A0A087WUE9_HUMAN Loading...

Symplekin

Scaffold protein that functions as a component of a multimolecular complex involved in histone mRNA 3'-end processing. Specific component of the tight junction (TJ) plaque, but might not be an exclusively junctional component. May have a house-keeping rule. Is involved in pre-mRNA polyadenylation. Enhances SSU72 phosphatase activity.

AlphaFold DB , UniProt , Accession A0A087WUE9, Species HUMAN (Homo sapiens, Human), Gene SYMPK, Length 1,058 aa.

						>A0A087WUE9_HUMAN|A0A087WUE9|SYMPK
MASGSGDSVTRRSVASQFFTQEEGPGIDGMTTSERVVDLLNQAALITNDSKITVLKQVQELIINKDPTLLDNFLDEIIAFQADKSIEVRKFVIGFIEEACKRDIELLLKLIANLNMLLRDENVNVVKKAILTMTQLYKVALQWMVKSRVISELQEACWDMVSAMAGDIILLLDSDNDGIRTHAIKFVEGLIVTLSPRMADSEIPRRQEHDISLDRIPRDHPYIQYNVLWEEGKAALEQLLKFMVHPAISSINLTTALGSLANIARQRPMFMSEVIQAYETLHANLPPTLAKSQVSSVRKNLKLHLLSVLKHPASLEFQAQITTLLVDLGTPQAEIARNMPSSKDTRKRPRDDSDSTLKKMKLEPNLGEDDEDKDLEPGPSGTSKASAQISGQSDTDITAEFLQPLLTPDNVANLVLISMVYLPEAMPASFQAIYTPVESAGTEAQIKHLARLMATQMTAAGLGPGVEQTKQCKEEPKEEKVVKTESVLIKRRLSAQGQAISVVGSLSSMSPLEEEAPQAKRRPEPIIPVTQPRLAGAGGRKKIFRLSDVLKPLTDAQVEAMKLGAVKRILRAEKAVACSGAAQVRIKILASLVTQFNSGLKAEVLSFILEDVRARLDLAFAWLYQEYNAYLAAGASGSLDKYEDCLIRLLSGLQEKPDQKDGIFTKVVLEAPLITESALEVVRKYCEDESRTYLGMSTLRDLIFKRPSRQFQYLHVLLDLSSHEKDKVRSQALLFIKRMYEKEQLREYVEKFALNYLQLLVHPNPPSVLFGADKDTEVAAPWTEETVKQCLYLYLALLPQNHKLIHELAAVYTEAIADIKRTVLRVIEQPIRGMGMNSPELLLLVENCPKGAETLVTRCLHSLTDKVPPSPELVKRVRDLYHKRLPDVRFLIPVLNGLEKKEVIQALPKLIKLNPIVVKEVFNRLLGTQHGEGNSALSPLNPGELLIALHNIDSVKCDMKSIIKGEALPPHSSGLAPATPGQDLSHPHAPTGICQVKDCHSQPHLRALESHLPPSLLFLPPLPSLPPSLLLPSSQVLPFTTHLFLPLMYLLCPGTEWA
					

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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	31.8	Very low	29.1	Very low	251 Å²	251	138.6 Å²	138.6	100%	1.236	86%	0.863	S	S	*	*				0	119.4	0	-60.2	-168.4	-170	0	0	106.5
2	A	30.1	Very low	29.1	Very low	104 Å²	104	145.7 Å²	145.7	86%	0.86	86%	0.861	S	S	*	*			cis	-141.5	158.4	5.6	0	0	0	0	0	108.4
3	S	31.8	Very low	29.5	Very low	126 Å²	126	140.8 Å²	140.8	88%	0.881	84%	0.839	S	S	*	*			trans	-65.8	146.8	-173.9	46.8	0	0	0	0	115.5
4	G	25.6	Very low	29.9	Very low	77 Å²	77	137.9 Å²	137.9	79%	0.794	82%	0.823	S	S	*	*			trans	178.4	75.5	164.5	0	0	0	0	0	112.4
5	S	32.6	Very low	30.4	Very low	127 Å²	127	131.9 Å²	131.9	89%	0.888	79%	0.794	S	S	*	*			trans	-70	146.8	175.2	-50.3	0	0	0	0	111.3
6	G	30.2	Very low	30.6	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	77%	0.768	S	S	*	*			trans	-73.4	173.4	-159.2	0	0	0	0	0	118.3
7	D	26.3	Very low	30.9	Very low	158 Å²	158	128.4 Å²	128.4	85%	0.845	76%	0.764	S	S	*	*			trans	-150.2	125.5	162.1	-107.8	-25	0	0	0	111.7
8	S	26.5	Very low	31.6	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	76%	0.757	S	S	*	*			trans	-79.3	109.9	172	53.6	0	0	0	0	110.1	T10	S8-T10 PolarHBondContact O-N 3.29Å
9	V	26.9	Very low	32.3	Very low	140 Å²	140	131.6 Å²	131.6	85%	0.848	76%	0.757	S	S	*	*			trans	-84	94	174.5	-177.8	0	0	0	0	109.7
10	T	28.7	Very low	32.6	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	75%	0.754	S	S	*	*			trans	-67.2	123.2	159.4	27.8	0	0	0	0	108.9	S8 R12	S8-T10 PolarHBondContact O-N 3.29Å; T10-R12 PolarHBondContact O-N 3.32Å
11	R	29.8	Very low	32.7	Very low	247 Å²	247	132.7 Å²	132.7	93%	0.932	76%	0.756	S	S	*	*			trans	-57.6	109.4	171.9	-92.7	-179.8	169.7	176.3	-3.3	109.6
12	R	29.3	Very low	33.1	Very low	223 Å²	223	129.6 Å²	129.6	84%	0.842	74%	0.739	S	S	*	*			trans	-69.9	142.5	168.2	-76.6	-178.3	173.2	177.8	-2.6	110.8	T10	T10-R12 PolarHBondContact O-N 3.32Å
13	S	33.5	Very low	33.3	Very low	82 Å²	82	133 Å²	133	57%	0.573	74%	0.737	S	S	*	*			trans	-71.3	145.1	174.6	172.3	0	0	0	0	111.2	A15 S16	S13-A15 PolarHBondContact O-N 3.29Å; S13-A15 PolarHBondContact OG-N 3Å; S13-S16 WeakPolarHBondContact O-CB 3.49Å; S13-S16 PolarHBondContact O-N 3.13Å; S13-S16 PolarHBondContact O-OG 3.48Å
14	V	35.5	Very low	33.4	Very low	101 Å²	101	128.8 Å²	128.8	61%	0.612	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-50.2	-29.8	173.2	171.4	0	0	0	0	112.1	S16 Q17 F18	V14-S16 PolarHBondContact O-N 3.36Å; V14-Q17 PolarHBondContact O-N 3.41Å; V14-F18 HydrophobicContact CG1-CD2 4.25Å; V14-F18 HydrophobicContact CG1-CE2 3.67Å; V14-F18 VanDerWaalsContact O-CD2 3.28Å; V14-F18 WeakPolarHBondContact O-CD2 3.49Å
15	A	37.6	Very low	34	Very low	47 Å²	47	132.4 Å²	132.4	39%	0.388	72%	0.723	S	S	.	*	G	3₁₀ helix	trans	-57.7	-29.9	174.6	0	0	0	0	0	114.2	S13 Q17 F18	S13-A15 PolarHBondContact O-N 3.29Å; S13-A15 PolarHBondContact OG-N 3Å; A15-Q17 VanDerWaalsContact C-N 3.32Å; A15-Q17 PolarHBondContact O-N 3.11Å; A15-F18 PolarHBondContact O-N 3.41Å
