2	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-67.1	-40.6	176.8	-69.8	-55.5	0	0	0	111.9	F209 T213 W253 L494 T500 G501 I502	F209-F498 HydrophobicContact CB-CB 3.96Å; F209-F498 HydrophobicContact CB-CD2 3.53Å; F209-F498 HydrophobicContact CB-CE2 4.21Å; F209-F498 HydrophobicContact CB-CG 3.86Å; T213-F498 HydrophobicContact CG2-CD1 4.25Å; T213-F498 WeakPolarHBondContact OG1-CB 3.43Å; T213-F498 WeakPolarHBondContact OG1-CD1 3.48Å; T213-F498 PolarHBondContact OG1-O 3.14Å; W253-F498 HydrophobicContact CB-CE1 4.29Å; W253-F498 HydrophobicContact CB-CZ 3.9Å; W253-F498 AromaticContact CD1-CE1 3.96Å; W253-F498 AromaticContact CD1-CZ 3.85Å; W253-F498 HydrophobicContact CD2-CZ 4.07Å; W253-F498 HydrophobicContact CG-CE1 4.14Å; W253-F498 AromaticContact CG-CZ 3.68Å; W253-F498 HydrophobicContact CG-CZ 3.68Å; L494-F498 HydrophobicContact CB-CD2 4.3Å; L494-F498 HydrophobicContact CB-CE2 4.33Å; L494-F498 HydrophobicContact CD2-CE2 4.07Å; L494-F498 WeakPolarHBondContact O-CB 3.19Å; L494-F498 WeakPolarHBondContact O-CD2 3.39Å; L494-F498 PolarHBondContact O-N 3.3Å; F498-T500 VanDerWaalsContact C-N 3.27Å; F498-T500 PolarHBondContact O-N 3.17Å; F498-G501 PolarHBondContact O-N 3.49Å; F498-I502 WeakPolarHBondContact O-CG1 3.38Å; F498-I502 PolarHBondContact O-N 2.99Å
499	G	96.4	Very high	95.1	Very high	8 Å²	8	25.6 Å²	25.6	8%	0.082	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-34.4	176.4	0	0	0	0	0	113.3	F495 A503	F495-G499 WeakPolarHBondContact O-CA 3.33Å; F495-G499 PolarHBondContact O-N 3.45Å; G499-A503 WeakPolarHBondContact O-CB 3.33Å; G499-A503 PolarHBondContact O-N 3.01Å
500	T	95.4	Very high	94.8	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-49.6	171	-54.4	0	0	0	0	111.1	F246 A431 F434 S496 M497 F498 I502 A503 M504	F246-T500 HydrophobicContact CE1-CG2 4.39Å; F246-T500 HydrophobicContact CE2-CG2 3.73Å; F246-T500 HydrophobicContact CZ-CG2 3.44Å; F246-T500 VanDerWaalsContact CZ-CG2 3.44Å; A431-T500 HydrophobicContact CB-CG2 4.48Å; F434-T500 WeakPolarHBondContact CB-OG1 3.23Å; S496-T500 PolarHBondContact O-N 2.93Å; S496-T500 PolarHBondContact O-OG1 3.22Å; M497-T500 PolarHBondContact O-N 3.22Å; F498-T500 VanDerWaalsContact C-N 3.27Å; F498-T500 PolarHBondContact O-N 3.17Å; T500-I502 PolarHBondContact O-N 3.36Å; T500-A503 PolarHBondContact O-N 3.47Å; T500-M504 HydrophobicContact CG2-CG 4.38Å; T500-M504 VanDerWaalsContact O-CG 3.27Å; T500-M504 WeakPolarHBondContact O-CG 3.22Å; T500-M504 PolarHBondContact O-N 3.25Å
501	G	95.9	Very high	94.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-46.1	177.7	0	0	0	0	0	112.6	F498 M504 S505	F498-G501 PolarHBondContact O-N 3.49Å; G501-M504 PolarHBondContact O-N 3.38Å; G501-S505 PolarHBondContact O-N 2.98Å
502	I	96.6	Very high	93.9	Very high	38 Å²	38	32.5 Å²	32.5	20%	0.195	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-49.1	175.4	-64.6	166.2	0	0	0	110.3	F209 I212 T213 F498 T500 M504 S505 T506	F209-I502 HydrophobicContact CD1-CD1 4.46Å; I212-I502 HydrophobicContact CB-CD1 4.44Å; I212-I502 HydrophobicContact CG2-CD1 3.74Å; I212-I502 HydrophobicContact CG2-CG1 4.16Å; T213-I502 HydrophobicContact CG2-CG1 4.45Å; F498-I502 WeakPolarHBondContact O-CG1 3.38Å; F498-I502 PolarHBondContact O-N 2.99Å; T500-I502 PolarHBondContact O-N 3.36Å; I502-M504 PolarHBondContact O-N 2.83Å; I502-S505 WeakPolarHBondContact O-CB 3.13Å; I502-S505 PolarHBondContact O-N 3.42Å; I502-S505 VanDerWaalsContact O-N 3.16Å; I502-S505 PolarHBondContact O-OG 3.02Å; I502-T506 PolarHBondContact O-N 3.37Å
503	A	95.2	Very high	93.5	Very high	10 Å²	10	29.3 Å²	29.3	8%	0.083	14%	0.138	C	C	.	.	H	α-helix	trans	-58.3	-46.8	179.1	0	0	0	0	0	112.3	F427 L430 F434 G499 T500 S505 T506	F427-A503 VanDerWaalsContact CE1-O 3.32Å; F427-A503 WeakPolarHBondContact CE1-O 3.42Å; L430-A503 HydrophobicContact CD2-CB 3.73Å; L430-A503 HydrophobicContact CG-CB 4.15Å; F434-A503 HydrophobicContact CE2-CB 3.93Å; G499-A503 WeakPolarHBondContact O-CB 3.33Å; G499-A503 PolarHBondContact O-N 3.01Å; T500-A503 PolarHBondContact O-N 3.47Å; A503-S505 VanDerWaalsContact C-N 3.27Å; A503-S505 PolarHBondContact O-N 3.08Å; A503-T506 PolarHBondContact O-N 3.1Å; A503-T506 VanDerWaalsContact O-N 3.15Å; A503-T506 PolarHBondContact O-OG1 3.37Å
504	M	93.4	Very high	93.2	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-67.8	-25.1	179.5	-64.1	-57.4	100.9	0	0	113	L239 I242 N243 L307 F427 A431 T500 G501 I502 T506	L239-M504 HydrophobicContact CD2-SD 4.1Å; I242-M504 HydrophobicContact CG2-CB 4.07Å; I242-M504 HydrophobicContact CG2-CG 3.85Å; N243-M504 PolarHBondContact ND2-O 3.16Å; L307-M504 HydrophobicContact CD2-SD 4.42Å; F427-M504 HydrophobicContact CB-CE 3.9Å; F427-M504 HydrophobicContact CB-SD 4.33Å; F427-M504 HydrophobicContact CD1-CE 3.74Å; F427-M504 HydrophobicContact CG-CE 4.24Å; F427-M504 WeakPolarHBondContact O-CE 3.45Å; A431-M504 HydrophobicContact CB-CE 3.9Å; A431-M504 HydrophobicContact CB-SD 4.23Å; T500-M504 HydrophobicContact CG2-CG 4.38Å; T500-M504 VanDerWaalsContact O-CG 3.27Å; T500-M504 WeakPolarHBondContact O-CG 3.22Å; T500-M504 PolarHBondContact O-N 3.25Å; G501-M504 PolarHBondContact O-N 3.38Å; I502-M504 PolarHBondContact O-N 2.83Å; M504-T506 VanDerWaalsContact C-N 3.32Å
505	S	95.1	Very high	92.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-32.1	172.8	84.4	0	0	0	0	112.8	C216 T220 N243 G501 I502 A503 W507 V508	C216-S505 WeakPolarHBondContact CB-OG 3.16Å; C216-S505 WeakPolarHBondContact O-CB 3.35Å; T220-S505 WeakPolarHBondContact OG1-CA 3.34Å; T220-S505 WeakPolarHBondContact OG1-CB 3.35Å; T220-S505 PolarHBondContact OG1-O 3.16Å; N243-S505 VanDerWaalsContact OD1-CA 3.25Å; N243-S505 WeakPolarHBondContact OD1-CA 3.44Å; N243-S505 WeakPolarHBondContact OD1-CB 3.03Å; N243-S505 PolarHBondContact OD1-N 3.24Å; G501-S505 PolarHBondContact O-N 2.98Å; I502-S505 WeakPolarHBondContact O-CB 3.13Å; I502-S505 PolarHBondContact O-N 3.42Å; I502-S505 VanDerWaalsContact O-N 3.16Å; I502-S505 PolarHBondContact O-OG 3.02Å; A503-S505 VanDerWaalsContact C-N 3.27Å; A503-S505 PolarHBondContact O-N 3.08Å; S505-W507 PolarHBondContact O-N 2.9Å; S505-V508 PolarHBondContact O-N 2.88Å; S505-V508 VanDerWaalsContact O-N 3.15Å
506	T	93.3	Very high	92.4	Very high	35 Å²	35	35.2 Å²	35.2	22%	0.215	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-66.7	-7.9	-178.2	72	0	0	0	0	113.5	R423 F427 I502 A503 M504 V508 W509	R423-T506 PolarHBondContact NH2-O 3.04Å; F427-T506 WeakPolarHBondContact CE1-OG1 3.4Å; F427-T506 VanDerWaalsContact CZ-OG1 3.27Å; F427-T506 WeakPolarHBondContact CZ-OG1 3.34Å; I502-T506 PolarHBondContact O-N 3.37Å; A503-T506 PolarHBondContact O-N 3.1Å; A503-T506 VanDerWaalsContact O-N 3.15Å; A503-T506 PolarHBondContact O-OG1 3.37Å; M504-T506 VanDerWaalsContact C-N 3.32Å; T506-V508 PolarHBondContact O-N 3.43Å; T506-W509 HydrophobicContact CG2-CD2 3.96Å; T506-W509 HydrophobicContact CG2-CE3 4.07Å; T506-W509 HydrophobicContact CG2-CG 4.5Å; T506-W509 HydrophobicContact CG2-CH2 4.28Å; T506-W509 HydrophobicContact CG2-CZ2 4.17Å; T506-W509 HydrophobicContact CG2-CZ3 4.23Å; T506-W509 WeakPolarHBondContact O-CB 3.29Å; T506-W509 PolarHBondContact O-N 3.03Å
507	W	89.8	Confident	92.1	Very high	13 Å²	13	39.4 Å²	39.4	5%	0.049	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-50.7	-44.2	167.1	178.3	-105	0	0	0	112.1	F224 L239 R423 L424 F427 S505 W509 T510	F224-W507 AromaticContact CZ-CD1 3.87Å; L239-W507 HydrophobicContact CD1-CB 4.03Å; L239-W507 HydrophobicContact CD1-CD2 3.35Å; L239-W507 HydrophobicContact CD1-CE3 3.72Å; L239-W507 HydrophobicContact CD1-CG 3.46Å; L239-W507 VanDerWaalsContact CD1-CG 3.46Å; L239-W507 HydrophobicContact CD1-CZ2 4.42Å; L239-W507 HydrophobicContact CD1-CZ3 4.39Å; R423-W507 HydrophobicContact CB-CZ3 4.42Å; R423-W507 HydrophobicContact CG-CE3 4.45Å; R423-W507 HydrophobicContact CG-CZ3 3.98Å; R423-W507 VanDerWaalsContact CZ-O 3.28Å; R423-W507 VanDerWaalsContact NH1-CE3 3.34Å; R423-W507 PolarHBondContact NH1-O 3.42Å; R423-W507 PolarHBondContact NH2-O 3.05Å; L424-W507 HydrophobicContact CB-CZ3 4.4Å; L424-W507 HydrophobicContact CD1-CH2 4.5Å; L424-W507 HydrophobicContact CD1-CZ3 4.25Å; F427-W507 AromaticContact CD2-CE3 3.69Å; F427-W507 HydrophobicContact CD2-CE3 3.69Å; F427-W507 HydrophobicContact CD2-CZ3 4.21Å; F427-W507 AromaticContact CE2-CE3 3.7Å; F427-W507 HydrophobicContact CE2-CE3 3.7Å; F427-W507 HydrophobicContact CE2-CZ3 4.39Å; S505-W507 PolarHBondContact O-N 2.9Å; W507-W509 VanDerWaalsContact C-N 3.28Å; W507-W509 PolarHBondContact O-N 3.49Å; W507-T510 WeakPolarHBondContact O-CG2 3.46Å
508	V	91.7	Very high	91.8	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-84.3	6.1	179.4	-56.2	0	0	0	0	113.8	F219 T220 T223 F224 S505 T506 T510 T513	F219-V508 HydrophobicContact CD1-CG2 4.05Å; F219-V508 HydrophobicContact CE1-CG2 3.9Å; T220-V508 HydrophobicContact CG2-CG1 3.89Å; T220-V508 HydrophobicContact CG2-CG2 4.06Å; T223-V508 HydrophobicContact CG2-CB 4.04Å; T223-V508 HydrophobicContact CG2-CG1 4.13Å; T223-V508 HydrophobicContact CG2-CG2 4.45Å; F224-V508 HydrophobicContact CD2-CG1 3.94Å; F224-V508 HydrophobicContact CE2-CG1 3.69Å; S505-V508 PolarHBondContact O-N 2.88Å; S505-V508 VanDerWaalsContact O-N 3.15Å; T506-V508 PolarHBondContact O-N 3.43Å; V508-T510 VanDerWaalsContact C-N 3.26Å; V508-T510 PolarHBondContact O-N 3.38Å; V508-T513 WeakPolarHBondContact O-CB 3.48Å; V508-T513 WeakPolarHBondContact O-CG2 3.33Å; V508-T513 PolarHBondContact O-OG1 3.28Å
509	W	91.3	Very high	91.2	Very high	149 Å²	149	47 Å²	47	56%	0.564	21%	0.213	S	C	*	.			trans	-83.3	73.5	178.1	-65	23	0	0	0	109.6	T506 W507	T506-W509 HydrophobicContact CG2-CD2 3.96Å; T506-W509 HydrophobicContact CG2-CE3 4.07Å; T506-W509 HydrophobicContact CG2-CG 4.5Å; T506-W509 HydrophobicContact CG2-CH2 4.28Å; T506-W509 HydrophobicContact CG2-CZ2 4.17Å; T506-W509 HydrophobicContact CG2-CZ3 4.23Å; T506-W509 WeakPolarHBondContact O-CB 3.29Å; T506-W509 PolarHBondContact O-N 3.03Å; W507-W509 VanDerWaalsContact C-N 3.28Å; W507-W509 PolarHBondContact O-N 3.49Å
510	T	89.3	Confident	90.9	Very high	27 Å²	27	47.8 Å²	47.8	17%	0.166	22%	0.216	C	C	.	.	S	Bend	trans	-136	161.3	-175.1	79	0	0	0	0	112.6	W507 V508 A512 T513 P571	W507-T510 WeakPolarHBondContact O-CG2 3.46Å; V508-T510 VanDerWaalsContact C-N 3.26Å; V508-T510 PolarHBondContact O-N 3.38Å; T510-A512 PolarHBondContact O-N 2.9Å; T510-A512 PolarHBondContact OG1-N 3.5Å; T510-T513 WeakPolarHBondContact O-CB 3.27Å; T510-T513 PolarHBondContact O-N 2.88Å; T510-T513 VanDerWaalsContact O-N 3.1Å; T510-T513 PolarHBondContact OG1-N 3.17Å; T510-T513 PolarHBondContact OG1-OG1 3.33Å; T510-P571 HydrophobicContact CG2-CG 4.17Å
511	K	87.4	Confident	90.5	Very high	194 Å²	194	54.9 Å²	54.9	84%	0.843	24%	0.242	S	C	*	.	H	α-helix	trans	-60.8	-23.4	174.3	-65.7	177.8	-179.2	173.6	0	113.4
512	A	83.2	Confident	89.9	Confident	10 Å²	10	58.4 Å²	58.4	8%	0.083	26%	0.257	C	S	.	.	H	α-helix	trans	-73.6	-33.1	175.4	0	0	0	0	0	112.6	T510 F514 L515 I516 V572	T510-A512 PolarHBondContact O-N 2.9Å; T510-A512 PolarHBondContact OG1-N 3.5Å; A512-F514 VanDerWaalsContact C-N 3.3Å; A512-F514 PolarHBondContact O-N 2.97Å; A512-L515 CarbonylContact O-C 3.53Å; A512-L515 WeakPolarHBondContact O-CA 3.16Å; A512-L515 WeakPolarHBondContact O-CB 3.26Å; A512-L515 PolarHBondContact O-N 3.04Å; A512-I516 WeakPolarHBondContact O-CG1 3.36Å; A512-I516 PolarHBondContact O-N 2.95Å; A512-V572 HydrophobicContact CB-CG2 4.14Å
513	T	89.6	Confident	89.3	Confident	6 Å²	6	61.8 Å²	61.8	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-39.2	177.9	-57.5	0	0	0	0	111.7	F219 T223 V508 T510 L515 I516 W517	F219-T513 HydrophobicContact CE1-CG2 4.19Å; F219-T513 HydrophobicContact CZ-CG2 3.73Å; T223-T513 HydrophobicContact CG2-CG2 3.64Å; V508-T513 WeakPolarHBondContact O-CB 3.48Å; V508-T513 WeakPolarHBondContact O-CG2 3.33Å; V508-T513 PolarHBondContact O-OG1 3.28Å; T510-T513 WeakPolarHBondContact O-CB 3.27Å; T510-T513 PolarHBondContact O-N 2.88Å; T510-T513 VanDerWaalsContact O-N 3.1Å; T510-T513 PolarHBondContact OG1-N 3.17Å; T510-T513 PolarHBondContact OG1-OG1 3.33Å; T513-L515 VanDerWaalsContact C-N 3.29Å; T513-L515 PolarHBondContact O-N 2.95Å; T513-I516 PolarHBondContact O-N 3.43Å; T513-W517 VanDerWaalsContact O-CD1 3.32Å; T513-W517 PolarHBondContact O-N 2.78Å
514	F	89.9	Confident	89	Confident	146 Å²	146	67.2 Å²	67.2	64%	0.64	30%	0.297	S	S	*	.	H	α-helix	trans	-61.3	-35.8	170.6	-176.7	-99.8	0	0	0	112.7	A512 K518	A512-F514 VanDerWaalsContact C-N 3.3Å; A512-F514 PolarHBondContact O-N 2.97Å; F514-K518 HydrophobicContact CE1-CD 4.32Å; F514-K518 WeakPolarHBondContact O-CB 3.13Å; F514-K518 PolarHBondContact O-N 3.21Å
515	L	88	Confident	88.7	Confident	60 Å²	60	71.1 Å²	71.1	31%	0.314	32%	0.317	S	S	.	.	H	α-helix	trans	-71.6	-36.6	175	-62.5	174	0	0	0	112.6	A512 T513 R519	A512-L515 CarbonylContact O-C 3.53Å; A512-L515 WeakPolarHBondContact O-CA 3.16Å; A512-L515 WeakPolarHBondContact O-CB 3.26Å; A512-L515 PolarHBondContact O-N 3.04Å; T513-L515 VanDerWaalsContact C-N 3.29Å; T513-L515 PolarHBondContact O-N 2.95Å; L515-R519 WeakPolarHBondContact O-CB 3.34Å; L515-R519 PolarHBondContact O-N 2.85Å
516	I	89.3	Confident	87.5	Confident	8 Å²	8	73.9 Å²	73.9	4%	0.041	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-56.6	173.1	-68.4	165.2	0	0	0	109.3	A226 D227 A512 T513 K518 R519 T520 V572	A226-I516 HydrophobicContact CB-CG2 3.95Å; D227-I516 HydrophobicContact CB-CD1 3.86Å; D227-I516 HydrophobicContact CB-CG1 4.1Å; D227-I516 HydrophobicContact CB-CG2 3.99Å; A512-I516 WeakPolarHBondContact O-CG1 3.36Å; A512-I516 PolarHBondContact O-N 2.95Å; T513-I516 PolarHBondContact O-N 3.43Å; I516-K518 VanDerWaalsContact C-N 3.34Å; I516-K518 PolarHBondContact O-N 3.45Å; I516-R519 WeakPolarHBondContact O-CB 3.47Å; I516-R519 PolarHBondContact O-N 2.77Å; I516-R519 VanDerWaalsContact O-N 3.07Å; I516-T520 PolarHBondContact O-N 2.99Å; I516-T520 PolarHBondContact O-OG1 3.3Å; I516-V572 HydrophobicContact CD1-CG2 4.37Å
517	W	91.2	Very high	86	Confident	89 Å²	89	80.6 Å²	80.6	34%	0.337	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-39.7	179.4	-80.2	99.2	0	0	0	112.6	F219 A222 T223 T513 R519 T520 W521	F219-W517 HydrophobicContact CD2-CZ2 4.31Å; F219-W517 AromaticContact CE2-CE2 3.89Å; F219-W517 HydrophobicContact CE2-CZ2 4.25Å; F219-W517 AromaticContact CE2-NE1 3.42Å; F219-W517 AromaticContact CZ-NE1 3.85Å; A222-W517 HydrophobicContact CB-CH2 4.08Å; A222-W517 HydrophobicContact CB-CZ2 3.88Å; T223-W517 PolarHBondContact OG1-NE1 3.4Å; T513-W517 VanDerWaalsContact O-CD1 3.32Å; T513-W517 PolarHBondContact O-N 2.78Å; W517-R519 PolarHBondContact O-N 3.47Å; W517-T520 PolarHBondContact O-N 3.36Å; W517-W521 VanDerWaalsContact O-CB 3.22Å; W517-W521 WeakPolarHBondContact O-CB 3.12Å; W517-W521 PolarHBondContact O-N 3.39Å
518	K	88.6	Confident	84.1	Confident	104 Å²	104	84.2 Å²	84.2	45%	0.452	39%	0.394	S	S	.	.	H	α-helix	trans	-59.1	-43.5	172.1	-179.1	175.1	-179.3	175.4	0	112.3	F514 I516 F522	F514-K518 HydrophobicContact CE1-CD 4.32Å; F514-K518 WeakPolarHBondContact O-CB 3.13Å; F514-K518 PolarHBondContact O-N 3.21Å; I516-K518 VanDerWaalsContact C-N 3.34Å; I516-K518 PolarHBondContact O-N 3.45Å; K518-F522 HydrophobicContact CD-CE2 4.37Å; K518-F522 HydrophobicContact CG-CD2 3.92Å; K518-F522 HydrophobicContact CG-CE2 3.68Å; K518-F522 WeakPolarHBondContact O-CD2 3.38Å; K518-F522 PolarHBondContact O-N 2.99Å; K518-F522 VanDerWaalsContact O-N 3.1Å
519	R	85.6	Confident	82.1	Confident	79 Å²	79	89.5 Å²	89.5	30%	0.298	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-44	176.4	-174.1	-167.9	-66.2	148.7	-3	111.2	D227 L515 I516 W517 F522 K523	D227-R519 IonicContact OD1-NH1 2.66Å; D227-R519 PolarHBondContact OD1-NH1 2.93Å; L515-R519 WeakPolarHBondContact O-CB 3.34Å; L515-R519 PolarHBondContact O-N 2.85Å; I516-R519 WeakPolarHBondContact O-CB 3.47Å; I516-R519 PolarHBondContact O-N 2.77Å; I516-R519 VanDerWaalsContact O-N 3.07Å; W517-R519 PolarHBondContact O-N 3.47Å; R519-F522 PolarHBondContact O-N 3.39Å; R519-K523 WeakPolarHBondContact O-CG 3.08Å; R519-K523 PolarHBondContact O-N 3.19Å
520	T	88.5	Confident	79.9	Confident	23 Å²	23	87.3 Å²	87.3	14%	0.141	42%	0.422	C	S	.	.	H	α-helix	trans	-65.6	-44.2	178.9	-61.7	0	0	0	0	111.6	I516 W517 F522 K523 I524	I516-T520 PolarHBondContact O-N 2.99Å; I516-T520 PolarHBondContact O-OG1 3.3Å; W517-T520 PolarHBondContact O-N 3.36Å; T520-F522 PolarHBondContact O-N 3.47Å; T520-K523 WeakPolarHBondContact O-CB 3.5Å; T520-K523 PolarHBondContact O-N 2.6Å; T520-I524 HydrophobicContact CG2-CD1 3.89Å; T520-I524 WeakPolarHBondContact O-CG1 3.35Å; T520-I524 PolarHBondContact O-N 2.98Å
521	W	88	Confident	77.4	Confident	159 Å²	159	93.3 Å²	93.3	60%	0.602	45%	0.447	S	S	*	.	H	α-helix	trans	-59.3	-44.2	174.6	-169.6	-114.7	0	0	0	112.3	W517 I524 I525	W517-W521 VanDerWaalsContact O-CB 3.22Å; W517-W521 WeakPolarHBondContact O-CB 3.12Å; W517-W521 PolarHBondContact O-N 3.39Å; W521-I524 PolarHBondContact O-N 2.95Å; W521-I525 HydrophobicContact CD2-CD1 4.09Å; W521-I525 HydrophobicContact CG-CD1 4.2Å; W521-I525 HydrophobicContact CZ2-CD1 4.02Å; W521-I525 VanDerWaalsContact NE1-CD1 3.31Å; W521-I525 WeakPolarHBondContact O-CB 3.41Å; W521-I525 WeakPolarHBondContact O-CG1 3.34Å; W521-I525 PolarHBondContact O-N 3.37Å
522	F	84.1	Confident	75.2	Confident	74 Å²	74	89.1 Å²	89.1	33%	0.325	44%	0.44	S	S	.	.	H	α-helix	trans	-67.3	-34	175.3	-78.6	-51.4	0	0	0	113.9	K518 R519 T520 G526 R527	K518-F522 HydrophobicContact CD-CE2 4.37Å; K518-F522 HydrophobicContact CG-CD2 3.92Å; K518-F522 HydrophobicContact CG-CE2 3.68Å; K518-F522 WeakPolarHBondContact O-CD2 3.38Å; K518-F522 PolarHBondContact O-N 2.99Å; K518-F522 VanDerWaalsContact O-N 3.1Å; R519-F522 PolarHBondContact O-N 3.39Å; T520-F522 PolarHBondContact O-N 3.47Å; F522-G526 PolarHBondContact O-N 3.1Å; F522-R527 HydrophobicContact CD1-CB 4.08Å; F522-R527 CarbonylContact O-C 3.59Å; F522-R527 PolarHBondContact O-N 2.94Å
523	K	83.3	Confident	73.2	Confident	110 Å²	110	96.2 Å²	96.2	48%	0.478	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-48.2	169.9	-72.6	171.6	177.4	178.3	0	111.4	R519 T520 I525 G526	R519-K523 WeakPolarHBondContact O-CG 3.08Å; R519-K523 PolarHBondContact O-N 3.19Å; T520-K523 WeakPolarHBondContact O-CB 3.5Å; T520-K523 PolarHBondContact O-N 2.6Å; K523-I525 VanDerWaalsContact C-N 3.32Å; K523-I525 PolarHBondContact O-N 3.06Å; K523-G526 PolarHBondContact O-N 2.9Å
524	I	88.3	Confident	70.8	Confident	123 Å²	123	105.7 Å²	105.7	63%	0.631	50%	0.504	S	S	*	.	H	α-helix	trans	-61.3	-40.5	180	-68.8	165.5	0	0	0	111.1	T520 W521 G526	T520-I524 HydrophobicContact CG2-CD1 3.89Å; T520-I524 WeakPolarHBondContact O-CG1 3.35Å; T520-I524 PolarHBondContact O-N 2.98Å; W521-I524 PolarHBondContact O-N 2.95Å; I524-G526 PolarHBondContact O-N 3.28Å
525	I	86.8	Confident	68.9	Low	84 Å²	84	102.7 Å²	102.7	43%	0.431	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	0.7	177	-71.9	175.8	0	0	0	112.8	W521 K523 R527	W521-I525 HydrophobicContact CD2-CD1 4.09Å; W521-I525 HydrophobicContact CG-CD1 4.2Å; W521-I525 HydrophobicContact CZ2-CD1 4.02Å; W521-I525 VanDerWaalsContact NE1-CD1 3.31Å; W521-I525 WeakPolarHBondContact O-CB 3.41Å; W521-I525 WeakPolarHBondContact O-CG1 3.34Å; W521-I525 PolarHBondContact O-N 3.37Å; K523-I525 VanDerWaalsContact C-N 3.32Å; K523-I525 PolarHBondContact O-N 3.06Å; I525-R527 HydrophobicContact CG2-CB 4.39Å; I525-R527 HydrophobicContact CG2-CG 4.06Å; I525-R527 PolarHBondContact O-N 3.48Å; I525-R527 VanDerWaalsContact O-N 3.09Å
526	G	71.1	Confident	66.9	Low	58 Å²	58	107.7 Å²	107.7	60%	0.598	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	2.1	-178.6	0	0	0	0	0	114.5	F522 K523 I524 S528	F522-G526 PolarHBondContact O-N 3.1Å; K523-G526 PolarHBondContact O-N 2.9Å; I524-G526 PolarHBondContact O-N 3.28Å; G526-S528 VanDerWaalsContact C-N 3.25Å; G526-S528 PolarHBondContact O-N 3.38Å