16	S	32.8	Very low	34.5	Very low	56 Å²	56	129.6 Å²	129.6	39%	0.392	71%	0.714	S	S	.	*	G	3₁₀ helix	trans	-76.2	-16.6	-178.4	62	0	0	0	0	114.2	S13 V14	S13-S16 WeakPolarHBondContact O-CB 3.49Å; S13-S16 PolarHBondContact O-N 3.13Å; S13-S16 PolarHBondContact O-OG 3.48Å; V14-S16 PolarHBondContact O-N 3.36Å
17	Q	37.3	Very low	35.4	Very low	148 Å²	148	130.4 Å²	130.4	69%	0.692	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-87	-14.6	176.5	-69.4	179.9	-15.8	0	0	112.7	V14 A15 T20	V14-Q17 PolarHBondContact O-N 3.41Å; A15-Q17 VanDerWaalsContact C-N 3.32Å; A15-Q17 PolarHBondContact O-N 3.11Å; Q17-T20 PolarHBondContact O-OG1 2.92Å
18	F	42.4	Very low	36.3	Very low	147 Å²	147	131.3 Å²	131.3	65%	0.645	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-19.1	-177.4	-82.6	-77.6	0	0	0	114.3	V14 A15	V14-F18 HydrophobicContact CG1-CD2 4.25Å; V14-F18 HydrophobicContact CG1-CE2 3.67Å; V14-F18 VanDerWaalsContact O-CD2 3.28Å; V14-F18 WeakPolarHBondContact O-CD2 3.49Å; A15-F18 PolarHBondContact O-N 3.41Å
19	F	45.5	Very low	37.8	Very low	172 Å²	172	129.8 Å²	129.8	75%	0.754	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	0.3	179.1	-79	-83.1	0	0	0	113.8
20	T	37.3	Very low	40.2	Very low	112 Å²	112	128.3 Å²	128.3	69%	0.687	69%	0.69	S	S	*	*	S	Bend	trans	-102.1	2.3	-174.8	49.7	0	0	0	0	115	Q17	Q17-T20 PolarHBondContact O-OG1 2.92Å
21	Q	36.2	Very low	43.1	Very low	174 Å²	174	126.3 Å²	126.3	81%	0.813	68%	0.678	S	S	*	*	S	Bend	trans	-125	115.9	174.9	-94.3	174.5	-6.4	0	0	110.7
22	E	38.3	Very low	46	Very low	185 Å²	185	116 Å²	116	86%	0.864	64%	0.642	S	S	*	*			trans	80.6	62.6	171	-56.9	-169.1	158.4	0	0	117.6	G24	E22-G24 PolarHBondContact O-N 3.17Å
23	E	34.8	Very low	49	Very low	177 Å²	177	107.5 Å²	107.5	83%	0.827	62%	0.618	S	S	*	*			trans	-77.9	95.1	144.8	-75.4	-179.1	169.8	0	0	108.7
24	G	34.6	Very low	51.7	Low	37 Å²	37	108.6 Å²	108.6	38%	0.381	61%	0.614	S	S	.	*			trans	-72.6	148.4	162.6	0	0	0	0	0	110.4	E22 G26	E22-G24 PolarHBondContact O-N 3.17Å; G24-G26 VanDerWaalsContact C-N 3.25Å; G24-G26 PolarHBondContact O-N 2.93Å
25	P	37.1	Very low	54.4	Low	152 Å²	152	107.3 Å²	107.3	99%	0.987	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	63.4	-167	33.5	-36	0	0	0	112.9
26	G	44.2	Very low	57.1	Low	68 Å²	68	105.1 Å²	105.1	70%	0.701	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.1	7.5	178.4	0	0	0	0	0	117.2	G24	G24-G26 VanDerWaalsContact C-N 3.25Å; G24-G26 PolarHBondContact O-N 2.93Å
27	I	48.5	Very low	60	Low	91 Å²	91	105.3 Å²	105.3	47%	0.467	58%	0.578	S	S	.	*			trans	-105.3	2.9	-168.2	-55.2	177.1	0	0	0	113.7	G29	I27-G29 PolarHBondContact O-N 2.9Å
28	D	45	Very low	62.6	Low	177 Å²	177	100.9 Å²	100.9	95%	0.947	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	21.2	-173.6	-89.7	-20.1	0	0	0	116.4
29	G	57.6	Low	65.1	Low	71 Å²	71	94 Å²	94	73%	0.732	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.1	-3.2	-178.6	0	0	0	0	0	117.3	I27	I27-G29 PolarHBondContact O-N 2.9Å
30	M	77.8	Confident	67.4	Low	109 Å²	109	86.4 Å²	86.4	54%	0.537	50%	0.496	S	S	.	.			trans	-85.6	132.3	-174.8	-72	-178.9	176.1	0	0	112.3
31	T	89.9	Confident	70.1	Confident	76 Å²	76	85.7 Å²	85.7	47%	0.466	49%	0.488	S	S	.	.			trans	-68.1	156.7	171.8	63.7	0	0	0	0	111	S33 E34 R35	T31-S33 PolarHBondContact O-N 2.89Å; T31-E34 PolarHBondContact N-OE2 3.36Å; T31-E34 PolarHBondContact O-N 2.89Å; T31-E34 WeakPolarHBondContact OG1-CB 3.19Å; T31-E34 WeakPolarHBondContact OG1-CG 3.48Å; T31-E34 PolarHBondContact OG1-N 3.26Å; T31-E34 PolarHBondContact OG1-OE2 3.46Å; T31-R35 PolarHBondContact O-N 2.89Å
32	T	90.6	Very high	72.8	Confident	30 Å²	30	81 Å²	81	18%	0.184	47%	0.466	C	S	.	.	H	α-helix	trans	-56.9	-38.6	178.2	-54.4	0	0	0	0	111.6	R35 V36 L61 K65 D66 L69	T32-R35 PolarHBondContact O-N 3.29Å; T32-V36 VanDerWaalsContact O-CG2 3.29Å; T32-V36 WeakPolarHBondContact O-CG2 3.42Å; T32-V36 PolarHBondContact O-N 2.88Å; T32-L61 HydrophobicContact CG2-CB 4.17Å; T32-L61 HydrophobicContact CG2-CD2 4.29Å; T32-K65 HydrophobicContact CG2-CD 4.29Å; T32-D66 HydrophobicContact CG2-CB 4.17Å; T32-L69 HydrophobicContact CG2-CD1 3.79Å
33	S	92.1	Very high	75.4	Confident	46 Å²	46	72.1 Å²	72.1	32%	0.322	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-46.6	177	-173.2	0	0	0	0	112.3	T31 R35 V36 V37	T31-S33 PolarHBondContact O-N 2.89Å; S33-R35 VanDerWaalsContact C-N 3.29Å; S33-R35 PolarHBondContact O-N 3.25Å; S33-V36 PolarHBondContact O-N 2.96Å; S33-V37 WeakPolarHBondContact O-CG2 3.45Å; S33-V37 PolarHBondContact O-N 2.97Å
34	E	90.6	Very high	78.2	Confident	105 Å²	105	66.9 Å²	66.9	49%	0.491	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-39.4	177	-72.1	162	158	0	0	111.4	T31 V36 V37 D38	T31-E34 PolarHBondContact N-OE2 3.36Å; T31-E34 PolarHBondContact O-N 2.89Å; T31-E34 WeakPolarHBondContact OG1-CB 3.19Å; T31-E34 WeakPolarHBondContact OG1-CG 3.48Å; T31-E34 PolarHBondContact OG1-N 3.26Å; T31-E34 PolarHBondContact OG1-OE2 3.46Å; E34-V36 PolarHBondContact O-N 3.37Å; E34-V37 PolarHBondContact O-N 2.68Å; E34-D38 WeakPolarHBondContact O-CB 3.5Å; E34-D38 PolarHBondContact O-N 2.9Å