527	R	62.2	Low	65.1	Low	176 Å²	176	115 Å²	115	66%	0.664	55%	0.545	S	S	*	.			trans	-81.7	72.7	172.7	-77	-175.8	-179.8	-166.7	2.4	109.6	F522 I525 D529	F522-R527 HydrophobicContact CD1-CB 4.08Å; F522-R527 CarbonylContact O-C 3.59Å; F522-R527 PolarHBondContact O-N 2.94Å; I525-R527 HydrophobicContact CG2-CB 4.39Å; I525-R527 HydrophobicContact CG2-CG 4.06Å; I525-R527 PolarHBondContact O-N 3.48Å; I525-R527 VanDerWaalsContact O-N 3.09Å; R527-D529 PolarHBondContact O-N 3.24Å
528	S	49.1	Very low	63.5	Low	88 Å²	88	114.6 Å²	114.6	62%	0.615	56%	0.556	S	S	*	*			trans	-66.9	86.5	176.8	51.5	0	0	0	0	112	G526 N530	G526-S528 VanDerWaalsContact C-N 3.25Å; G526-S528 PolarHBondContact O-N 3.38Å; S528-N530 PolarHBondContact O-N 3.01Å
529	D	48.8	Very low	62	Low	112 Å²	112	117.2 Å²	117.2	60%	0.599	57%	0.567	S	S	*	*			trans	-70.4	37	162.2	-162.1	33.3	0	0	0	110.9	R527 K533	R527-D529 PolarHBondContact O-N 3.24Å; D529-K533 VanDerWaalsContact CG-NZ 3.34Å; D529-K533 IonicContact OD1-NZ 3.99Å; D529-K533 PolarHBondContact OD1-NZ 3.28Å; D529-K533 IonicContact OD2-NZ 3.82Å; D529-K533 PolarHBondContact OD2-NZ 3.27Å
530	N	45.6	Very low	60.7	Low	104 Å²	104	118.2 Å²	118.2	56%	0.556	58%	0.576	S	S	*	*			trans	-104.1	23.3	-179.7	-87.4	8.1	0	0	0	111.2	S528 P532	S528-N530 PolarHBondContact O-N 3.01Å; N530-P532 VanDerWaalsContact O-CD 3.23Å; N530-P532 WeakPolarHBondContact O-CD 3.45Å
531	E	36.3	Very low	59.1	Low	152 Å²	152	120.6 Å²	120.6	71%	0.71	59%	0.588	S	S	*	*	S	Bend	trans	-74.3	110.7	147.3	-169.4	175.6	178	0	0	105.8	K533	E531-K533 PolarHBondContact O-N 2.97Å
532	P	40.8	Very low	58.1	Low	107 Å²	107	115.8 Å²	115.8	70%	0.695	58%	0.581	S	S	*	*			trans	-57	123.5	174.5	25.2	-32.9	0	0	0	106.5	N530 R534	N530-P532 VanDerWaalsContact O-CD 3.23Å; N530-P532 WeakPolarHBondContact O-CD 3.45Å; P532-R534 WeakPolarHBondContact O-CA 3.31Å; P532-R534 PolarHBondContact O-N 2.93Å
533	K	41.9	Very low	56.9	Low	158 Å²	158	119.2 Å²	119.2	69%	0.687	60%	0.596	S	S	*	*			trans	-66	76.1	-173.8	-83.7	169.8	177	125.5	0	110.4	D529 E531 I535	D529-K533 VanDerWaalsContact CG-NZ 3.34Å; D529-K533 IonicContact OD1-NZ 3.99Å; D529-K533 PolarHBondContact OD1-NZ 3.28Å; D529-K533 IonicContact OD2-NZ 3.82Å; D529-K533 PolarHBondContact OD2-NZ 3.27Å; E531-K533 PolarHBondContact O-N 2.97Å; K533-I535 PolarHBondContact O-N 3.1Å
534	R	39.7	Very low	55.6	Low	205 Å²	205	116.1 Å²	116.1	77%	0.774	59%	0.591	S	S	*	*			trans	-54.9	106.3	-169.6	-168.4	179.9	-163.3	172.6	9.2	106.6	P532 K536	P532-R534 WeakPolarHBondContact O-CA 3.31Å; P532-R534 PolarHBondContact O-N 2.93Å; R534-K536 PolarHBondContact O-N 2.95Å
535	I	50	Low	54.3	Low	83 Å²	83	115.7 Å²	115.7	43%	0.426	59%	0.585	S	S	.	*			trans	-48.5	109.3	-174	-60.1	174.3	0	0	0	106.5	K533 K537 K539 M540	K533-I535 PolarHBondContact O-N 3.1Å; I535-K537 PolarHBondContact O-N 3.36Å; I535-K537 VanDerWaalsContact O-N 3.17Å; I535-K539 HydrophobicContact CG2-CB 3.72Å; I535-M540 HydrophobicContact CB-CE 4.48Å; I535-M540 HydrophobicContact CG2-CB 4.16Å
536	K	46.1	Very low	53.2	Low	166 Å²	166	114.5 Å²	114.5	72%	0.722	59%	0.588	S	S	*	*			trans	-48.1	130.7	-173	-79	-171.7	175.6	-177.7	0	106.8	R534 S538 K539 M540	R534-K536 PolarHBondContact O-N 2.95Å; K536-S538 CarbonylContact O-C 3.51Å; K536-S538 PolarHBondContact O-N 3.25Å; K536-K539 PolarHBondContact O-N 3.38Å; K536-M540 PolarHBondContact O-N 3.44Å
537	K	51.1	Low	52.5	Low	161 Å²	161	114 Å²	114	70%	0.7	57%	0.571	S	S	*	*	H	α-helix	trans	-49.7	-34.1	-168.5	-67	-174.3	178.5	-176.9	0	112	I535 M540 I541	I535-K537 PolarHBondContact O-N 3.36Å; I535-K537 VanDerWaalsContact O-N 3.17Å; K537-M540 PolarHBondContact O-N 3.24Å; K537-I541 HydrophobicContact CB-CD1 4.4Å; K537-I541 VanDerWaalsContact O-CB 3.29Å; K537-I541 WeakPolarHBondContact O-CB 3.37Å; K537-I541 WeakPolarHBondContact O-CD1 3.25Å; K537-I541 WeakPolarHBondContact O-CG1 3.06Å; K537-I541 PolarHBondContact O-N 2.91Å
538	S	57.8	Low	52.2	Low	81 Å²	81	110.2 Å²	110.2	57%	0.566	56%	0.556	S	S	*	*	H	α-helix	trans	-55.1	-42.6	170	50.9	0	0	0	0	115.9	K536 A542	K536-S538 CarbonylContact O-C 3.51Å; K536-S538 PolarHBondContact O-N 3.25Å; S538-A542 WeakPolarHBondContact O-CB 3.48Å; S538-A542 PolarHBondContact O-N 3.33Å
539	K	57.7	Low	52.6	Low	158 Å²	158	114.3 Å²	114.3	69%	0.687	56%	0.563	S	S	*	*	H	α-helix	trans	-69.5	-38.1	175.2	-84.8	-162.9	173.3	-168.9	0	112.7	I535 K536 A542 K543	I535-K539 HydrophobicContact CG2-CB 3.72Å; K536-K539 PolarHBondContact O-N 3.38Å; K539-A542 PolarHBondContact O-N 3.17Å; K539-K543 PolarHBondContact O-N 2.99Å
540	M	56.7	Low	53	Low	100 Å²	100	115 Å²	115	49%	0.493	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-45.5	175.9	-173.9	-177.8	-76	0	0	110.6	I535 K536 K537 K543 A544	I535-M540 HydrophobicContact CB-CE 4.48Å; I535-M540 HydrophobicContact CG2-CB 4.16Å; K536-M540 PolarHBondContact O-N 3.44Å; K537-M540 PolarHBondContact O-N 3.24Å; M540-K543 PolarHBondContact O-N 2.8Å; M540-A544 PolarHBondContact O-N 3.49Å; M540-A544 VanDerWaalsContact O-N 3.13Å
541	I	56.6	Low	53.1	Low	74 Å²	74	113.8 Å²	113.8	38%	0.379	56%	0.556	S	S	.	*	H	α-helix	trans	-60.8	-45.7	172.8	-70.2	166.1	0	0	0	110.7	K537 K543 A544 F545	K537-I541 HydrophobicContact CB-CD1 4.4Å; K537-I541 VanDerWaalsContact O-CB 3.29Å; K537-I541 WeakPolarHBondContact O-CB 3.37Å; K537-I541 WeakPolarHBondContact O-CD1 3.25Å; K537-I541 WeakPolarHBondContact O-CG1 3.06Å; K537-I541 PolarHBondContact O-N 2.91Å; I541-K543 VanDerWaalsContact C-N 3.34Å; I541-K543 PolarHBondContact O-N 2.95Å; I541-A544 PolarHBondContact O-N 3.14Å; I541-F545 HydrophobicContact CG2-CD2 3.6Å; I541-F545 HydrophobicContact CG2-CE2 3.79Å; I541-F545 WeakPolarHBondContact O-CD2 3.21Å; I541-F545 PolarHBondContact O-N 2.61Å
542	A	65.3	Low	54	Low	57 Å²	57	113.2 Å²	113.2	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-38	178.7	0	0	0	0	0	112.7	S538 K539 F545 A546	S538-A542 WeakPolarHBondContact O-CB 3.48Å; S538-A542 PolarHBondContact O-N 3.33Å; K539-A542 PolarHBondContact O-N 3.17Å; A542-F545 PolarHBondContact O-N 3.36Å; A542-A546 WeakPolarHBondContact O-CB 3.34Å; A542-A546 PolarHBondContact O-N 3.03Å
543	K	58.8	Low	54.8	Low	147 Å²	147	116.3 Å²	116.3	64%	0.639	56%	0.555	S	S	*	*	H	α-helix	trans	-65	-42.7	174.1	-167.1	178.6	179	-172.9	0	111.4	K539 M540 I541 A546 M547	K539-K543 PolarHBondContact O-N 2.99Å; M540-K543 PolarHBondContact O-N 2.8Å; I541-K543 VanDerWaalsContact C-N 3.34Å; I541-K543 PolarHBondContact O-N 2.95Å; K543-A546 PolarHBondContact O-N 2.87Å; K543-M547 HydrophobicContact CG-SD 4.22Å; K543-M547 WeakPolarHBondContact O-CG 3.4Å; K543-M547 PolarHBondContact O-N 3.08Å
544	A	57.8	Low	55.3	Low	45 Å²	45	112.3 Å²	112.3	37%	0.372	54%	0.541	S	S	.	.	H	α-helix	trans	-63.8	-42.2	175.1	0	0	0	0	0	112.8	M540 I541 A546 M547 R548	M540-A544 PolarHBondContact O-N 3.49Å; M540-A544 VanDerWaalsContact O-N 3.13Å; I541-A544 PolarHBondContact O-N 3.14Å; A544-A546 VanDerWaalsContact C-N 3.33Å; A544-A546 PolarHBondContact O-N 3.16Å; A544-M547 PolarHBondContact O-N 2.88Å; A544-R548 PolarHBondContact O-N 3.2Å
545	F	59.8	Low	55.9	Low	113 Å²	113	108.1 Å²	108.1	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-69.3	-26.2	175.5	-91.1	-84.9	0	0	0	113.7	I541 A542	I541-F545 HydrophobicContact CG2-CD2 3.6Å; I541-F545 HydrophobicContact CG2-CE2 3.79Å; I541-F545 WeakPolarHBondContact O-CD2 3.21Å; I541-F545 PolarHBondContact O-N 2.61Å; A542-F545 PolarHBondContact O-N 3.36Å
546	A	64.1	Low	55.7	Low	60 Å²	60	113.4 Å²	113.4	50%	0.496	56%	0.564	S	S	.	*	H	α-helix	trans	-68.9	-51.9	170.1	0	0	0	0	0	110.8	A542 K543 A544 R548 K549	A542-A546 WeakPolarHBondContact O-CB 3.34Å; A542-A546 PolarHBondContact O-N 3.03Å; K543-A546 PolarHBondContact O-N 2.87Å; A544-A546 VanDerWaalsContact C-N 3.33Å; A544-A546 PolarHBondContact O-N 3.16Å; A546-R548 PolarHBondContact O-N 2.92Å; A546-K549 PolarHBondContact O-N 2.86Å
547	M	56	Low	55.6	Low	48 Å²	48	111.3 Å²	111.3	24%	0.236	55%	0.554	C	S	.	*	H	α-helix	trans	-64.7	-23.6	-179.9	-62.7	177	83.6	0	0	112.7	K543 A544 K549 E550 L551 L559	K543-M547 HydrophobicContact CG-SD 4.22Å; K543-M547 WeakPolarHBondContact O-CG 3.4Å; K543-M547 PolarHBondContact O-N 3.08Å; A544-M547 PolarHBondContact O-N 2.88Å; M547-K549 PolarHBondContact O-N 3.34Å; M547-E550 WeakPolarHBondContact O-CB 3.49Å; M547-E550 PolarHBondContact O-N 3.49Å; M547-L551 PolarHBondContact O-N 3.17Å; M547-L559 HydrophobicContact CE-CD1 4.31Å; M547-L559 HydrophobicContact CE-CD2 4.46Å
548	R	56.5	Low	55.1	Low	95 Å²	95	112.7 Å²	112.7	36%	0.358	56%	0.563	S	S	.	*	H	α-helix	trans	-55.9	-31.5	168.9	-180	174.9	176.1	165	4	113.3	A544 A546 E550 H552 G602	A544-R548 PolarHBondContact O-N 3.2Å; A546-R548 PolarHBondContact O-N 2.92Å; R548-E550 VanDerWaalsContact C-N 3.32Å; R548-H552 PolarHBondContact O-CD2 3.38Å; R548-H552 VanDerWaalsContact O-CD2 3.31Å; R548-H552 PolarHBondContact O-N 2.97Å; R548-H552 VanDerWaalsContact O-N 3.15Å; R548-G602 PolarHBondContact NH1-O 3.05Å
549	K	56.5	Low	54.4	Low	175 Å²	175	112.7 Å²	112.7	76%	0.761	56%	0.556	S	S	*	*	H	α-helix	trans	-75.3	-20.4	175.1	-75.8	-167.1	172.6	-170.6	0	113.5	A546 M547	A546-K549 PolarHBondContact O-N 2.86Å; M547-K549 PolarHBondContact O-N 3.34Å
550	E	57.2	Low	53.4	Low	125 Å²	125	110.5 Å²	110.5	58%	0.584	56%	0.561	S	S	*	*	H	α-helix	trans	-83.7	-43.4	176	-59.6	173.2	139	0	0	109.8	M547 R548 H552 K553 D554	M547-E550 WeakPolarHBondContact O-CB 3.49Å; M547-E550 PolarHBondContact O-N 3.49Å; R548-E550 VanDerWaalsContact C-N 3.32Å; E550-H552 VanDerWaalsContact C-N 3.32Å; E550-H552 PolarHBondContact O-N 3.2Å; E550-K553 WeakPolarHBondContact O-CA 3.21Å; E550-K553 WeakPolarHBondContact O-CB 3.47Å; E550-K553 PolarHBondContact O-N 3.47Å; E550-D554 PolarHBondContact O-N 3.46Å; E550-D554 VanDerWaalsContact O-N 3.17Å