35	R	91.7	Very high	80.9	Confident	74 Å²	74	72.2 Å²	72.2	28%	0.279	43%	0.431	S	S	.	.	H	α-helix	trans	-65.3	-38.7	176.3	-175.3	54.8	174.8	171.3	-4.1	112.2	T31 T32 S33 D38 L39 L61	T31-R35 PolarHBondContact O-N 2.89Å; T32-R35 PolarHBondContact O-N 3.29Å; S33-R35 VanDerWaalsContact C-N 3.29Å; S33-R35 PolarHBondContact O-N 3.25Å; R35-D38 IonicContact CZ-OD2 3.57Å; R35-D38 IonicContact NH1-OD2 3.93Å; R35-D38 PolarHBondContact NH1-OD2 3.17Å; R35-D38 PolarHBondContact O-N 3.07Å; R35-L39 HydrophobicContact CG-CD1 4.1Å; R35-L39 WeakPolarHBondContact O-CB 3.39Å; R35-L39 VanDerWaalsContact O-CG 3.23Å; R35-L39 WeakPolarHBondContact O-CG 3.49Å; R35-L39 PolarHBondContact O-N 3.44Å; R35-L61 HydrophobicContact CG-CD1 4.07Å
36	V	94.3	Very high	83.4	Confident	0 Å²	0	67 Å²	67	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-45	175.3	167.4	0	0	0	0	111	T32 S33 E34 D38 L39 L40 V58 L61 I62 F73	T32-V36 VanDerWaalsContact O-CG2 3.29Å; T32-V36 WeakPolarHBondContact O-CG2 3.42Å; T32-V36 PolarHBondContact O-N 2.88Å; S33-V36 PolarHBondContact O-N 2.96Å; E34-V36 PolarHBondContact O-N 3.37Å; V36-D38 PolarHBondContact O-N 3.44Å; V36-L39 PolarHBondContact O-N 3.1Å; V36-L40 HydrophobicContact CG1-CD1 3.84Å; V36-L40 HydrophobicContact CG1-CG 4.35Å; V36-L40 WeakPolarHBondContact O-CB 3.35Å; V36-L40 WeakPolarHBondContact O-CG 3.45Å; V36-L40 PolarHBondContact O-N 2.92Å; V36-V58 HydrophobicContact CG1-CG1 3.82Å; V36-L61 HydrophobicContact CG2-CB 3.82Å; V36-L61 HydrophobicContact CG2-CD1 3.91Å; V36-I62 HydrophobicContact CB-CG2 4.47Å; V36-I62 HydrophobicContact CG1-CG2 4.03Å; V36-I62 HydrophobicContact CG2-CG2 3.66Å; V36-F73 HydrophobicContact CB-CD2 4.41Å; V36-F73 HydrophobicContact CB-CE2 4.11Å; V36-F73 HydrophobicContact CB-CZ 4.29Å; V36-F73 HydrophobicContact CG1-CB 4.4Å; V36-F73 HydrophobicContact CG1-CD1 3.88Å; V36-F73 HydrophobicContact CG1-CD2 3.61Å; V36-F73 HydrophobicContact CG1-CE1 3.98Å; V36-F73 HydrophobicContact CG1-CE2 3.73Å; V36-F73 HydrophobicContact CG1-CG 3.69Å; V36-F73 HydrophobicContact CG1-CZ 3.91Å
37	V	94	Very high	85.5	Confident	61 Å²	61	70.3 Å²	70.3	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-59.6	-46	176.6	172.9	0	0	0	0	111.3	S33 E34 L39 L40 N41 F73	S33-V37 WeakPolarHBondContact O-CG2 3.45Å; S33-V37 PolarHBondContact O-N 2.97Å; E34-V37 PolarHBondContact O-N 2.68Å; V37-L39 PolarHBondContact O-N 3.36Å; V37-L40 PolarHBondContact O-N 3.48Å; V37-N41 WeakPolarHBondContact O-CB 3.35Å; V37-N41 VanDerWaalsContact O-CG 3.29Å; V37-N41 PolarHBondContact O-N 3.07Å; V37-N41 PolarHBondContact O-ND2 3.01Å; V37-N41 VanDerWaalsContact O-ND2 3.16Å; V37-F73 HydrophobicContact CG2-CE1 3.62Å; V37-F73 HydrophobicContact CG2-CZ 3.71Å
38	D	92.7	Very high	87.4	Confident	54 Å²	54	70.3 Å²	70.3	29%	0.289	40%	0.402	S	S	.	.	H	α-helix	trans	-59.4	-46.9	177.1	178.2	44.2	0	0	0	111.8	E34 R35 V36 L40 N41 Q42	E34-D38 WeakPolarHBondContact O-CB 3.5Å; E34-D38 PolarHBondContact O-N 2.9Å; R35-D38 IonicContact CZ-OD2 3.57Å; R35-D38 IonicContact NH1-OD2 3.93Å; R35-D38 PolarHBondContact NH1-OD2 3.17Å; R35-D38 PolarHBondContact O-N 3.07Å; V36-D38 PolarHBondContact O-N 3.44Å; D38-L40 PolarHBondContact O-N 3.34Å; D38-N41 PolarHBondContact O-N 3.19Å; D38-Q42 VanDerWaalsContact O-CG 3.29Å; D38-Q42 WeakPolarHBondContact O-CG 3.37Å; D38-Q42 PolarHBondContact O-N 3.5Å; D38-Q42 PolarHBondContact OD1-NE2 2.84Å; D38-Q42 PolarHBondContact OD2-NE2 3.12Å
39	L	94.6	Very high	89.5	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-65.1	-38.8	177.9	-69.3	169.9	0	0	0	112.7	R35 V36 V37 Q42 A43 V54 Q57 V58 L61	R35-L39 HydrophobicContact CG-CD1 4.1Å; R35-L39 WeakPolarHBondContact O-CB 3.39Å; R35-L39 VanDerWaalsContact O-CG 3.23Å; R35-L39 WeakPolarHBondContact O-CG 3.49Å; R35-L39 PolarHBondContact O-N 3.44Å; V36-L39 PolarHBondContact O-N 3.1Å; V37-L39 PolarHBondContact O-N 3.36Å; L39-Q42 PolarHBondContact O-N 3.39Å; L39-A43 WeakPolarHBondContact O-CB 3.41Å; L39-A43 PolarHBondContact O-N 2.72Å; L39-V54 HydrophobicContact CB-CG1 3.88Å; L39-V54 HydrophobicContact CD2-CG1 3.84Å; L39-V54 HydrophobicContact CG-CG1 4.46Å; L39-V54 WeakPolarHBondContact O-CG1 3.27Å; L39-Q57 HydrophobicContact CD1-CB 4.07Å; L39-V58 HydrophobicContact CB-CG2 3.51Å; L39-V58 HydrophobicContact CD1-CG2 4.15Å; L39-V58 HydrophobicContact CG-CG2 4.49Å; L39-L61 HydrophobicContact CD1-CD1 3.73Å