551	L	49	Very low	52.3	Low	79 Å²	79	113.8 Å²	113.8	41%	0.414	57%	0.573	S	S	.	*	H	α-helix	trans	-59.9	-34.9	172.1	-81.8	157	0	0	0	113.8	M547 K553 L559	M547-L551 PolarHBondContact O-N 3.17Å; L551-K553 PolarHBondContact O-N 2.82Å; L551-L559 HydrophobicContact CD1-CD1 4.11Å; L551-L559 HydrophobicContact CD2-CD1 4.14Å; L551-L559 HydrophobicContact CG-CD1 4.04Å
552	H	55.1	Low	51.3	Low	141 Å²	141	114.2 Å²	114.2	65%	0.653	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-3.4	172.1	-90.8	-65.2	0	0	0	114	R548 E550	R548-H552 PolarHBondContact O-CD2 3.38Å; R548-H552 VanDerWaalsContact O-CD2 3.31Å; R548-H552 PolarHBondContact O-N 2.97Å; R548-H552 VanDerWaalsContact O-N 3.15Å; E550-H552 VanDerWaalsContact C-N 3.32Å; E550-H552 PolarHBondContact O-N 3.2Å
553	K	57.8	Low	49.9	Very low	172 Å²	172	116.7 Å²	116.7	75%	0.748	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-38.3	-177.3	-152.1	-177	-177.8	-167	0	112.9	E550 L551	E550-K553 WeakPolarHBondContact O-CA 3.21Å; E550-K553 WeakPolarHBondContact O-CB 3.47Å; E550-K553 PolarHBondContact O-N 3.47Å; L551-K553 PolarHBondContact O-N 2.82Å
554	D	52.5	Low	48.6	Very low	74 Å²	74	115.9 Å²	115.9	40%	0.396	58%	0.584	S	S	.	*			trans	-124.5	100.1	173.3	-61.6	-25.7	0	0	0	109.3	E550 K557	E550-D554 PolarHBondContact O-N 3.46Å; E550-D554 VanDerWaalsContact O-N 3.17Å; D554-K557 HydrophobicContact CB-CB 4.15Å; D554-K557 HydrophobicContact CB-CD 4.09Å; D554-K557 IonicContact OD2-NZ 2.72Å; D554-K557 PolarHBondContact OD2-NZ 3.17Å
555	P	52.5	Low	47.2	Very low	116 Å²	116	119.2 Å²	119.2	75%	0.753	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-25	-173.4	28.2	-34.3	0	0	0	114.8	K557	P555-K557 PolarHBondContact O-N 3.44Å
556	E	44.7	Very low	45.8	Very low	195 Å²	195	119.6 Å²	119.6	91%	0.911	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	13.5	-177	-58.3	-167.6	157.8	0	0	113.9	E558	E556-E558 PolarHBondContact O-N 3.48Å
557	K	44.8	Very low	44.1	Very low	121 Å²	121	120.8 Å²	120.8	53%	0.526	62%	0.616	S	S	.	*			trans	-97.8	90	-168.6	-155.8	175.8	-145.4	156.5	0	111.8	D554 P555	D554-K557 HydrophobicContact CB-CB 4.15Å; D554-K557 HydrophobicContact CB-CD 4.09Å; D554-K557 IonicContact OD2-NZ 2.72Å; D554-K557 PolarHBondContact OD2-NZ 3.17Å; P555-K557 PolarHBondContact O-N 3.44Å
558	E	40.8	Very low	43	Very low	190 Å²	190	123.6 Å²	123.6	89%	0.888	63%	0.628	S	S	*	*			trans	-55.8	138.5	176.2	-66.8	-162.7	152.5	0	0	112.5	E556	E556-E558 PolarHBondContact O-N 3.48Å
559	L	42.9	Very low	41.8	Very low	81 Å²	81	125.4 Å²	125.4	42%	0.424	65%	0.645	S	S	.	*			trans	-132.6	104.3	-178.9	-77.8	174.3	0	0	0	111.5	M547 L551 F561	M547-L559 HydrophobicContact CE-CD1 4.31Å; M547-L559 HydrophobicContact CE-CD2 4.46Å; L551-L559 HydrophobicContact CD1-CD1 4.11Å; L551-L559 HydrophobicContact CD2-CD1 4.14Å; L551-L559 HydrophobicContact CG-CD1 4.04Å; L559-F561 PolarHBondContact O-N 3.08Å
560	S	36	Very low	41	Very low	113 Å²	113	118.2 Å²	118.2	79%	0.79	62%	0.621	S	S	*	*			trans	-74.7	114.8	170.9	56	0	0	0	0	111.1	S562	S560-S562 PolarHBondContact O-N 3.29Å
561	F	33.2	Very low	39.9	Very low	169 Å²	169	114.7 Å²	114.7	74%	0.741	61%	0.608	S	S	*	*			trans	-74.8	70.2	175.6	-88.5	-91.2	0	0	0	111.7	L559 M563	L559-F561 PolarHBondContact O-N 3.08Å; F561-M563 PolarHBondContact O-N 3.09Å; F561-M563 VanDerWaalsContact O-N 3.14Å
562	S	35.7	Very low	39.5	Very low	82 Å²	82	111.3 Å²	111.3	57%	0.573	59%	0.591	S	S	*	*			trans	-66.2	113.9	170	70.3	0	0	0	0	110	S560 H564	S560-S562 PolarHBondContact O-N 3.29Å; S562-H564 PolarHBondContact O-N 2.94Å; S562-H564 PolarHBondContact OG-ND1 3.2Å; S562-H564 VanDerWaalsContact OG-ND1 3.16Å
563	M	36	Very low	39	Very low	110 Å²	110	105.9 Å²	105.9	54%	0.542	57%	0.57	S	S	.	*			trans	-78	76.8	178.1	-172.7	171.2	62.9	0	0	109.9	F561 T565 V586 W590	F561-M563 PolarHBondContact O-N 3.09Å; F561-M563 VanDerWaalsContact O-N 3.14Å; M563-T565 PolarHBondContact O-N 3.3Å; M563-V586 HydrophobicContact CE-CG1 3.54Å; M563-W590 HydrophobicContact CE-CZ3 4.47Å; M563-W590 HydrophobicContact SD-CH2 4.3Å; M563-W590 HydrophobicContact SD-CZ3 4.32Å
564	H	30.9	Very low	37.9	Very low	130 Å²	130	99.3 Å²	99.3	60%	0.602	55%	0.551	S	S	*	*			trans	-58.8	98.1	169	-86.4	61.8	0	0	0	109.9	S562 V566	S562-H564 PolarHBondContact O-N 2.94Å; S562-H564 PolarHBondContact OG-ND1 3.2Å; S562-H564 VanDerWaalsContact OG-ND1 3.16Å; H564-V566 PolarHBondContact O-N 3.1Å
565	T	29.5	Very low	37.1	Very low	115 Å²	115	99.9 Å²	99.9	71%	0.706	55%	0.554	S	S	*	*			trans	-54.8	133.8	151.2	47.1	0	0	0	0	107.6	M563 S567	M563-T565 PolarHBondContact O-N 3.3Å; T565-S567 PolarHBondContact O-N 3.09Å
566	V	29.7	Very low	36.1	Very low	121 Å²	121	100.3 Å²	100.3	73%	0.733	55%	0.55	S	S	*	.			trans	-76	75	178.6	-172.8	0	0	0	0	109.2	H564	H564-V566 PolarHBondContact O-N 3.1Å
567	S	30	Very low	35.4	Very low	84 Å²	84	95.7 Å²	95.7	59%	0.587	53%	0.527	S	S	*	.			trans	-59	143.3	149.4	-166.5	0	0	0	0	107.4	T565 D569	T565-S567 PolarHBondContact O-N 3.09Å; S567-D569 PolarHBondContact O-N 3.05Å
568	H	32.4	Very low	34.5	Very low	107 Å²	107	95.9 Å²	95.9	50%	0.495	53%	0.534	S	S	.	.			trans	-72	132.8	-173.8	-81.8	-113.8	0	0	0	110.7	G570	H568-G570 PolarHBondContact O-N 3.36Å
569	D	31.6	Very low	34.1	Very low	134 Å²	134	93.3 Å²	93.3	72%	0.717	53%	0.525	S	S	*	.			trans	-55.4	107.6	161	-95.3	-42.4	0	0	0	109.7	K416 S567	K416-D569 VanDerWaalsContact NZ-CG 3.34Å; K416-D569 IonicContact NZ-OD1 3.82Å; K416-D569 PolarHBondContact NZ-OD1 3.14Å; K416-D569 IonicContact NZ-OD2 2.77Å; S567-D569 PolarHBondContact O-N 3.05Å
570	G	38.4	Very low	33.7	Very low	24 Å²	24	97.1 Å²	97.1	25%	0.247	55%	0.546	C	S	.	.			trans	-157.4	128.2	-176.4	0	0	0	0	0	111.6	H568 V572	H568-G570 PolarHBondContact O-N 3.36Å; G570-V572 PolarHBondContact O-N 3Å
571	P	35.1	Very low	33.2	Very low	51 Å²	51	100 Å²	100	33%	0.331	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	13.2	-164.8	29.5	-38.1	0	0	0	116.2	T420 T510	T420-P571 HydrophobicContact CG2-CB 4.43Å; T510-P571 HydrophobicContact CG2-CG 4.17Å
572	V	40.5	Very low	33	Very low	7 Å²	7	97.1 Å²	97.1	4%	0.042	55%	0.545	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-25.4	179.3	-178.7	0	0	0	0	111.8	A512 I516 G570	A512-V572 HydrophobicContact CB-CG2 4.14Å; I516-V572 HydrophobicContact CD1-CG2 4.37Å; G570-V572 PolarHBondContact O-N 3Å
573	A	43.6	Very low	32.8	Very low	27 Å²	27	97 Å²	97	22%	0.223	54%	0.544	C	S	.	.	S	Bend	trans	-137.9	81.1	172.4	0	0	0	0	0	110.6	I575	A573-I575 VanDerWaalsContact C-N 3.28Å; A573-I575 PolarHBondContact O-N 3.29Å
574	G	36.1	Very low	32.7	Very low	34 Å²	34	99.8 Å²	99.8	35%	0.351	56%	0.561	S	S	.	*			trans	-79	8.7	-174.2	0	0	0	0	0	116.8
575	I	35.8	Very low	32.9	Very low	86 Å²	86	101.3 Å²	101.3	44%	0.441	57%	0.574	S	S	.	*			trans	-112.8	95.1	-173.2	-49.7	177.8	0	0	0	109.6	P235 A573 F577	P235-I575 HydrophobicContact CG-CD1 4.45Å; A573-I575 VanDerWaalsContact C-N 3.28Å; A573-I575 PolarHBondContact O-N 3.29Å; I575-F577 HydrophobicContact CG2-CB 4.46Å
576	N	29.7	Very low	33.4	Very low	125 Å²	125	98.4 Å²	98.4	67%	0.668	56%	0.556	S	S	*	*			trans	-97.1	93.1	163.2	-92.7	6.2	0	0	0	108.6
577	F	30.3	Very low	33.9	Very low	99 Å²	99	96.4 Å²	96.4	43%	0.434	55%	0.548	S	S	.	.			trans	-137.4	83.1	168.2	-113.4	-73.4	0	0	0	109.4	Q323 I575	Q323-F577 PolarHBondContact NE2-O 3.3Å; Q323-F577 VanDerWaalsContact NE2-O 3.1Å; I575-F577 HydrophobicContact CG2-CB 4.46Å
578	D	26.8	Very low	34.9	Very low	125 Å²	125	96.7 Å²	96.7	67%	0.668	55%	0.549	S	S	*	.			trans	-138.2	119.3	158.9	-77.9	-54	0	0	0	108.9	Q323	Q323-D578 PolarHBondContact NE2-OD1 2.96Å
579	L	32.4	Very low	35.6	Very low	135 Å²	135	93.7 Å²	93.7	71%	0.707	54%	0.543	S	S	*	.			trans	-102.6	125.7	166.1	-83.8	161.8	0	0	0	106.6
580	N	34	Very low	36.2	Very low	162 Å²	162	93.6 Å²	93.6	87%	0.866	53%	0.533	S	S	*	.			trans	58.9	69.4	174.4	-62.9	-12.3	0	0	0	116.7
581	E	25.6	Very low	36.9	Very low	172 Å²	172	95 Å²	95	80%	0.804	54%	0.543	S	S	*	.			trans	-118.8	121.3	142.6	-166.7	176.9	-131.5	0	0	109.1	S583	E581-S583 PolarHBondContact O-N 2.86Å
582	P	29.2	Very low	37.8	Very low	109 Å²	109	98.5 Å²	98.5	71%	0.708	56%	0.558	S	S	*	*			trans	-78.3	108.1	179.2	30.5	-32.1	0	0	0	110.1	N584	P582-N584 PolarHBondContact O-N 3.38Å
583	S	31.7	Very low	38.1	Very low	80 Å²	80	103.3 Å²	103.3	56%	0.559	58%	0.58	S	S	*	*			trans	-64.4	127	-177.4	53	0	0	0	0	112.6	E581 D585 V586	E581-S583 PolarHBondContact O-N 2.86Å; S583-D585 PolarHBondContact O-N 2.9Å; S583-V586 WeakPolarHBondContact O-CG2 3.47Å; S583-V586 PolarHBondContact O-N 2.83Å
584	N	34.3	Very low	38.5	Very low	168 Å²	168	104.1 Å²	104.1	90%	0.898	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-3.3	-173.5	-78.3	-41.6	0	0	0	115.7	P582 V586	P582-N584 PolarHBondContact O-N 3.38Å; N584-V586 VanDerWaalsContact C-N 3.33Å
585	D	35.1	Very low	39.3	Very low	163 Å²	163	105.7 Å²	105.7	87%	0.872	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-2.8	176.7	-76	-36.1	0	0	0	114.2	S583	S583-D585 PolarHBondContact O-N 2.9Å
586	V	39.1	Very low	40.1	Very low	53 Å²	53	108.7 Å²	108.7	32%	0.321	60%	0.595	S	S	.	*	S	Bend	trans	-103.2	113.1	167.5	-71.3	0	0	0	0	111.5	M563 S583 N584 S588 W590	M563-V586 HydrophobicContact CE-CG1 3.54Å; S583-V586 WeakPolarHBondContact O-CG2 3.47Å; S583-V586 PolarHBondContact O-N 2.83Å; N584-V586 VanDerWaalsContact C-N 3.33Å; V586-S588 PolarHBondContact O-N 3.48Å; V586-W590 HydrophobicContact CG1-CE3 4.49Å
587	S	40	Very low	41.2	Very low	80 Å²	80	108.1 Å²	108.1	56%	0.559	59%	0.59	S	S	*	*			trans	-53.1	126.4	170.5	177	0	0	0	0	110.3	A589 W590 A591	S587-A589 PolarHBondContact O-N 3.46Å; S587-A589 VanDerWaalsContact O-N 3.16Å; S587-W590 WeakPolarHBondContact O-CA 3.38Å; S587-W590 WeakPolarHBondContact O-CB 3.35Å; S587-W590 PolarHBondContact O-N 2.88Å; S587-A591 PolarHBondContact O-N 3.37Å