40	L	94.4	Very high	91.1	Very high	13 Å²	13	65.1 Å²	65.1	7%	0.068	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-42.9	175.9	-76.1	170.5	0	0	0	111.7	V36 V37 D38 Q42 A43 A44 L55 V58 F73 E76 I77 F80	V36-L40 HydrophobicContact CG1-CD1 3.84Å; V36-L40 HydrophobicContact CG1-CG 4.35Å; V36-L40 WeakPolarHBondContact O-CB 3.35Å; V36-L40 WeakPolarHBondContact O-CG 3.45Å; V36-L40 PolarHBondContact O-N 2.92Å; V37-L40 PolarHBondContact O-N 3.48Å; D38-L40 PolarHBondContact O-N 3.34Å; L40-Q42 VanDerWaalsContact C-N 3.34Å; L40-Q42 PolarHBondContact O-N 3.47Å; L40-A43 PolarHBondContact O-N 3.4Å; L40-A44 PolarHBondContact O-N 3.33Å; L40-L55 HydrophobicContact CD2-CD2 4.32Å; L40-V58 HydrophobicContact CD2-CG1 4.27Å; L40-V58 HydrophobicContact CD2-CG2 4.37Å; L40-V58 HydrophobicContact CG-CG1 4.36Å; L40-V58 HydrophobicContact CG-CG2 4.27Å; L40-F73 HydrophobicContact CD1-CD1 3.67Å; L40-F73 HydrophobicContact CD1-CE1 4.26Å; L40-F73 HydrophobicContact CD1-CG 4.34Å; L40-E76 HydrophobicContact CD1-CB 3.92Å; L40-E76 HydrophobicContact CD1-CG 4.33Å; L40-E76 HydrophobicContact CD2-CB 4.38Å; L40-I77 HydrophobicContact CD2-CD1 3.62Å; L40-I77 HydrophobicContact CD2-CG1 4.35Å; L40-F80 HydrophobicContact CD2-CE2 4.42Å
41	N	93.3	Very high	91.8	Very high	97 Å²	97	60.6 Å²	60.6	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-42.3	175	-72.4	-32.6	0	0	0	111.5	V37 D38 A44 L45	V37-N41 WeakPolarHBondContact O-CB 3.35Å; V37-N41 VanDerWaalsContact O-CG 3.29Å; V37-N41 PolarHBondContact O-N 3.07Å; V37-N41 PolarHBondContact O-ND2 3.01Å; V37-N41 VanDerWaalsContact O-ND2 3.16Å; D38-N41 PolarHBondContact O-N 3.19Å; N41-A44 PolarHBondContact O-N 3.15Å; N41-L45 WeakPolarHBondContact O-CG 3.35Å; N41-L45 PolarHBondContact O-N 3.21Å
42	Q	92.6	Very high	92.1	Very high	75 Å²	75	58 Å²	58	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-45.2	174.1	-71.1	171.3	29.7	0	0	111.6	D38 L39 L40 A44 L45 I46 V54	D38-Q42 VanDerWaalsContact O-CG 3.29Å; D38-Q42 WeakPolarHBondContact O-CG 3.37Å; D38-Q42 PolarHBondContact O-N 3.5Å; D38-Q42 PolarHBondContact OD1-NE2 2.84Å; D38-Q42 PolarHBondContact OD2-NE2 3.12Å; L39-Q42 PolarHBondContact O-N 3.39Å; L40-Q42 VanDerWaalsContact C-N 3.34Å; L40-Q42 PolarHBondContact O-N 3.47Å; Q42-A44 VanDerWaalsContact C-N 3.29Å; Q42-A44 PolarHBondContact O-N 3.29Å; Q42-L45 PolarHBondContact O-N 2.98Å; Q42-I46 WeakPolarHBondContact O-CG1 3.48Å; Q42-I46 PolarHBondContact O-N 3.03Å; Q42-V54 HydrophobicContact CB-CG1 4.49Å
43	A	94.1	Very high	92.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-34.6	178.9	0	0	0	0	0	112.9	L39 L40 L45 V54 L55 F80	L39-A43 WeakPolarHBondContact O-CB 3.41Å; L39-A43 PolarHBondContact O-N 2.72Å; L40-A43 PolarHBondContact O-N 3.4Å; A43-L45 VanDerWaalsContact C-N 3.34Å; A43-V54 HydrophobicContact CB-CB 4.33Å; A43-V54 HydrophobicContact CB-CG1 4.05Å; A43-L55 HydrophobicContact CB-CD2 3.79Å; A43-L55 HydrophobicContact CB-CG 4.03Å; A43-F80 HydrophobicContact CB-CZ 4.17Å
44	A	91.6	Very high	92.3	Very high	67 Å²	67	59 Å²	59	55%	0.554	33%	0.327	S	S	*	.	H	α-helix	trans	-67.7	-31.2	176.6	0	0	0	0	0	113.1	L40 N41 Q42	L40-A44 PolarHBondContact O-N 3.33Å; N41-A44 PolarHBondContact O-N 3.15Å; Q42-A44 VanDerWaalsContact C-N 3.29Å; Q42-A44 PolarHBondContact O-N 3.29Å
45	L	91.4	Very high	92.5	Very high	148 Å²	148	54 Å²	54	78%	0.775	30%	0.303	S	S	*	.	H	α-helix	trans	-83.1	-24.1	179.4	-64.6	174.2	0	0	0	113.3	N41 Q42 A43	N41-L45 WeakPolarHBondContact O-CG 3.35Å; N41-L45 PolarHBondContact O-N 3.21Å; Q42-L45 PolarHBondContact O-N 2.98Å; A43-L45 VanDerWaalsContact C-N 3.34Å
46	I	91.5	Very high	92.7	Very high	43 Å²	43	56.3 Å²	56.3	22%	0.221	32%	0.315	C	S	.	.			trans	-74	129.3	179.3	-66.2	164	0	0	0	110	Q42 N48 S50 K51 V54	Q42-I46 WeakPolarHBondContact O-CG1 3.48Å; Q42-I46 PolarHBondContact O-N 3.03Å; I46-N48 WeakPolarHBondContact CG2-O 2.98Å; I46-N48 VanDerWaalsContact CG2-OD1 3.26Å; I46-N48 WeakPolarHBondContact CG2-OD1 3.13Å; I46-S50 WeakPolarHBondContact CG2-OG 3.45Å; I46-K51 HydrophobicContact CB-CB 3.89Å; I46-K51 HydrophobicContact CD1-CB 4.47Å; I46-K51 HydrophobicContact CG2-CB 3.77Å; I46-K51 WeakPolarHBondContact O-CE 3.49Å; I46-K51 PolarHBondContact O-NZ 2.83Å; I46-V54 HydrophobicContact CD1-CG2 3.89Å
47	T	87.3	Confident	92.6	Very high	138 Å²	138	60.3 Å²	60.3	85%	0.847	33%	0.334	S	S	*	.			trans	-98.2	-11	-177	53.5	0	0	0	0	114.5
48	N	88.6	Confident	92.7	Very high	90 Å²	90	57.4 Å²	57.4	48%	0.481	32%	0.317	S	S	.	.	S	Bend	trans	-110.1	177.9	-179.7	65.5	24.7	0	0	0	112	I46 S50 K51	I46-N48 WeakPolarHBondContact CG2-O 2.98Å; I46-N48 VanDerWaalsContact CG2-OD1 3.26Å; I46-N48 WeakPolarHBondContact CG2-OD1 3.13Å; N48-S50 PolarHBondContact O-N 3.47Å; N48-S50 VanDerWaalsContact O-N 3.09Å; N48-S50 VanDerWaalsContact OD1-CB 3.26Å; N48-S50 WeakPolarHBondContact OD1-CB 3.39Å; N48-S50 PolarHBondContact OD1-N 2.87Å; N48-S50 VanDerWaalsContact OD1-N 3.14Å; N48-S50 PolarHBondContact OD1-OG 3.35Å; N48-K51 WeakPolarHBondContact O-CE 3.34Å; N48-K51 PolarHBondContact O-N 2.97Å
49	D	88.4	Confident	92.8	Very high	80 Å²	80	56.6 Å²	56.6	43%	0.428	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-6.5	-176.2	-69.5	-11.6	0	0	0	114.1	K51 I52 S85	D49-K51 PolarHBondContact O-N 3.25Å; D49-I52 HydrophobicContact CB-CD1 4.2Å; D49-I52 WeakPolarHBondContact O-CB 3.37Å; D49-I52 WeakPolarHBondContact O-CG1 3.5Å; D49-I52 PolarHBondContact O-N 3.3Å; D49-I52 VanDerWaalsContact O-N 3.11Å; D49-S85 VanDerWaalsContact OD1-CB 3.31Å; D49-S85 WeakPolarHBondContact OD1-CB 3.49Å; D49-S85 PolarHBondContact OD1-OG 3.33Å
50	S	91	Very high	92.7	Very high	59 Å²	59	61 Å²	61	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.6	175.6	82.8	0	0	0	0	112.2	I46 N48 I52 T53	I46-S50 WeakPolarHBondContact CG2-OG 3.45Å; N48-S50 PolarHBondContact O-N 3.47Å; N48-S50 VanDerWaalsContact O-N 3.09Å; N48-S50 VanDerWaalsContact OD1-CB 3.26Å; N48-S50 WeakPolarHBondContact OD1-CB 3.39Å; N48-S50 PolarHBondContact OD1-N 2.87Å; N48-S50 VanDerWaalsContact OD1-N 3.14Å; N48-S50 PolarHBondContact OD1-OG 3.35Å; S50-I52 PolarHBondContact O-N 2.89Å; S50-I52 VanDerWaalsContact O-N 3.14Å; S50-T53 WeakPolarHBondContact O-CB 3.48Å; S50-T53 PolarHBondContact O-N 3.25Å
51	K	94.1	Very high	92.7	Very high	15 Å²	15	61.4 Å²	61.4	7%	0.065	33%	0.334	C	S	.	.	H	α-helix	trans	-56.7	-28	172.6	77.5	176.1	79.2	-173.3	0	112.6	I46 N48 D49 T53 V54 L55 F80 D83 V88	I46-K51 HydrophobicContact CB-CB 3.89Å; I46-K51 HydrophobicContact CD1-CB 4.47Å; I46-K51 HydrophobicContact CG2-CB 3.77Å; I46-K51 WeakPolarHBondContact O-CE 3.49Å; I46-K51 PolarHBondContact O-NZ 2.83Å; N48-K51 WeakPolarHBondContact O-CE 3.34Å; N48-K51 PolarHBondContact O-N 2.97Å; D49-K51 PolarHBondContact O-N 3.25Å; K51-T53 PolarHBondContact O-N 3.39Å; K51-V54 WeakPolarHBondContact O-CB 3.4Å; K51-V54 PolarHBondContact O-N 3.37Å; K51-V54 VanDerWaalsContact O-N 3.12Å; K51-L55 HydrophobicContact CG-CD1 4.37Å; K51-L55 WeakPolarHBondContact O-CG 3.4Å; K51-L55 PolarHBondContact O-N 2.71Å; K51-F80 HydrophobicContact CD-CE1 4.4Å; K51-D83 IonicContact NZ-OD2 2.71Å; K51-D83 PolarHBondContact NZ-OD2 3.26Å; K51-V88 HydrophobicContact CD-CG1 4.47Å; K51-V88 HydrophobicContact CD-CG2 3.77Å; K51-V88 HydrophobicContact CG-CG2 3.84Å
52	I	94.9	Very high	92.7	Very high	21 Å²	21	56.8 Å²	56.8	11%	0.108	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-34.1	178.2	-59.4	170	0	0	0	110.8	D49 S50 V54 L55 K56 E87 V88 F91	D49-I52 HydrophobicContact CB-CD1 4.2Å; D49-I52 WeakPolarHBondContact O-CB 3.37Å; D49-I52 WeakPolarHBondContact O-CG1 3.5Å; D49-I52 PolarHBondContact O-N 3.3Å; D49-I52 VanDerWaalsContact O-N 3.11Å; S50-I52 PolarHBondContact O-N 2.89Å; S50-I52 VanDerWaalsContact O-N 3.14Å; I52-V54 VanDerWaalsContact C-N 3.32Å; I52-L55 PolarHBondContact O-N 3.36Å; I52-K56 HydrophobicContact CG2-CD 4.23Å; I52-K56 HydrophobicContact CG2-CG 4.41Å; I52-K56 WeakPolarHBondContact O-CB 3.27Å; I52-K56 VanDerWaalsContact O-CG 3.28Å; I52-K56 WeakPolarHBondContact O-CG 3.47Å; I52-K56 PolarHBondContact O-N 2.72Å; I52-E87 HydrophobicContact CD1-CB 3.37Å; I52-V88 HydrophobicContact CD1-CG2 4.08Å; I52-V88 HydrophobicContact CG1-CG2 3.76Å; I52-F91 HydrophobicContact CG2-CB 4.29Å; I52-F91 HydrophobicContact CG2-CD2 4.25Å; I52-F91 HydrophobicContact CG2-CG 4.4Å
53	T	93.8	Very high	92.8	Very high	81 Å²	81	53.4 Å²	53.4	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-42.4	175.8	-55.6	0	0	0	0	110.7	S50 K51 K56 Q57	S50-T53 WeakPolarHBondContact O-CB 3.48Å; S50-T53 PolarHBondContact O-N 3.25Å; K51-T53 PolarHBondContact O-N 3.39Å; T53-K56 PolarHBondContact O-N 3.21Å; T53-Q57 WeakPolarHBondContact O-CG 3.31Å; T53-Q57 PolarHBondContact O-N 2.95Å
54	V	93.6	Very high	92.7	Very high	16 Å²	16	57.1 Å²	57.1	10%	0.097	31%	0.313	C	S	.	.	H	α-helix	trans	-67	-46.9	177.1	-176.3	0	0	0	0	110.6	L39 Q42 A43 I46 K51 I52 K56 Q57 V58	L39-V54 HydrophobicContact CB-CG1 3.88Å; L39-V54 HydrophobicContact CD2-CG1 3.84Å; L39-V54 HydrophobicContact CG-CG1 4.46Å; L39-V54 WeakPolarHBondContact O-CG1 3.27Å; Q42-V54 HydrophobicContact CB-CG1 4.49Å; A43-V54 HydrophobicContact CB-CB 4.33Å; A43-V54 HydrophobicContact CB-CG1 4.05Å; I46-V54 HydrophobicContact CD1-CG2 3.89Å; K51-V54 WeakPolarHBondContact O-CB 3.4Å; K51-V54 PolarHBondContact O-N 3.37Å; K51-V54 VanDerWaalsContact O-N 3.12Å; I52-V54 VanDerWaalsContact C-N 3.32Å; V54-K56 VanDerWaalsContact C-N 3.29Å; V54-K56 PolarHBondContact O-N 3.34Å; V54-Q57 WeakPolarHBondContact O-CB 3.21Å; V54-Q57 PolarHBondContact O-N 3.5Å; V54-V58 PolarHBondContact O-N 3.34Å