588	S	51.4	Low	42.3	Very low	89 Å²	89	106 Å²	106	62%	0.622	59%	0.585	S	S	*	*	H	α-helix	trans	-52.8	-37	-179.3	53.8	0	0	0	0	112.8	V586 W590 A591 L592	V586-S588 PolarHBondContact O-N 3.48Å; S588-W590 VanDerWaalsContact C-N 3.31Å; S588-W590 PolarHBondContact O-N 3.13Å; S588-A591 PolarHBondContact O-N 2.94Å; S588-L592 WeakPolarHBondContact O-CB 3.29Å; S588-L592 WeakPolarHBondContact O-CG 3.21Å; S588-L592 PolarHBondContact O-N 2.92Å
589	A	47.2	Very low	43.7	Very low	45 Å²	45	102 Å²	102	37%	0.372	57%	0.569	S	S	.	*	H	α-helix	trans	-60.8	-35.8	173.5	0	0	0	0	0	112.9	S587 H593	S587-A589 PolarHBondContact O-N 3.46Å; S587-A589 VanDerWaalsContact O-N 3.16Å; A589-H593 WeakPolarHBondContact O-CB 3.24Å; A589-H593 PolarHBondContact O-CD2 2.88Å; A589-H593 PolarHBondContact O-N 3.03Å
590	W	44.8	Very low	44.6	Very low	132 Å²	132	106.7 Å²	106.7	50%	0.5	58%	0.578	S	S	.	*	H	α-helix	trans	-68.6	-45.4	176.1	-169.7	77.3	0	0	0	111.3	M563 V586 S587 S588 L592 H593 V594	M563-W590 HydrophobicContact CE-CZ3 4.47Å; M563-W590 HydrophobicContact SD-CH2 4.3Å; M563-W590 HydrophobicContact SD-CZ3 4.32Å; V586-W590 HydrophobicContact CG1-CE3 4.49Å; S587-W590 WeakPolarHBondContact O-CA 3.38Å; S587-W590 WeakPolarHBondContact O-CB 3.35Å; S587-W590 PolarHBondContact O-N 2.88Å; S588-W590 VanDerWaalsContact C-N 3.31Å; S588-W590 PolarHBondContact O-N 3.13Å; W590-L592 PolarHBondContact O-N 3Å; W590-H593 PolarHBondContact O-N 3.45Å; W590-V594 HydrophobicContact CD2-CG2 3.75Å; W590-V594 VanDerWaalsContact CE2-CG2 3.5Å; W590-V594 HydrophobicContact CE3-CG2 3.99Å; W590-V594 HydrophobicContact CG-CG2 4.41Å; W590-V594 HydrophobicContact CH2-CG2 3.81Å; W590-V594 HydrophobicContact CZ2-CG2 3.54Å; W590-V594 HydrophobicContact CZ3-CG2 4.02Å; W590-V594 WeakPolarHBondContact O-CG2 3.39Å; W590-V594 PolarHBondContact O-N 3.35Å
591	A	53.2	Low	45.4	Very low	54 Å²	54	107.9 Å²	107.9	45%	0.446	57%	0.57	S	S	.	*	H	α-helix	trans	-58.2	-46	175.4	0	0	0	0	0	111.8	S587 S588 H593 P595	S587-A591 PolarHBondContact O-N 3.37Å; S588-A591 PolarHBondContact O-N 2.94Å; A591-H593 VanDerWaalsContact C-N 3.33Å; A591-H593 PolarHBondContact O-N 3.33Å; A591-P595 WeakPolarHBondContact O-CD 3.15Å
592	L	53.2	Low	46.5	Very low	124 Å²	124	102 Å²	102	65%	0.649	56%	0.556	S	S	*	*	H	α-helix	trans	-64.8	-30.1	177.2	-75	165.3	0	0	0	114	S588 W590	S588-L592 WeakPolarHBondContact O-CB 3.29Å; S588-L592 WeakPolarHBondContact O-CG 3.21Å; S588-L592 PolarHBondContact O-N 2.92Å; W590-L592 PolarHBondContact O-N 3Å
593	H	47	Very low	47.7	Very low	108 Å²	108	99 Å²	99	50%	0.5	54%	0.54	S	S	.	.	H	α-helix	trans	-94.5	-17.2	-177.6	-72.6	-51.6	0	0	0	114.9	A589 W590 A591 K596 M597	A589-H593 WeakPolarHBondContact O-CB 3.24Å; A589-H593 PolarHBondContact O-CD2 2.88Å; A589-H593 PolarHBondContact O-N 3.03Å; W590-H593 PolarHBondContact O-N 3.45Å; A591-H593 VanDerWaalsContact C-N 3.33Å; A591-H593 PolarHBondContact O-N 3.33Å; H593-K596 PolarHBondContact O-N 3.42Å; H593-M597 WeakPolarHBondContact O-CB 3.38Å; H593-M597 PolarHBondContact O-N 2.71Å
594	V	51.6	Low	48.3	Very low	44 Å²	44	98.8 Å²	98.8	27%	0.267	53%	0.532	S	S	.	.	H	α-helix	trans	-59.2	-50.8	176.7	160.6	0	0	0	0	112.6	W590 K596 M597 V598	W590-V594 HydrophobicContact CD2-CG2 3.75Å; W590-V594 VanDerWaalsContact CE2-CG2 3.5Å; W590-V594 HydrophobicContact CE3-CG2 3.99Å; W590-V594 HydrophobicContact CG-CG2 4.41Å; W590-V594 HydrophobicContact CH2-CG2 3.81Å; W590-V594 HydrophobicContact CZ2-CG2 3.54Å; W590-V594 HydrophobicContact CZ3-CG2 4.02Å; W590-V594 WeakPolarHBondContact O-CG2 3.39Å; W590-V594 PolarHBondContact O-N 3.35Å; V594-K596 VanDerWaalsContact C-N 3.33Å; V594-K596 PolarHBondContact O-N 3.31Å; V594-M597 PolarHBondContact O-N 3.14Å; V594-V598 HydrophobicContact CG1-CG2 4.27Å; V594-V598 WeakPolarHBondContact O-CG2 3.41Å; V594-V598 PolarHBondContact O-N 2.9Å
595	P	52.7	Low	48.8	Very low	66 Å²	66	96.6 Å²	96.6	43%	0.429	52%	0.519	S	S	.	.	H	α-helix	trans	-56.9	-45	178	-26.6	35.2	0	0	0	112.5	A591 M597 V598 A599	A591-P595 WeakPolarHBondContact O-CD 3.15Å; P595-M597 VanDerWaalsContact C-N 3.3Å; P595-M597 PolarHBondContact O-N 2.63Å; P595-V598 PolarHBondContact O-N 3.5Å; P595-A599 WeakPolarHBondContact O-CB 3.43Å; P595-A599 PolarHBondContact O-N 3.1Å
596	K	52.7	Low	48.9	Very low	150 Å²	150	94.7 Å²	94.7	65%	0.652	52%	0.516	S	S	*	.	H	α-helix	trans	-63	-34	176.4	-67.4	-178.9	177.7	177.7	0	112.4	H593 V594 R600	H593-K596 PolarHBondContact O-N 3.42Å; V594-K596 VanDerWaalsContact C-N 3.33Å; V594-K596 PolarHBondContact O-N 3.31Å; K596-R600 WeakPolarHBondContact O-CB 3.17Å; K596-R600 PolarHBondContact O-N 3.41Å; K596-R600 VanDerWaalsContact O-N 3.08Å
597	M	52.5	Low	49	Very low	112 Å²	112	100.6 Å²	100.6	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-76.4	-27.5	177	-162.1	-178.8	-54.9	0	0	113.3	H593 V594 P595 R601	H593-M597 WeakPolarHBondContact O-CB 3.38Å; H593-M597 PolarHBondContact O-N 2.71Å; V594-M597 PolarHBondContact O-N 3.14Å; P595-M597 VanDerWaalsContact C-N 3.3Å; P595-M597 PolarHBondContact O-N 2.63Å; M597-R601 WeakPolarHBondContact O-CG 3.45Å
598	V	53.1	Low	48.9	Very low	55 Å²	55	102.8 Å²	102.8	33%	0.333	55%	0.545	S	S	.	.	H	α-helix	trans	-78.4	-46	174.7	172.5	0	0	0	0	110.7	V594 P595 R600 R601 A603 I604	V594-V598 HydrophobicContact CG1-CG2 4.27Å; V594-V598 WeakPolarHBondContact O-CG2 3.41Å; V594-V598 PolarHBondContact O-N 2.9Å; P595-V598 PolarHBondContact O-N 3.5Å; V598-R600 PolarHBondContact O-N 3.4Å; V598-R601 CarbonylContact O-C 3.45Å; V598-R601 PolarHBondContact O-N 3.01Å; V598-A603 HydrophobicContact CG1-CB 3.67Å; V598-A603 PolarHBondContact O-N 2.98Å; V598-I604 HydrophobicContact CB-CD1 4.35Å; V598-I604 HydrophobicContact CG1-CD1 3.75Å; V598-I604 HydrophobicContact CG1-CG1 3.94Å
599	A	56.1	Low	48.3	Very low	41 Å²	41	103.9 Å²	103.9	34%	0.339	54%	0.543	S	S	.	.	H	α-helix	trans	-59.5	-45.1	173.8	0	0	0	0	0	111.9	P595 R601 G602	P595-A599 WeakPolarHBondContact O-CB 3.43Å; P595-A599 PolarHBondContact O-N 3.1Å; A599-R601 PolarHBondContact O-N 3.22Å; A599-G602 PolarHBondContact O-N 3.47Å
600	R	52.3	Low	47.6	Very low	233 Å²	233	107.4 Å²	107.4	88%	0.879	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	0.7	174.6	-163.7	173.8	-179.6	-170.6	2	114.2	K596 V598	K596-R600 WeakPolarHBondContact O-CB 3.17Å; K596-R600 PolarHBondContact O-N 3.41Å; K596-R600 VanDerWaalsContact O-N 3.08Å; V598-R600 PolarHBondContact O-N 3.4Å
601	R	51	Low	46.9	Very low	187 Å²	187	106.7 Å²	106.7	71%	0.706	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	14.1	172.2	-70.8	-179.9	171.4	-122.2	-7	113.4	M597 V598 A599 A603	M597-R601 WeakPolarHBondContact O-CG 3.45Å; V598-R601 CarbonylContact O-C 3.45Å; V598-R601 PolarHBondContact O-N 3.01Å; A599-R601 PolarHBondContact O-N 3.22Å; R601-A603 PolarHBondContact O-N 3.31Å
602	G	47.7	Very low	45.6	Very low	49 Å²	49	110.2 Å²	110.2	51%	0.505	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	71.3	28.7	172.7	0	0	0	0	0	114.9	R548 A599	R548-G602 PolarHBondContact NH1-O 3.05Å; A599-G602 PolarHBondContact O-N 3.47Å
603	A	54.3	Low	44.7	Very low	45 Å²	45	109.9 Å²	109.9	37%	0.372	60%	0.596	S	S	.	*	S	Bend	trans	-105.9	-6.7	-178.8	0	0	0	0	0	114.5	V598 R601	V598-A603 HydrophobicContact CG1-CB 3.67Å; V598-A603 PolarHBondContact O-N 2.98Å; R601-A603 PolarHBondContact O-N 3.31Å
604	I	45	Very low	43.8	Very low	77 Å²	77	111.8 Å²	111.8	40%	0.395	62%	0.616	S	S	.	*	S	Bend	trans	-138.1	143.2	171.8	-60.7	168.7	0	0	0	106.4	V598	V598-I604 HydrophobicContact CB-CD1 4.35Å; V598-I604 HydrophobicContact CG1-CD1 3.75Å; V598-I604 HydrophobicContact CG1-CG1 3.94Å
605	L	43.8	Very low	42.8	Very low	122 Å²	122	113.1 Å²	113.1	64%	0.639	64%	0.639	S	S	*	*			trans	-85.3	155	177.2	-90.2	140	0	0	0	111.4	Q607	L605-Q607 PolarHBondContact O-N 3.45Å
606	P	37.4	Very low	41.6	Very low	122 Å²	122	116.5 Å²	116.5	79%	0.792	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	5.5	-169.5	-20.7	34.8	0	0	0	117.3
607	Q	41.4	Very low	40.7	Very low	178 Å²	178	115.2 Å²	115.2	83%	0.832	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-19.2	-171.7	-70.6	-177.1	-49	0	0	114.3	L605 I609	L605-Q607 PolarHBondContact O-N 3.45Å; Q607-I609 VanDerWaalsContact C-N 3.27Å; Q607-I609 PolarHBondContact O-N 2.86Å; Q607-I609 VanDerWaalsContact O-N 3.09Å
608	D	39.4	Very low	39.6	Very low	125 Å²	125	116.4 Å²	116.4	67%	0.668	68%	0.678	S	S	*	*	S	Bend	trans	-89.2	37.3	-171.2	-47.2	-50.2	0	0	0	113.7
609	I	37.6	Very low	38.5	Very low	113 Å²	113	118.8 Å²	118.8	58%	0.579	70%	0.695	S	S	*	*			trans	-134.9	75.8	179.9	-52.2	-178	0	0	0	110.7	Q607 V611	Q607-I609 VanDerWaalsContact C-N 3.27Å; Q607-I609 PolarHBondContact O-N 2.86Å; Q607-I609 VanDerWaalsContact O-N 3.09Å; I609-V611 VanDerWaalsContact C-N 3.3Å; I609-V611 HydrophobicContact CG2-CG2 3.78Å; I609-V611 PolarHBondContact O-N 3.19Å; I609-V611 VanDerWaalsContact O-N 3.1Å
610	S	31.8	Very low	37.5	Very low	119 Å²	119	122.7 Å²	122.7	83%	0.832	72%	0.717	S	S	*	*			trans	-80.4	68.5	170.2	44.1	0	0	0	0	111.9	T612	S610-T612 PolarHBondContact O-N 3.4Å
611	V	30.2	Very low	36.7	Very low	116 Å²	116	117.7 Å²	117.7	70%	0.703	71%	0.714	S	S	*	*			trans	-85.4	99.9	169.3	175.6	0	0	0	0	109.4	I609 P613	I609-V611 VanDerWaalsContact C-N 3.3Å; I609-V611 HydrophobicContact CG2-CG2 3.78Å; I609-V611 PolarHBondContact O-N 3.19Å; I609-V611 VanDerWaalsContact O-N 3.1Å; V611-P613 WeakPolarHBondContact O-CD 3.46Å
612	T	27.6	Very low	35.8	Very low	128 Å²	128	117.6 Å²	117.6	79%	0.785	72%	0.722	S	S	*	*			trans	-63.9	118.4	171.6	-24.7	0	0	0	0	109.7	S610 T614	S610-T612 PolarHBondContact O-N 3.4Å; T612-T614 PolarHBondContact O-N 2.8Å
613	P	32.5	Very low	35.1	Very low	117 Å²	117	123.6 Å²	123.6	76%	0.76	74%	0.737	S	S	*	*			trans	-82	113.4	176.8	-1.1	18.8	0	0	0	109.6	V611 G615	V611-P613 WeakPolarHBondContact O-CD 3.46Å; P613-G615 PolarHBondContact O-N 3.17Å
614	T	29.2	Very low	34.3	Very low	149 Å²	149	132.3 Å²	132.3	91%	0.914	76%	0.76	S	S	*	*			trans	-66	128.2	161.2	34.3	0	0	0	0	108.9	T612	T612-T614 PolarHBondContact O-N 2.8Å
615	G	29.8	Very low	33.5	Very low	72 Å²	72	135 Å²	135	74%	0.742	78%	0.775	S	S	*	*			trans	-93.5	164.9	-157.2	0	0	0	0	0	116.7	P613	P613-G615 PolarHBondContact O-N 3.17Å
616	T	28.3	Very low	32.9	Very low	136 Å²	136	139.8 Å²	139.8	83%	0.834	79%	0.785	S	S	*	*			trans	-141.3	157.3	158	25.1	0	0	0	0	108.3
617	P	33.1	Very low	32.5	Very low	123 Å²	123	141.9 Å²	141.9	80%	0.799	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-78.2	156.4	-154.6	29	-36.3	0	0	0	116
618	V	29.8	Very low	31.9	Very low	138 Å²	138	144.8 Å²	144.8	84%	0.836	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.2	128.2	179.6	172.3	0	0	0	0	111
619	P	30.8	Very low	31.2	Very low	105 Å²	105	147 Å²	147	68%	0.682	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.2	157.9	165.7	-10.9	28.1	0	0	0	112.4
620	P	34.1	Very low	30.9	Very low	122 Å²	122	148.7 Å²	148.7	79%	0.792	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-66.2	160.1	-176.1	-22.1	34.9	0	0	0	115.2
621	P	36.8	Very low	30.7	Very low	128 Å²	128	151.5 Å²	151.5	83%	0.831	82%	0.816	S	S	*	*			trans	-102.6	102.5	-169.6	36.9	-30	0	0	0	114
622	E	31.6	Very low	30.7	Very low	186 Å²	186	150.5 Å²	150.5	87%	0.869	82%	0.82	S	S	*	*			trans	-127.6	158.7	167.2	-67	-165.2	145.1	0	0	112.6	R624	E622-R624 PolarHBondContact O-N 3.24Å
623	E	32.7	Very low	30.8	Very low	174 Å²	174	152.3 Å²	152.3	81%	0.813	82%	0.824	S	S	*	*			trans	52.9	44.9	177.1	-59.1	-134.2	117.5	0	0	117.7	N625	E623-N625 PolarHBondContact O-N 2.72Å
624	R	37.1	Very low	30.9	Very low	229 Å²	229	153.1 Å²	153.1	86%	0.864	82%	0.821	S	S	*	*			trans	-63.7	105	150.7	-175	-175.3	-172.9	179.6	5.1	109.3	E622	E622-R624 PolarHBondContact O-N 3.24Å
625	N	29.2	Very low	31.1	Very low	134 Å²	134	150.3 Å²	150.3	72%	0.717	81%	0.808	S	S	*	*			trans	114.7	100.8	165.9	-59.5	-30.1	0	0	0	115	E623	E623-N625 PolarHBondContact O-N 2.72Å
626	R	29.9	Very low	31.4	Very low	222 Å²	222	151.5 Å²	151.5	84%	0.838	80%	0.802	S	S	*	*			trans	-160.4	129.7	138.5	-109.6	155	-160.5	-145.4	3.1	113.9
627	L	29.4	Very low	32.1	Very low	166 Å²	166	152.2 Å²	152.2	87%	0.869	80%	0.796	S	S	*	*			trans	68.6	162.2	157	-72.3	154.4	0	0	0	119.7
628	W	28.5	Very low	32.6	Very low	239 Å²	239	154 Å²	154	91%	0.905	80%	0.796	S	S	*	*			trans	-116.7	173.3	-167.2	-78.2	77.3	0	0	0	111.2
629	M	26.1	Very low	33.4	Very low	170 Å²	170	152.3 Å²	152.3	84%	0.837	78%	0.781	S	S	*	*			trans	64.8	106.6	164.5	-67.1	171.5	56.8	0	0	117.6
630	V	29.7	Very low	34	Very low	150 Å²	150	155.2 Å²	155.2	91%	0.909	78%	0.783	S	S	*	*			trans	-130	130.1	130.7	177.8	0	0	0	0	107.8
631	E	28.4	Very low	34.3	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	79%	0.786	S	S	*	*			trans	-85.2	137.1	177.7	-168.8	165	-167.9	0	0	109.8	D633	E631-D633 PolarHBondContact O-N 3.31Å
632	A	29.9	Very low	34.4	Very low	95 Å²	95	162.8 Å²	162.8	79%	0.785	78%	0.784	S	S	*	*			trans	-82.7	87.4	-169.7	0	0	0	0	0	112.2
633	D	29.1	Very low	34.7	Very low	166 Å²	166	161.3 Å²	161.3	89%	0.888	78%	0.775	S	S	*	*			trans	-57	136.4	-177.1	-129.9	-30.4	0	0	0	113.9	E631	E631-D633 PolarHBondContact O-N 3.31Å
634	I	36.3	Very low	34.9	Very low	135 Å²	135	162 Å²	162	69%	0.692	78%	0.775	S	S	*	*			trans	-99.4	99.7	-176.2	-58.3	179	0	0	0	110
635	S	32.9	Very low	34.9	Very low	90 Å²	90	160.7 Å²	160.7	63%	0.629	78%	0.775	S	S	*	*			trans	-55	135	180	179.8	0	0	0	0	113.1	E637	S635-E637 VanDerWaalsContact C-N 3.3Å; S635-E637 PolarHBondContact O-N 3.15Å
636	P	36.3	Very low	35.2	Very low	97 Å²	97	163.4 Å²	163.4	63%	0.63	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-9.1	-157.9	-22.2	35.8	0	0	0	117.1
637	E	43.4	Very low	35.4	Very low	151 Å²	151	161.9 Å²	161.9	71%	0.706	78%	0.78	S	S	*	*	H	α-helix	trans	-69.2	-38	-169.3	-71.5	-130.6	98.2	0	0	114.3	S635 I639 K640	S635-E637 VanDerWaalsContact C-N 3.3Å; S635-E637 PolarHBondContact O-N 3.15Å; E637-I639 PolarHBondContact O-N 3.39Å; E637-I639 VanDerWaalsContact O-N 3.09Å; E637-K640 PolarHBondContact O-N 3Å; E637-K640 VanDerWaalsContact O-N 3.1Å
638	M	42.3	Very low	35.7	Very low	161 Å²	161	165.2 Å²	165.2	79%	0.793	78%	0.781	S	S	*	*	H	α-helix	trans	-65.6	-18.2	-173.9	-74.6	-133.9	-81.4	0	0	113.9
639	I	46.9	Very low	36.1	Very low	101 Å²	101	164.9 Å²	164.9	52%	0.518	78%	0.78	S	S	.	*	H	α-helix	trans	-77.2	-31.1	177.5	-63.9	175.2	0	0	0	111.6	E637	E637-I639 PolarHBondContact O-N 3.39Å; E637-I639 VanDerWaalsContact O-N 3.09Å
640	K	42.7	Very low	36.3	Very low	166 Å²	166	165.8 Å²	165.8	72%	0.722	78%	0.779	S	S	*	*	H	α-helix	trans	-71.7	-39	-176.8	-76	177.8	178.1	171.1	0	113	E637	E637-K640 PolarHBondContact O-N 3Å; E637-K640 VanDerWaalsContact O-N 3.1Å
641	R	40.8	Very low	36.4	Very low	229 Å²	229	166.8 Å²	166.8	86%	0.864	77%	0.774	S	S	*	*	H	α-helix	trans	-68.6	-34.6	-179.5	-78	-173.9	173.8	-171.7	-1.5	113.8
642	K	39.8	Very low	36.3	Very low	181 Å²	181	164.3 Å²	164.3	79%	0.787	77%	0.771	S	S	*	*	H	α-helix	trans	-73.7	-31.3	178.7	-78.1	-179.7	178.8	171.7	0	113.9
643	K	37.1	Very low	36.2	Very low	155 Å²	155	170.9 Å²	170.9	67%	0.674	78%	0.775	S	S	*	*	H	α-helix	trans	-69.9	-34.2	177	-74.6	-177.2	176.4	178.1	0	112.9	K645 K646	K643-K645 VanDerWaalsContact C-N 3.33Å; K643-K645 PolarHBondContact O-N 3.23Å; K643-K646 PolarHBondContact O-N 2.97Å
644	K	37.9	Very low	36.2	Very low	188 Å²	188	170.4 Å²	170.4	82%	0.817	77%	0.765	S	S	*	*	H	α-helix	trans	-68.4	-23.2	-175.5	-152.5	171.2	-173.2	177.6	0	114.6
645	K	35.3	Very low	36.2	Very low	201 Å²	201	170 Å²	170	87%	0.874	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-5.7	178	-146.7	172.9	-173.1	177	0	114.3	K643	K643-K645 VanDerWaalsContact C-N 3.33Å; K643-K645 PolarHBondContact O-N 3.23Å
646	K	36.3	Very low	35.9	Very low	192 Å²	192	171.1 Å²	171.1	84%	0.835	77%	0.77	S	S	*	*	S	Bend	trans	-108.2	0.2	-177.8	-144.6	-178.8	-176.8	-175.2	0	114.7	K643	K643-K646 PolarHBondContact O-N 2.97Å
647	K	34.5	Very low	35.4	Very low	190 Å²	190	175.5 Å²	175.5	83%	0.826	78%	0.782	S	S	*	*	S	Bend	trans	-117	42	-179.9	-155.1	-175.7	-178.3	-174.5	0	112.8
648	R	36.2	Very low	34.5	Very low	235 Å²	235	174.1 Å²	174.1	89%	0.887	78%	0.784	S	S	*	*	S	Bend	trans	-138.5	23.9	178	-137.3	-179.7	-169.8	-165.4	2.3	113.5
649	R	37.2	Very low	33.8	Very low	233 Å²	233	172.5 Å²	172.5	88%	0.879	78%	0.783	S	S	*	*	S	Bend	trans	-148.6	130.2	170.7	-90.3	-173.8	167.3	-173	-4.8	106.8
650	K	30.3	Very low	32.7	Very low	188 Å²	188	175.8 Å²	175.8	82%	0.817	80%	0.796	S	S	*	*			trans	61.5	131.5	-141.6	-53.8	-172.2	173.9	-164.3	0	110.1
651	E	30.1	Very low	31.9	Very low	172 Å²	172	175.1 Å²	175.1	80%	0.804	80%	0.8	S	S	*	*			cis	-154.1	147.2	8.2	-130.3	155.1	-174.9	0	0	104.4
652	V	27.9	Very low	31.2	Very low	125 Å²	125	172.4 Å²	172.4	76%	0.758	80%	0.797	S	S	*	*				-168.2	127.2	53.8	168.3	0	0	0	0	104.8
653	R	26.4	Very low	30.5	Very low	233 Å²	233	170.5 Å²	170.5	88%	0.879	80%	0.801	S	S	*	*				85.6	115.5	74.6	-155.6	-176.1	-173.5	175.7	1.6	115.4
654	K	30.1	Very low	29.9	Very low	156 Å²	156	172.5 Å²	172.5	68%	0.678	80%	0.804	S	S	*	*			trans	19.5	148.5	147.8	-99.5	179.7	174.5	-110.1	0	121.5	D656	K654-D656 IonicContact NZ-OD1 3.64Å; K654-D656 PolarHBondContact NZ-OD1 2.91Å; K654-D656 IonicContact NZ-OD2 3.37Å; K654-D656 PolarHBondContact NZ-OD2 2.98Å
655	P	35.9	Very low	29.4	Very low	126 Å²	126	171.2 Å²	171.2	82%	0.818	81%	0.806	S	S	*	*				-135.3	-159.5	62.3	41	-24.8	0	0	0	116
656	D	26	Very low	28.9	Very low	114 Å²	114	167.2 Å²	167.2	61%	0.61	79%	0.79	S	S	*	*			trans	-124.5	148	-162.7	-48.5	-102.4	0	0	0	112.9	K654	K654-D656 IonicContact NZ-OD1 3.64Å; K654-D656 PolarHBondContact NZ-OD1 2.91Å; K654-D656 IonicContact NZ-OD2 3.37Å; K654-D656 PolarHBondContact NZ-OD2 2.98Å
657	E	25.6	Very low	28.4	Very low	188 Å²	188	167.2 Å²	167.2	88%	0.879	79%	0.785	S	S	*	*			trans	-179.2	171.4	155.6	-102.2	-176.9	164.5	0	0	107.7
658	V	25.3	Very low	28	Very low	123 Å²	123	167.3 Å²	167.3	75%	0.745	79%	0.788	S	S	*	*				-169.5	158	-59.6	137	0	0	0	0	106.5
659	V	26.7	Very low	27.7	Very low	126 Å²	126	165.2 Å²	165.2	76%	0.764	79%	0.786	S	S	*	*			trans	68.9	112.6	-172.1	-169.2	0	0	0	0	112.8
660	E	24.4	Very low	27.2	Very low	170 Å²	170	157.1 Å²	157.1	79%	0.794	78%	0.775	S	S	*	*			cis	87.6	103	49	-174.6	178.7	-126.2	0	0	114.9
661	N	27.1	Very low	27.2	Very low	152 Å²	152	160.1 Å²	160.1	81%	0.813	78%	0.782	S	S	*	*				-163	152.7	128.4	-123.5	-58.8	0	0	0	112.6
662	Q	25.6	Very low	27.1	Very low	172 Å²	172	156.6 Å²	156.6	80%	0.804	78%	0.776	S	S	*	*			trans	-138.3	126.8	176.1	-80.2	-167.2	-3.9	0	0	112.6
663	T	25.8	Very low	27.2	Very low	142 Å²	142	155.1 Å²	155.1	87%	0.871	77%	0.771	S	S	*	*			trans	-149.3	114.5	159.3	21.7	0	0	0	0	107.8
664	R	23.7	Very low	27.4	Very low	196 Å²	196	150.4 Å²	150.4	74%	0.74	77%	0.768	S	S	*	*			cis	92.6	92.5	20.9	-162.9	-163.6	-171.9	-147.7	3.8	115.3
665	L	26.8	Very low	28.5	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	77%	0.767	S	S	*	*			trans	-151.1	130.4	131.7	-84.5	120.9	0	0	0	106.7
666	Q	25.9	Very low	28.2	Very low	118 Å²	118	152.8 Å²	152.8	55%	0.551	77%	0.77	S	S	*	*			cis	83	129.7	42.4	-173.7	171.9	-24.9	0	0	110.8
667	R	25.3	Very low	28.4	Very low	192 Å²	192	155 Å²	155	73%	0.725	78%	0.781	S	S	*	*			cis	-118.4	175.1	26.2	-110.6	139.3	-174.6	162.3	-0.4	112.1	F669	R667-F669 HydrophobicContact CG-CE2 4.49Å
668	E	26.4	Very low	29.3	Very low	191 Å²	191	150.9 Å²	150.9	89%	0.893	77%	0.77	S	S	*	*			cis	-134	-177.6	48.1	-64.2	-175.8	125.1	0	0	115.8
669	F	28.4	Very low	29.4	Very low	191 Å²	191	153.9 Å²	153.9	84%	0.838	77%	0.773	S	S	*	*			trans	-90.1	154	179.5	-69	-110.8	0	0	0	111.6	R667	R667-F669 HydrophobicContact CG-CE2 4.49Å
670	G	27.9	Very low	29.5	Very low	64 Å²	64	155.2 Å²	155.2	66%	0.66	78%	0.775	S	S	*	*			cis	161.8	126	-12.8	0	0	0	0	0	115.6
671	R	29.6	Very low	30.5	Very low	251 Å²	251	152.5 Å²	152.5	95%	0.947	77%	0.772	S	S	*	*			trans	68.1	158.2	163.7	-61.4	-176.1	172.3	-179.3	-3.4	117
672	S	28.3	Very low	30.5	Very low	98 Å²	98	151.7 Å²	151.7	69%	0.685	78%	0.777	S	S	*	*			cis	-148.5	157.7	13.8	-159.7	0	0	0	0	116
673	S	30.1	Very low	30.7	Very low	93 Å²	93	152 Å²	152	65%	0.65	78%	0.778	S	S	*	*			trans	26.5	119.7	150.3	52.3	0	0	0	0	121.4