55	L	95.6	Very high	92.7	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-34	178	-67.6	172.8	0	0	0	112.8	L40 A43 K51 I52 Q57 V58 Q59 I77 F80 V88 F91	L40-L55 HydrophobicContact CD2-CD2 4.32Å; A43-L55 HydrophobicContact CB-CD2 3.79Å; A43-L55 HydrophobicContact CB-CG 4.03Å; K51-L55 HydrophobicContact CG-CD1 4.37Å; K51-L55 WeakPolarHBondContact O-CG 3.4Å; K51-L55 PolarHBondContact O-N 2.71Å; I52-L55 PolarHBondContact O-N 3.36Å; L55-Q57 VanDerWaalsContact C-N 3.34Å; L55-V58 WeakPolarHBondContact O-CB 3.48Å; L55-V58 PolarHBondContact O-N 3.29Å; L55-Q59 PolarHBondContact O-N 3.22Å; L55-I77 HydrophobicContact CD2-CD1 3.9Å; L55-F80 HydrophobicContact CD1-CD1 4.29Å; L55-F80 HydrophobicContact CD1-CG 4.27Å; L55-F80 HydrophobicContact CD2-CD2 4.08Å; L55-F80 HydrophobicContact CD2-CE2 3.84Å; L55-F80 HydrophobicContact CD2-CZ 4.15Å; L55-V88 HydrophobicContact CD1-CG1 4.34Å; L55-F91 HydrophobicContact CB-CD1 4.1Å; L55-F91 HydrophobicContact CB-CE1 3.51Å; L55-F91 HydrophobicContact CB-CE2 4.22Å; L55-F91 HydrophobicContact CB-CZ 3.58Å; L55-F91 HydrophobicContact CD1-CD1 4.06Å; L55-F91 HydrophobicContact CD1-CE1 4.07Å; L55-F91 HydrophobicContact CG-CE1 4.29Å; L55-F91 WeakPolarHBondContact O-CZ 3.34Å
56	K	94.9	Very high	92.7	Very high	123 Å²	123	56 Å²	56	54%	0.535	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-33.9	172.2	-78.6	174.9	178.4	176.1	0	113	I52 T53 V54 Q59 E60 F91	I52-K56 HydrophobicContact CG2-CD 4.23Å; I52-K56 HydrophobicContact CG2-CG 4.41Å; I52-K56 WeakPolarHBondContact O-CB 3.27Å; I52-K56 VanDerWaalsContact O-CG 3.28Å; I52-K56 WeakPolarHBondContact O-CG 3.47Å; I52-K56 PolarHBondContact O-N 2.72Å; T53-K56 PolarHBondContact O-N 3.21Å; V54-K56 VanDerWaalsContact C-N 3.29Å; V54-K56 PolarHBondContact O-N 3.34Å; K56-Q59 PolarHBondContact O-N 3.24Å; K56-E60 PolarHBondContact O-N 2.74Å; K56-F91 HydrophobicContact CB-CE2 4.42Å; K56-F91 HydrophobicContact CG-CD2 3.93Å; K56-F91 HydrophobicContact CG-CE2 3.62Å
57	Q	92.6	Very high	92.8	Very high	84 Å²	84	56.3 Å²	56.3	39%	0.393	30%	0.297	S	S	.	.	H	α-helix	trans	-65.7	-43.5	172	-65.1	173.8	26.6	0	0	110.3	L39 T53 V54 L55 Q59 E60 L61	L39-Q57 HydrophobicContact CD1-CB 4.07Å; T53-Q57 WeakPolarHBondContact O-CG 3.31Å; T53-Q57 PolarHBondContact O-N 2.95Å; V54-Q57 WeakPolarHBondContact O-CB 3.21Å; V54-Q57 PolarHBondContact O-N 3.5Å; L55-Q57 VanDerWaalsContact C-N 3.34Å; Q57-Q59 VanDerWaalsContact C-N 3.35Å; Q57-Q59 PolarHBondContact O-N 3.31Å; Q57-E60 PolarHBondContact O-N 2.84Å; Q57-L61 VanDerWaalsContact O-CG 3.3Å; Q57-L61 WeakPolarHBondContact O-CG 3.42Å; Q57-L61 PolarHBondContact O-N 3.03Å
58	V	95.2	Very high	93.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-48.7	174.3	177.9	0	0	0	0	110.7	V36 L39 L40 V54 L55 E60 L61 I62 I77	V36-V58 HydrophobicContact CG1-CG1 3.82Å; L39-V58 HydrophobicContact CB-CG2 3.51Å; L39-V58 HydrophobicContact CD1-CG2 4.15Å; L39-V58 HydrophobicContact CG-CG2 4.49Å; L40-V58 HydrophobicContact CD2-CG1 4.27Å; L40-V58 HydrophobicContact CD2-CG2 4.37Å; L40-V58 HydrophobicContact CG-CG1 4.36Å; L40-V58 HydrophobicContact CG-CG2 4.27Å; V54-V58 PolarHBondContact O-N 3.34Å; L55-V58 WeakPolarHBondContact O-CB 3.48Å; L55-V58 PolarHBondContact O-N 3.29Å; V58-E60 VanDerWaalsContact C-N 3.32Å; V58-E60 PolarHBondContact O-N 3.44Å; V58-L61 PolarHBondContact O-N 2.96Å; V58-L61 VanDerWaalsContact O-N 3.1Å; V58-I62 HydrophobicContact CG1-CD1 4.07Å; V58-I62 HydrophobicContact CG1-CG2 4.36Å; V58-I62 WeakPolarHBondContact O-CG1 3.33Å; V58-I62 PolarHBondContact O-N 3.49Å; V58-I77 HydrophobicContact CB-CD1 4.33Å; V58-I77 HydrophobicContact CG1-CD1 3.82Å; V58-I77 HydrophobicContact CG1-CG1 4.42Å
59	Q	94.8	Very high	93.3	Very high	37 Å²	37	51.1 Å²	51.1	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-53.2	-46.9	176.6	179	179.8	-30.6	0	0	112.1	L55 K56 Q57 L61 I62 I63 F91 F95	L55-Q59 PolarHBondContact O-N 3.22Å; K56-Q59 PolarHBondContact O-N 3.24Å; Q57-Q59 VanDerWaalsContact C-N 3.35Å; Q57-Q59 PolarHBondContact O-N 3.31Å; Q59-L61 VanDerWaalsContact C-N 3.35Å; Q59-L61 PolarHBondContact O-N 3.47Å; Q59-I62 PolarHBondContact O-N 3.03Å; Q59-I63 HydrophobicContact CG-CD1 3.58Å; Q59-I63 HydrophobicContact CG-CG1 4.15Å; Q59-I63 VanDerWaalsContact O-CB 3.23Å; Q59-I63 WeakPolarHBondContact O-CB 3.49Å; Q59-I63 WeakPolarHBondContact O-CG1 3.48Å; Q59-I63 PolarHBondContact O-N 3.19Å; Q59-F91 HydrophobicContact CB-CE2 4.4Å; Q59-F91 HydrophobicContact CB-CZ 4.2Å; Q59-F95 HydrophobicContact CB-CD2 4.22Å; Q59-F95 HydrophobicContact CG-CD2 3.93Å; Q59-F95 HydrophobicContact CG-CE2 4.47Å
60	E	93.9	Very high	93.5	Very high	93 Å²	93	47.5 Å²	47.5	44%	0.435	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-40.8	178.9	-175.3	66.2	-173.4	0	0	111.9	K56 Q57 V58 N64 K65	K56-E60 PolarHBondContact O-N 2.74Å; Q57-E60 PolarHBondContact O-N 2.84Å; V58-E60 VanDerWaalsContact C-N 3.32Å; V58-E60 PolarHBondContact O-N 3.44Å; E60-N64 WeakPolarHBondContact O-CA 3.36Å; E60-N64 WeakPolarHBondContact O-CB 3.32Å; E60-N64 PolarHBondContact O-N 3.36Å; E60-N64 PolarHBondContact OE2-ND2 3.23Å; E60-K65 PolarHBondContact O-N 3.1Å