674	V	30.9	Very low	31.5	Very low	134 Å²	134	150 Å²	150	81%	0.812	77%	0.768	S	S	*	*			cis	76.2	132.1	32	-171.8	0	0	0	0	113.8
675	P	52	Low	31.8	Very low	103 Å²	103	145 Å²	145	67%	0.669	76%	0.763	S	S	*	*			cis	-144.5	-171	-36.3	40.5	-19.6	0	0	0	115.2
676	R	31	Very low	32	Very low	230 Å²	230	144.4 Å²	144.4	87%	0.868	76%	0.759	S	S	*	*			trans	144	112.7	135.9	-76.9	-177.2	-172.8	-162.2	1.9	117.2
677	L	30.4	Very low	32.1	Very low	161 Å²	161	144.7 Å²	144.7	84%	0.843	77%	0.769	S	S	*	*				28.6	159.7	125.1	-62.4	166.7	0	0	0	122.6
678	P	42.8	Very low	32.3	Very low	101 Å²	101	139.4 Å²	139.4	66%	0.656	77%	0.766	S	S	*	*			cis	-144	-163.7	-43.4	40.6	-20.5	0	0	0	114.3
679	K	27.9	Very low	32.6	Very low	186 Å²	186	136.9 Å²	136.9	81%	0.809	76%	0.759	S	S	*	*			trans	78.4	150.7	171.7	-61.8	-179.9	179.1	-179.9	0	116.2
680	L	29.4	Very low	32.6	Very low	154 Å²	154	134.8 Å²	134.8	81%	0.806	76%	0.756	S	S	*	*			cis	-152.2	167.4	-15.8	-103.5	164.3	0	0	0	107.4
681	P	44.3	Very low	32.5	Very low	112 Å²	112	140.5 Å²	140.5	73%	0.727	76%	0.757	S	S	*	*			trans	-96.6	166.7	-165.3	38.7	-37.6	0	0	0	115.4
682	C	28.8	Very low	32.5	Very low	135 Å²	135	134.9 Å²	134.9	91%	0.912	74%	0.742	S	S	*	*			trans	-150.4	149.9	143.9	-118.4	0	0	0	0	112.6
683	H	29.1	Very low	32.3	Very low	179 Å²	179	137.9 Å²	137.9	83%	0.829	75%	0.745	S	S	*	*			trans	-116.5	-180	173	-124.8	-89.5	0	0	0	106.3
684	P	41.6	Very low	32.1	Very low	101 Å²	101	140.6 Å²	140.6	66%	0.656	75%	0.747	S	S	*	*			cis	-139.5	-169.3	-2.6	43.8	-24.9	0	0	0	116
685	S	31	Very low	31.7	Very low	91 Å²	91	144.4 Å²	144.4	64%	0.636	75%	0.747	S	S	*	*			trans	-22.8	155.1	156.3	55.7	0	0	0	0	119.9
686	L	30.6	Very low	30.3	Very low	147 Å²	147	147.2 Å²	147.2	77%	0.77	75%	0.751	S	S	*	*				-169.4	149.4	79.5	-85.9	165.9	0	0	0	110.2
687	V	28.6	Very low	30	Very low	125 Å²	125	144.9 Å²	144.9	76%	0.758	75%	0.75	S	S	*	*				52.9	129.2	81.9	-178.2	0	0	0	0	112.3
688	A	28.3	Very low	29.5	Very low	81 Å²	81	142.2 Å²	142.2	67%	0.669	75%	0.745	S	S	*	*			cis	-153.5	151.3	35.9	0	0	0	0	0	112.1
689	N	33.4	Very low	28.6	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	75%	0.75	S	S	*	*				77.1	135.5	81	-80.6	-22.2	0	0	0	118.8
690	L	28.9	Very low	28.5	Very low	147 Å²	147	142.4 Å²	142.4	77%	0.77	74%	0.744	S	S	*	*			trans	69.7	150.7	152.9	-59.9	158.4	0	0	0	116.5
691	R	26.2	Very low	28.4	Very low	184 Å²	184	143.2 Å²	143.2	69%	0.694	74%	0.743	S	S	*	*			cis	-154.6	170.6	5.3	-140.4	167.8	170.8	-171	-22.6	113.9
692	E	28.2	Very low	27.4	Very low	132 Å²	132	140.9 Å²	140.9	62%	0.617	74%	0.74	S	S	*	*			trans	2.4	155	149.8	-71.3	148.8	-152.5	0	0	120.9
693	Q	25.4	Very low	27.3	Very low	161 Å²	161	140.8 Å²	140.8	75%	0.752	74%	0.735	S	S	*	*			cis	-177.5	156.5	-16.9	-175.3	176.6	-11.3	0	0	108.3
694	Q	24.5	Very low	27.3	Very low	150 Å²	150	139.6 Å²	139.6	70%	0.701	73%	0.734	S	S	*	*			trans	72.1	155.9	-178.9	-44.7	-172	-10.8	0	0	114.1
695	R	23.3	Very low	26.9	Very low	215 Å²	215	141 Å²	141	81%	0.811	74%	0.743	S	S	*	*			cis	-139.6	160.2	6.5	-163.9	169.9	-70.6	175.9	-0.5	111.2
696	Q	23.7	Very low	26.7	Very low	162 Å²	162	140.2 Å²	140.2	76%	0.757	75%	0.749	S	S	*	*			trans	-80.2	150.4	176.6	-74.6	150.2	-104.8	0	0	113.1
697	Q	23.2	Very low	26.3	Very low	181 Å²	181	139.1 Å²	139.1	85%	0.846	75%	0.754	S	S	*	*			trans	64.3	139.3	160.9	-65.9	158	-56.4	0	0	115.2
698	S	21.3	Very low	26.2	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	76%	0.758	S	S	*	*			cis	-158.4	153.9	28.4	53.4	0	0	0	0	114.9
699	L	23.2	Very low	27.1	Very low	148 Å²	148	141.4 Å²	141.4	78%	0.775	76%	0.755	S	S	*	*			trans	66	134.1	147.4	-98.2	67.5	0	0	0	123.5
700	E	26.1	Very low	26.7	Very low	144 Å²	144	142 Å²	142	67%	0.673	76%	0.758	S	S	*	*			trans	94.6	142	132.6	-87.8	-166.7	97.9	0	0	125.8
701	Q	26.5	Very low	26.4	Very low	170 Å²	170	146 Å²	146	79%	0.794	76%	0.764	S	S	*	*			trans	66.3	140.8	155.8	-64.9	158.7	26.2	0	0	119.8
702	G	24.5	Very low	26.2	Very low	63 Å²	63	145.2 Å²	145.2	65%	0.649	77%	0.769	S	S	*	*			cis	166	170.2	-11.1	0	0	0	0	0	115.1
703	V	26.1	Very low	26.6	Very low	134 Å²	134	144.3 Å²	144.3	81%	0.812	78%	0.775	S	S	*	*			trans	68.9	117.9	151.4	179.5	0	0	0	0	116.9
704	L	29.2	Very low	26.3	Very low	153 Å²	153	142.5 Å²	142.5	80%	0.801	78%	0.778	S	S	*	*				70.9	141.5	63.7	-69.4	171.2	0	0	0	114.4
705	P	33.3	Very low	26.3	Very low	131 Å²	131	144.7 Å²	144.7	85%	0.851	79%	0.789	S	S	*	*				-134.2	-174.8	77.3	31.8	-12.4	0	0	0	112.6
706	G	25.7	Very low	26.4	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	78%	0.782	S	S	*	*			cis	158.6	155.1	3	0	0	0	0	0	107.3
707	S	23.9	Very low	26.4	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	78%	0.782	S	S	*	*			cis	-153.8	-170.2	24	55.7	0	0	0	0	113.4
708	L	24.4	Very low	26.4	Very low	159 Å²	159	139.5 Å²	139.5	83%	0.832	78%	0.775	S	S	*	*			trans	-117.6	-169.7	-165.6	-122	67.9	0	0	0	111.8
709	P	47.9	Very low	26.4	Very low	95 Å²	95	139.9 Å²	139.9	62%	0.617	78%	0.778	S	S	*	*			cis	-144.8	-172.4	-16.8	38.5	-16.9	0	0	0	117.9
710	D	25.4	Very low	26.5	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	78%	0.781	S	S	*	*			trans	100	144.8	135.8	-74.8	-20.1	0	0	0	127
711	Y	23.2	Very low	26.7	Very low	231 Å²	231	143.1 Å²	143.1	91%	0.906	79%	0.785	S	S	*	*			trans	101	148	163.6	-101.7	-91.3	0	0	0	123.8
712	E	22.3	Very low	26.6	Very low	169 Å²	169	143.4 Å²	143.4	79%	0.79	79%	0.786	S	S	*	*			trans	-115.4	-174.7	-162.9	-121.2	-176.1	177.3	0	0	112
713	P	35.3	Very low	26.7	Very low	113 Å²	113	145.4 Å²	145.4	73%	0.734	79%	0.789	S	S	*	*			cis	-134.6	-138.6	-10.2	39.2	-16.4	0	0	0	114.1
714	C	20.3	Very low	26.8	Very low	123 Å²	123	148 Å²	148	83%	0.831	79%	0.792	S	S	*	*			trans	-95.4	168.3	-172.4	-55.7	0	0	0	0	115.4
715	E	24	Very low	26.8	Very low	196 Å²	196	146.1 Å²	146.1	92%	0.916	79%	0.792	S	S	*	*				169.2	-152.5	113.7	-146.9	168	-140.3	0	0	114.2
716	E	24.1	Very low	26.6	Very low	146 Å²	146	143.1 Å²	143.1	68%	0.682	79%	0.785	S	S	*	*			trans	-114.2	141.8	-153.1	-114.8	-159.3	130.3	0	0	117.2
717	R	24	Very low	26.9	Very low	200 Å²	200	150.8 Å²	150.8	76%	0.755	79%	0.791	S	S	*	*				70.5	133.5	125	-165.1	166.2	-174	170.4	1.4	125
718	C	22.9	Very low	27	Very low	103 Å²	103	151.3 Å²	151.3	70%	0.696	78%	0.784	S	S	*	*			trans	78.9	121.9	149.8	-86.4	0	0	0	0	124.3
719	S	21.2	Very low	27.2	Very low	112 Å²	112	146.3 Å²	146.3	78%	0.783	77%	0.771	S	S	*	*			trans	-179.5	131.3	134.8	-75.3	0	0	0	0	107.9
720	Y	25.5	Very low	26.3	Very low	216 Å²	216	152.7 Å²	152.7	85%	0.847	78%	0.784	S	S	*	*				58.1	143.1	64.2	-78.6	-86.5	0	0	0	115.6
721	L	30.3	Very low	26.5	Very low	144 Å²	144	152.7 Å²	152.7	75%	0.754	78%	0.784	S	S	*	*			cis	-172.5	161.6	-37.3	-171.2	132.7	0	0	0	107.9
722	E	26.1	Very low	26.6	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.822	78%	0.782	S	S	*	*			trans	116.4	157.1	167	-70.7	-155.4	114.5	0	0	117
723	C	26.6	Very low	26.9	Very low	104 Å²	104	148.2 Å²	148.2	70%	0.703	78%	0.782	S	S	*	*			cis	-169.4	177.5	-38.1	-157.1	0	0	0	0	111.4
724	Q	26.7	Very low	26.4	Very low	188 Å²	188	152.6 Å²	152.6	88%	0.879	78%	0.784	S	S	*	*			trans	78.2	157.3	171.3	-54	-170.3	17.1	0	0	118.8
725	S	29.9	Very low	26.7	Very low	115 Å²	115	153.2 Å²	153.2	80%	0.804	78%	0.784	S	S	*	*			cis	175.9	149.1	-30.9	-176	0	0	0	0	108.4
726	G	28.3	Very low	26.8	Very low	68 Å²	68	149 Å²	149	70%	0.701	77%	0.767	S	S	*	*			cis	-116.8	-122.8	-15.7	0	0	0	0	0	108.7
727	R	32.7	Very low	26.7	Very low	235 Å²	235	148.3 Å²	148.3	89%	0.887	78%	0.777	S	S	*	*			cis	-168.9	170.6	-18.7	-127.4	-173.4	175.9	164.6	1.9	105.6
728	N	26.2	Very low	27.5	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	78%	0.777	S	S	*	*			cis	-152.7	-179.7	9.4	-154.3	33	0	0	0	108.6
729	G	27.8	Very low	27.8	Very low	55 Å²	55	148.2 Å²	148.2	57%	0.567	79%	0.785	S	S	*	*			trans	176	-171.4	176.5	0	0	0	0	0	117.4
730	Y	30.2	Very low	28.2	Very low	228 Å²	228	149.9 Å²	149.9	89%	0.894	79%	0.785	S	S	*	*			trans	-154.4	166.7	174.1	-63.5	-83.4	0	0	0	109.3
731	L	29.4	Very low	28.4	Very low	150 Å²	150	148.2 Å²	148.2	79%	0.785	79%	0.79	S	S	*	*			cis	177.6	110.4	-42.6	175.4	91.7	0	0	0	107.4
732	M	24.7	Very low	28.3	Very low	176 Å²	176	144.4 Å²	144.4	87%	0.867	79%	0.786	S	S	*	*			trans	-174	162.6	148.6	-135.8	57.9	177	0	0	111.5
733	T	28.2	Very low	28.4	Very low	130 Å²	130	145 Å²	145	80%	0.798	79%	0.794	S	S	*	*			trans	-142.3	133.1	-167.1	5.3	0	0	0	0	115.8
734	R	26.1	Very low	28.2	Very low	204 Å²	204	151.4 Å²	151.4	77%	0.77	80%	0.803	S	S	*	*			trans	58	121.3	132.8	-170	-174.3	-172.4	157.3	7.7	122.2	D736	R734-D736 IonicContact CZ-OD1 2.95Å; R734-D736 IonicContact NE-OD1 3.74Å; R734-D736 PolarHBondContact NE-OD1 2.93Å; R734-D736 IonicContact NH2-OD1 2.61Å
735	V	25.2	Very low	29	Very low	136 Å²	136	147.3 Å²	147.3	82%	0.824	79%	0.792	S	S	*	*			trans	-148.6	96.9	140.3	-179.4	0	0	0	0	105.5
736	D	25.8	Very low	28.7	Very low	108 Å²	108	146.7 Å²	146.7	58%	0.578	79%	0.788	S	S	*	*				78.5	129.5	89.5	-68.4	-26.9	0	0	0	116.4	R734	R734-D736 IonicContact CZ-OD1 2.95Å; R734-D736 IonicContact NE-OD1 3.74Å; R734-D736 PolarHBondContact NE-OD1 2.93Å; R734-D736 IonicContact NH2-OD1 2.61Å
737	C	23.9	Very low	28.4	Very low	132 Å²	132	148.8 Å²	148.8	89%	0.892	79%	0.791	S	S	*	*			trans	-156.4	121.5	173.3	-84.5	0	0	0	0	110.3
738	P	39.1	Very low	28	Very low	114 Å²	114	149 Å²	149	74%	0.74	79%	0.792	S	S	*	*			trans	-102.4	164.9	171.3	38.8	-32.8	0	0	0	112
739	E	29.8	Very low	28.7	Very low	187 Å²	187	147.7 Å²	147.7	87%	0.874	79%	0.791	S	S	*	*			cis	-154.3	-178.1	-15.5	-118.4	-176.1	133.1	0	0	110.4
740	N	30.6	Very low	28.6	Very low	147 Å²	147	153.4 Å²	153.4	79%	0.786	81%	0.807	S	S	*	*			trans	-91.5	160.2	-171.3	-66.2	-84	0	0	0	114.7
741	L	29.4	Very low	28.3	Very low	181 Å²	181	148.2 Å²	148.2	95%	0.948	80%	0.8	S	S	*	*			trans	164.7	138.5	133.7	-88.2	157.2	0	0	0	110.3
742	G	28.3	Very low	28.1	Very low	64 Å²	64	146 Å²	146	66%	0.66	80%	0.797	S	S	*	*			cis	175.1	129.1	-11.4	0	0	0	0	0	114.3
743	L	26.9	Very low	28.2	Very low	189 Å²	189	144.2 Å²	144.2	99%	0.99	79%	0.791	S	S	*	*			trans	76	164.3	156.2	-64.5	163.6	0	0	0	121.5
744	R	23.9	Very low	28	Very low	237 Å²	237	149.2 Å²	149.2	89%	0.894	80%	0.795	S	S	*	*			trans	-139.4	-165.5	-162.9	-138.2	-175.5	177.2	-167	2.6	106.3
745	P	42.3	Very low	28.1	Very low	102 Å²	102	148 Å²	148	66%	0.662	80%	0.798	S	S	*	*			cis	-141.2	-171.1	-16	41	-20.7	0	0	0	116.3
746	S	23.5	Very low	28.9	Very low	103 Å²	103	146.6 Å²	146.6	72%	0.72	79%	0.792	S	S	*	*			trans	75.5	110.9	141.6	-76.7	0	0	0	0	125.5
747	C	23.4	Very low	28.9	Very low	111 Å²	111	147.5 Å²	147.5	75%	0.75	81%	0.806	S	S	*	*				57.5	109.2	116.3	-63.6	0	0	0	0	124.9
748	R	23.4	Very low	29	Very low	240 Å²	240	144.3 Å²	144.3	91%	0.906	80%	0.796	S	S	*	*				64.5	165.6	127.8	-71.7	-170.1	179.2	-165.7	1.2	120.1
749	P	41.3	Very low	28.4	Very low	108 Å²	108	144.9 Å²	144.9	70%	0.701	80%	0.803	S	S	*	*			cis	-136	171.7	-42.3	39.1	-24.1	0	0	0	113.5
750	L	24.9	Very low	28.1	Very low	174 Å²	174	141.3 Å²	141.3	91%	0.911	80%	0.798	S	S	*	*			trans	-152.5	167.5	148.2	-143.5	70.5	0	0	0	111.8
751	T	24.7	Very low	27.8	Very low	120 Å²	120	142.6 Å²	142.6	74%	0.736	80%	0.802	S	S	*	*			trans	-125.2	-176.7	-167	52.5	0	0	0	0	112.7
752	S	24.8	Very low	27.9	Very low	104 Å²	104	144.2 Å²	144.2	73%	0.727	80%	0.797	S	S	*	*			trans	85.4	144.8	172.2	89.5	0	0	0	0	115.7
753	N	26.7	Very low	28.3	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	80%	0.804	S	S	*	*			cis	-160.7	161.5	-15.1	-122.1	-13.1	0	0	0	113.4
754	W	24.8	Very low	28.4	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.89	79%	0.788	S	S	*	*			trans	75.6	151.5	155.5	-75.3	36.4	0	0	0	121.4
755	Q	26.7	Very low	28.5	Very low	178 Å²	178	139 Å²	139	83%	0.832	79%	0.788	S	S	*	*			trans	-120.3	-163.7	168.2	-44.9	176.4	-61.7	0	0	106.8
756	P	43.5	Very low	27.9	Very low	106 Å²	106	139.7 Å²	139.7	69%	0.688	79%	0.79	S	S	*	*			cis	-134.4	-176.3	-13.7	36.1	-16.3	0	0	0	114.9
757	S	26	Very low	28	Very low	127 Å²	127	144 Å²	144	89%	0.888	80%	0.8	S	S	*	*			trans	64.7	152.9	167.4	69.8	0	0	0	0	118.6
758	G	25.4	Very low	28.3	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	80%	0.803	S	S	*	*			cis	172.4	162.9	-11.3	0	0	0	0	0	114
759	S	25.5	Very low	28.5	Very low	126 Å²	126	140.2 Å²	140.2	88%	0.881	80%	0.796	S	S	*	*			trans	69	118.7	161.4	-57.8	0	0	0	0	121.8
760	S	24.5	Very low	27.9	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	80%	0.799	S	S	*	*			trans	69.7	123.1	138.6	-164.2	0	0	0	0	121.9
761	M	25	Very low	28.1	Very low	175 Å²	175	136.3 Å²	136.3	86%	0.862	78%	0.784	S	S	*	*				154.8	137.8	112.1	-162.6	104.4	177	0	0	112
762	Y	30.6	Very low	28.2	Very low	214 Å²	214	137.7 Å²	137.7	84%	0.839	79%	0.787	S	S	*	*			trans	-81	152.2	165.9	-90.6	-83.5	0	0	0	110.5
763	P	37.6	Very low	28.4	Very low	125 Å²	125	137.8 Å²	137.8	81%	0.812	79%	0.787	S	S	*	*				-137.5	178	74.7	34.6	-16	0	0	0	113.8
764	G	27.2	Very low	28.6	Very low	64 Å²	64	136.5 Å²	136.5	66%	0.66	78%	0.777	S	S	*	*			cis	119.4	69.6	-5.8	0	0	0	0	0	114.2
765	E	27.5	Very low	28.9	Very low	192 Å²	192	135 Å²	135	90%	0.897	77%	0.771	S	S	*	*			trans	-151.9	179.5	166.2	-122	161.5	-166.9	0	0	112.7
766	V	29.4	Very low	29	Very low	116 Å²	116	133.5 Å²	133.5	70%	0.703	77%	0.766	S	S	*	*				-154.4	149.4	-127.4	147	0	0	0	0	113.3	H768	V766-H768 HydrophobicContact CG1-CB 4.41Å
767	E	25.2	Very low	28.3	Very low	195 Å²	195	132.9 Å²	132.9	91%	0.911	77%	0.769	S	S	*	*			trans	-128.2	160.1	154	-76.4	-161.9	131	0	0	111.4
768	H	28.8	Very low	28.4	Very low	179 Å²	179	135.6 Å²	135.6	83%	0.829	77%	0.768	S	S	*	*			trans	-158.9	-175.2	-154.7	-134.5	55.4	0	0	0	115.4	V766	V766-H768 HydrophobicContact CG1-CB 4.41Å
769	A	29.7	Very low	28.7	Very low	92 Å²	92	139.3 Å²	139.3	76%	0.76	78%	0.777	S	S	*	*			trans	76.8	142	173.6	0	0	0	0	0	116.7
770	D	28.4	Very low	28.8	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	77%	0.767	S	S	*	*			cis	-158.5	174.6	-24.8	-157.2	-139.5	0	0	0	106.7	L772	D770-L772 WeakPolarHBondContact OD1-CG 3.34Å
771	G	28.7	Very low	29	Very low	59 Å²	59	143.3 Å²	143.3	61%	0.608	77%	0.773	S	S	*	*			cis	-177.9	-163.6	4.6	0	0	0	0	0	107.7
772	L	26.4	Very low	29.2	Very low	149 Å²	149	141 Å²	141	78%	0.78	77%	0.768	S	S	*	*			cis	-148.6	154.9	-4.7	-81.7	98.8	0	0	0	109.4	D770	D770-L772 WeakPolarHBondContact OD1-CG 3.34Å
773	S	29	Very low	29.7	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	77%	0.767	S	S	*	*			trans	28.6	136.8	135.6	-129.2	0	0	0	0	121.4
774	E	31.2	Very low	29.4	Very low	112 Å²	112	135.9 Å²	135.9	52%	0.523	77%	0.771	S	S	.	*			cis	-152.5	-151.2	4.5	-141.7	-157	97	0	0	108.4
775	R	29.8	Very low	29.5	Very low	203 Å²	203	136.3 Å²	136.3	77%	0.766	78%	0.775	S	S	*	*			cis	-146.1	158.7	11.8	179.9	139	-81.4	-175.2	0.5	113.1
776	M	29.2	Very low	29.6	Very low	147 Å²	147	139.7 Å²	139.7	72%	0.724	78%	0.779	S	S	*	*			trans	-36.5	164.5	176.4	-62.2	-179.8	175.7	0	0	122.1
777	A	29.3	Very low	29.6	Very low	92 Å²	92	146 Å²	146	76%	0.76	79%	0.791	S	S	*	*			trans	-127.3	166.2	167.9	0	0	0	0	0	112.1
778	H	28.8	Very low	29.8	Very low	185 Å²	185	141.9 Å²	141.9	86%	0.856	79%	0.79	S	S	*	*			trans	-140.9	175.8	177.8	-87.1	-39	0	0	0	114.2
779	V	30.5	Very low	29.8	Very low	144 Å²	144	136.2 Å²	136.2	87%	0.873	78%	0.78	S	S	*	*			trans	-134.5	164	-149.5	171.3	0	0	0	0	113.4
780	A	29.1	Very low	29.7	Very low	82 Å²	82	143.8 Å²	143.8	68%	0.678	79%	0.791	S	S	*	*			trans	103.5	156.6	165.1	0	0	0	0	0	115.6
781	R	27.1	Very low	29.7	Very low	238 Å²	238	140.4 Å²	140.4	90%	0.898	79%	0.789	S	S	*	*			cis	-156.5	174.1	5.1	-144	169.9	-161.2	130.2	-1	111.5
782	V	30.7	Very low	30.4	Very low	126 Å²	126	143.8 Å²	143.8	76%	0.764	80%	0.8	S	S	*	*			trans	-124.7	147.9	175.2	174.9	0	0	0	0	111.3
783	P	40.9	Very low	30.4	Very low	126 Å²	126	145 Å²	145	82%	0.818	81%	0.806	S	S	*	*			trans	-125.9	167.9	150.1	36.8	-24.5	0	0	0	113.4
784	A	31.3	Very low	30.3	Very low	107 Å²	107	148.3 Å²	148.3	88%	0.884	81%	0.809	S	S	*	*			trans	-151.2	163.4	-169.7	0	0	0	0	0	116
785	G	29.6	Very low	30.4	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	81%	0.814	S	S	*	*			trans	124.9	151.9	173.6	0	0	0	0	0	113.3
786	R	27.9	Very low	30.2	Very low	262 Å²	262	148 Å²	148	99%	0.989	82%	0.817	S	S	*	*			cis	-143.7	-163.5	0.1	-98.8	-175.9	177.2	-178.6	0.4	110.6
787	R	30.7	Very low	30.3	Very low	250 Å²	250	146.6 Å²	146.6	94%	0.943	82%	0.816	S	S	*	*			trans	-123.3	169.3	-157.2	-147.6	-176.1	-164.8	-179.9	5.1	114.1
788	A	29.6	Very low	30.2	Very low	107 Å²	107	149.4 Å²	149.4	88%	0.884	82%	0.819	S	S	*	*			trans	81.3	150.5	173.4	0	0	0	0	0	116.6
789	G	28.1	Very low	30.3	Very low	61 Å²	61	147 Å²	147	63%	0.629	81%	0.811	S	S	*	*			cis	173.8	163.7	-7.1	0	0	0	0	0	113.4
790	Y	27.9	Very low	30.3	Very low	251 Å²	251	149 Å²	149	98%	0.984	81%	0.814	S	S	*	*			trans	69.6	155.7	-180	-63.3	-89.7	0	0	0	118.4
791	G	27.6	Very low	30.3	Very low	69 Å²	69	153 Å²	153	71%	0.711	82%	0.818	S	S	*	*			trans	-141.7	-144.7	167.6	0	0	0	0	0	107.6
792	P	43.4	Very low	30.3	Very low	130 Å²	130	146.1 Å²	146.1	84%	0.844	81%	0.812	S	S	*	*			cis	-120.8	169.4	-21.7	40.5	-27.7	0	0	0	112.1
793	I	27.9	Very low	30.2	Very low	176 Å²	176	148.8 Å²	148.8	90%	0.903	82%	0.816	S	S	*	*			trans	-134.1	150.9	177.1	-64.8	-175	0	0	0	113.4
794	H	26.3	Very low	29.6	Very low	173 Å²	173	150 Å²	150	80%	0.801	82%	0.815	S	S	*	*			trans	-77.9	156.3	-166	-105	-97.6	0	0	0	118.1
795	S	32.3	Very low	29.5	Very low	90 Å²	90	152.1 Å²	152.1	63%	0.629	81%	0.808	S	S	*	*			trans	-18.2	141.6	150.4	56.1	0	0	0	0	120.5
796	R	26.4	Very low	29.4	Very low	220 Å²	220	155.5 Å²	155.5	83%	0.83	81%	0.809	S	S	*	*				-166.8	136.9	129.7	-95	161.2	91	150.3	8.4	107
797	T	32	Very low	29.5	Very low	116 Å²	116	147.3 Å²	147.3	71%	0.712	80%	0.798	S	S	*	*			cis	66.2	97.3	45.4	63.9	0	0	0	0	115.8
798	N	26.2	Very low	29.3	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	79%	0.793	S	S	*	*			trans	-174.8	125.4	150.9	-84.4	-13.2	0	0	0	103.7
799	L	31	Very low	29.2	Very low	135 Å²	135	142.4 Å²	142.4	71%	0.707	78%	0.783	S	S	*	*			cis	75.9	98.2	22.2	-141.6	175.5	0	0	0	113.6	E801	L799-E801 HydrophobicContact CD2-CG 4.1Å
800	M	30	Very low	29.4	Very low	187 Å²	187	146.8 Å²	146.8	92%	0.921	79%	0.792	S	S	*	*			trans	-143.4	165.5	148.6	-105.9	-164.5	75.3	0	0	108.3
801	E	28.6	Very low	29.4	Very low	165 Å²	165	148.3 Å²	148.3	77%	0.771	80%	0.804	S	S	*	*			trans	-132.8	-178.7	-149.4	-100.7	171.5	113.2	0	0	114.5	L799	L799-E801 HydrophobicContact CD2-CG 4.1Å
802	A	28.1	Very low	29.5	Very low	93 Å²	93	152.3 Å²	152.3	77%	0.769	81%	0.809	S	S	*	*			trans	77	151	168.7	0	0	0	0	0	115.5
803	E	29.1	Very low	28.8	Very low	182 Å²	182	153.4 Å²	153.4	85%	0.85	81%	0.807	S	S	*	*			cis	-124.4	142.4	0.7	-66.9	171	140.8	0	0	107.8
804	L	28.4	Very low	28.8	Very low	152 Å²	152	152.2 Å²	152.2	80%	0.796	80%	0.802	S	S	*	*				64.6	93.8	59	-149.7	104.2	0	0	0	114.3
805	M	29	Very low	29	Very low	151 Å²	151	150.9 Å²	150.9	74%	0.744	80%	0.802	S	S	*	*				172	156.2	128.1	-86.1	-89.8	74.9	0	0	112.4
806	D	26	Very low	28.8	Very low	144 Å²	144	154.8 Å²	154.8	77%	0.77	81%	0.813	S	S	*	*			trans	-58.5	174.9	-162.7	-66.8	-57.5	0	0	0	119.5
807	A	30.9	Very low	28.9	Very low	91 Å²	91	150.4 Å²	150.4	75%	0.752	81%	0.811	S	S	*	*			trans	-89.7	156.2	169.1	0	0	0	0	0	112.1
808	D	27.1	Very low	28.7	Very low	157 Å²	157	152.9 Å²	152.9	84%	0.84	82%	0.818	S	S	*	*			trans	-161.7	166.7	131	-130.7	-24.4	0	0	0	114.1
809	S	27.6	Very low	28.9	Very low	96 Å²	96	153 Å²	153	67%	0.671	82%	0.819	S	S	*	*			trans	63.9	110.9	162	61	0	0	0	0	121.6
810	D	31.1	Very low	28.7	Very low	154 Å²	154	154.5 Å²	154.5	82%	0.824	83%	0.829	S	S	*	*				32.7	110.1	128.3	-57.1	-18.3	0	0	0	121.4
811	F	28.8	Very low	28.6	Very low	282 Å²	282	151.5 Å²	151.5	100%	1.237	82%	0.82	S	S	*	*				-160.5	0	115.2	-121.5	-78	0	0	0	113

Retrieved 811 of 811 residues in 608.7 ms (Link to these results)

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