61	L	93.1	Very high	93.6	Very high	23 Å²	23	48.6 Å²	48.6	12%	0.12	25%	0.25	C	C	.	.	I	π-helix	trans	-65.7	-44	179.3	-66.8	174.6	0	0	0	112	T32 R35 V36 L39 Q57 V58 Q59 K65 D66	T32-L61 HydrophobicContact CG2-CB 4.17Å; T32-L61 HydrophobicContact CG2-CD2 4.29Å; R35-L61 HydrophobicContact CG-CD1 4.07Å; V36-L61 HydrophobicContact CG2-CB 3.82Å; V36-L61 HydrophobicContact CG2-CD1 3.91Å; L39-L61 HydrophobicContact CD1-CD1 3.73Å; Q57-L61 VanDerWaalsContact O-CG 3.3Å; Q57-L61 WeakPolarHBondContact O-CG 3.42Å; Q57-L61 PolarHBondContact O-N 3.03Å; V58-L61 PolarHBondContact O-N 2.96Å; V58-L61 VanDerWaalsContact O-N 3.1Å; Q59-L61 VanDerWaalsContact C-N 3.35Å; Q59-L61 PolarHBondContact O-N 3.47Å; L61-K65 HydrophobicContact CD2-CB 4.36Å; L61-K65 HydrophobicContact CD2-CD 3.49Å; L61-K65 VanDerWaalsContact CD2-CD 3.49Å; L61-K65 WeakPolarHBondContact O-CB 3.39Å; L61-K65 PolarHBondContact O-N 3.42Å; L61-D66 PolarHBondContact O-N 3.01Å
62	I	94.9	Very high	93.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-91.3	-19.6	-174.4	71.6	-178.2	0	0	0	114.5	V36 V58 Q59 P67 L69 L70 F73 I77 F95	V36-I62 HydrophobicContact CB-CG2 4.47Å; V36-I62 HydrophobicContact CG1-CG2 4.03Å; V36-I62 HydrophobicContact CG2-CG2 3.66Å; V58-I62 HydrophobicContact CG1-CD1 4.07Å; V58-I62 HydrophobicContact CG1-CG2 4.36Å; V58-I62 WeakPolarHBondContact O-CG1 3.33Å; V58-I62 PolarHBondContact O-N 3.49Å; Q59-I62 PolarHBondContact O-N 3.03Å; I62-P67 VanDerWaalsContact O-CA 3.31Å; I62-P67 WeakPolarHBondContact O-CA 3.26Å; I62-L69 HydrophobicContact CB-CB 4.41Å; I62-L69 HydrophobicContact CG2-CB 4.06Å; I62-L70 HydrophobicContact CD1-CD1 4.07Å; I62-L70 HydrophobicContact CG1-CD1 4.09Å; I62-F73 HydrophobicContact CD1-CB 4.29Å; I62-F73 HydrophobicContact CG2-CD2 4.19Å; I62-I77 HydrophobicContact CD1-CG1 4.3Å; I62-F95 HydrophobicContact CD1-CE2 3.76Å; I62-F95 HydrophobicContact CD1-CZ 3.88Å; I62-F95 HydrophobicContact CG1-CE2 4.22Å
63	I	93.5	Very high	93.5	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	27%	0.271	C	S	.	.	I	π-helix	trans	-95.5	-39.2	176.3	-61	-171.6	0	0	0	111.4	Q59 L70 F95 E98 R102	Q59-I63 HydrophobicContact CG-CD1 3.58Å; Q59-I63 HydrophobicContact CG-CG1 4.15Å; Q59-I63 VanDerWaalsContact O-CB 3.23Å; Q59-I63 WeakPolarHBondContact O-CB 3.49Å; Q59-I63 WeakPolarHBondContact O-CG1 3.48Å; Q59-I63 PolarHBondContact O-N 3.19Å; I63-L70 HydrophobicContact CG1-CD1 4.13Å; I63-F95 HydrophobicContact CD1-CD2 4Å; I63-F95 HydrophobicContact CD1-CE2 3.91Å; I63-F95 HydrophobicContact CG1-CE2 4.2Å; I63-E98 HydrophobicContact CD1-CB 3.71Å; I63-R102 HydrophobicContact CG2-CB 4.21Å; I63-R102 HydrophobicContact CG2-CG 4.43Å; I63-R102 PolarHBondContact O-NE 3.39Å; I63-R102 PolarHBondContact O-NH2 3.46Å
64	N	92.4	Very high	93.5	Very high	78 Å²	78	49 Å²	49	42%	0.417	25%	0.248	S	C	.	.	I	π-helix	trans	-109.6	-48.1	-170.2	-67.4	-36.8	0	0	0	113.4	E60 R102	E60-N64 WeakPolarHBondContact O-CA 3.36Å; E60-N64 WeakPolarHBondContact O-CB 3.32Å; E60-N64 PolarHBondContact O-N 3.36Å; E60-N64 PolarHBondContact OE2-ND2 3.23Å; N64-R102 PolarHBondContact OD1-NH2 3.13Å
65	K	92.3	Very high	93.6	Very high	142 Å²	142	54.2 Å²	54.2	62%	0.617	28%	0.276	S	S	*	.	I	π-helix	trans	-73.5	-52.9	-175.9	-168.3	-175.9	-179	-171.1	0	112.3	T32 E60 L61	T32-K65 HydrophobicContact CG2-CD 4.29Å; E60-K65 PolarHBondContact O-N 3.1Å; L61-K65 HydrophobicContact CD2-CB 4.36Å; L61-K65 HydrophobicContact CD2-CD 3.49Å; L61-K65 VanDerWaalsContact CD2-CD 3.49Å; L61-K65 WeakPolarHBondContact O-CB 3.39Å; L61-K65 PolarHBondContact O-N 3.42Å
66	D	91.4	Very high	93.5	Very high	48 Å²	48	58.2 Å²	58.2	26%	0.257	30%	0.295	S	S	.	.			trans	-136	86.3	178	-169.4	-8.2	0	0	0	110.9	T32 L61 T68 L69	T32-D66 HydrophobicContact CG2-CB 4.17Å; L61-D66 PolarHBondContact O-N 3.01Å; D66-T68 PolarHBondContact O-N 2.88Å; D66-T68 VanDerWaalsContact O-N 3.13Å; D66-T68 PolarHBondContact OD1-N 2.92Å; D66-T68 PolarHBondContact OD1-OG1 2.9Å; D66-L69 HydrophobicContact CB-CD1 4Å; D66-L69 HydrophobicContact CB-CG 4.21Å; D66-L69 PolarHBondContact O-N 3.13Å
67	P	92.9	Very high	93.6	Very high	50 Å²	50	52.3 Å²	52.3	33%	0.325	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-61.1	-19.6	-178.2	-23.1	33.9	0	0	0	114.7	I62 L69 L70	I62-P67 VanDerWaalsContact O-CA 3.31Å; I62-P67 WeakPolarHBondContact O-CA 3.26Å; P67-L69 PolarHBondContact O-N 3.32Å; P67-L70 VanDerWaalsContact O-CB 3.28Å; P67-L70 WeakPolarHBondContact O-CB 3.31Å; P67-L70 PolarHBondContact O-N 2.94Å; P67-L70 VanDerWaalsContact O-N 3.17Å
68	T	93.1	Very high	93.7	Very high	106 Å²	106	48.9 Å²	48.9	65%	0.65	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-68.5	-20	-179.2	69.5	0	0	0	0	112.3	D66 L70	D66-T68 PolarHBondContact O-N 2.88Å; D66-T68 VanDerWaalsContact O-N 3.13Å; D66-T68 PolarHBondContact OD1-N 2.92Å; D66-T68 PolarHBondContact OD1-OG1 2.9Å; T68-L70 VanDerWaalsContact C-N 3.32Å
69	L	93.3	Very high	93.8	Very high	14 Å²	14	52 Å²	52	7%	0.073	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-81.9	-9.6	177.1	-59.3	-179.9	0	0	0	113.1	T32 I62 D66 P67 D71 N72 F73	T32-L69 HydrophobicContact CG2-CD1 3.79Å; I62-L69 HydrophobicContact CB-CB 4.41Å; I62-L69 HydrophobicContact CG2-CB 4.06Å; D66-L69 HydrophobicContact CB-CD1 4Å; D66-L69 HydrophobicContact CB-CG 4.21Å; D66-L69 PolarHBondContact O-N 3.13Å; P67-L69 PolarHBondContact O-N 3.32Å; L69-D71 PolarHBondContact O-N 3.41Å; L69-N72 PolarHBondContact O-N 3.37Å; L69-F73 HydrophobicContact CB-CD2 4.05Å; L69-F73 HydrophobicContact CB-CE2 4.24Å; L69-F73 HydrophobicContact CD2-CE2 4.41Å; L69-F73 WeakPolarHBondContact O-CD2 3.47Å; L69-F73 PolarHBondContact O-N 2.92Å
70	L	93.3	Very high	93.8	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-46	-174.4	-177.9	56.7	0	0	0	112.7	I62 I63 P67 T68 N72 L74 F95 A99 R102 L106	I62-L70 HydrophobicContact CD1-CD1 4.07Å; I62-L70 HydrophobicContact CG1-CD1 4.09Å; I63-L70 HydrophobicContact CG1-CD1 4.13Å; P67-L70 VanDerWaalsContact O-CB 3.28Å; P67-L70 WeakPolarHBondContact O-CB 3.31Å; P67-L70 PolarHBondContact O-N 2.94Å; P67-L70 VanDerWaalsContact O-N 3.17Å; T68-L70 VanDerWaalsContact C-N 3.32Å; L70-N72 VanDerWaalsContact C-N 3.29Å; L70-N72 PolarHBondContact O-N 2.99Å; L70-L74 HydrophobicContact CD1-CD1 4.42Å; L70-L74 PolarHBondContact O-N 3.25Å; L70-F95 HydrophobicContact CD1-CE2 4.12Å; L70-F95 HydrophobicContact CD1-CZ 3.64Å; L70-A99 HydrophobicContact CD1-CB 4.26Å; L70-A99 HydrophobicContact CD2-CB 4.2Å; L70-R102 HydrophobicContact CD2-CG 4.42Å; L70-L106 HydrophobicContact CD2-CD1 3.41Å; L70-L106 VanDerWaalsContact CD2-CD1 3.41Å; L70-L106 HydrophobicContact CG-CD1 3.66Å
71	D	91.8	Very high	93.9	Very high	82 Å²	82	48.8 Å²	48.8	44%	0.439	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-28.9	179.9	-157.9	33.6	0	0	0	111.8	L69 L106 K109	L69-D71 PolarHBondContact O-N 3.41Å; D71-L106 WeakPolarHBondContact OD1-CD2 3.48Å; D71-K109 VanDerWaalsContact CG-NZ 3.33Å; D71-K109 IonicContact OD1-NZ 2.61Å; D71-K109 PolarHBondContact OD1-NZ 3.08Å; D71-K109 IonicContact OD2-NZ 3.82Å; D71-K109 PolarHBondContact OD2-NZ 3.43Å
72	N	93.3	Very high	93.9	Very high	104 Å²	104	51.6 Å²	51.6	56%	0.556	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-33.2	-179.8	-63.8	-25.1	0	0	0	113.2	L69 L70	L69-N72 PolarHBondContact O-N 3.37Å; L70-N72 VanDerWaalsContact C-N 3.29Å; L70-N72 PolarHBondContact O-N 2.99Å
73	F	94.1	Very high	93.9	Very high	17 Å²	17	53.2 Å²	53.2	8%	0.075	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	15	-176.6	-67.5	-69	0	0	0	113.4	V36 V37 L40 I62 L69 E76 I77	V36-F73 HydrophobicContact CB-CD2 4.41Å; V36-F73 HydrophobicContact CB-CE2 4.11Å; V36-F73 HydrophobicContact CB-CZ 4.29Å; V36-F73 HydrophobicContact CG1-CB 4.4Å; V36-F73 HydrophobicContact CG1-CD1 3.88Å; V36-F73 HydrophobicContact CG1-CD2 3.61Å; V36-F73 HydrophobicContact CG1-CE1 3.98Å; V36-F73 HydrophobicContact CG1-CE2 3.73Å; V36-F73 HydrophobicContact CG1-CG 3.69Å; V36-F73 HydrophobicContact CG1-CZ 3.91Å; V37-F73 HydrophobicContact CG2-CE1 3.62Å; V37-F73 HydrophobicContact CG2-CZ 3.71Å; L40-F73 HydrophobicContact CD1-CD1 3.67Å; L40-F73 HydrophobicContact CD1-CE1 4.26Å; L40-F73 HydrophobicContact CD1-CG 4.34Å; I62-F73 HydrophobicContact CD1-CB 4.29Å; I62-F73 HydrophobicContact CG2-CD2 4.19Å; L69-F73 HydrophobicContact CB-CD2 4.05Å; L69-F73 HydrophobicContact CB-CE2 4.24Å; L69-F73 HydrophobicContact CD2-CE2 4.41Å; L69-F73 WeakPolarHBondContact O-CD2 3.47Å; L69-F73 PolarHBondContact O-N 2.92Å; F73-E76 VanDerWaalsContact C-OE2 3.22Å; F73-E76 WeakPolarHBondContact CA-OE2 3.18Å; F73-I77 PolarHBondContact O-N 3.02Å
74	L	94.4	Very high	93.9	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-64.9	-50.6	-175	-165	71.6	0	0	0	110.6	L70 E76 I77 I78 F95 L106 K109 L110	L70-L74 HydrophobicContact CD1-CD1 4.42Å; L70-L74 PolarHBondContact O-N 3.25Å; L74-E76 VanDerWaalsContact C-N 3.3Å; L74-E76 PolarHBondContact O-N 2.94Å; L74-I77 PolarHBondContact O-N 2.93Å; L74-I78 HydrophobicContact CG-CG1 4.39Å; L74-I78 VanDerWaalsContact O-CG1 3.23Å; L74-I78 WeakPolarHBondContact O-CG1 3.28Å; L74-I78 PolarHBondContact O-N 3.29Å; L74-F95 HydrophobicContact CD1-CE1 3.91Å; L74-F95 HydrophobicContact CD1-CZ 4.28Å; L74-L106 HydrophobicContact CD1-CD1 4.48Å; L74-L106 HydrophobicContact CD2-CD2 4.31Å; L74-K109 HydrophobicContact CD2-CB 4.25Å; L74-K109 HydrophobicContact CD2-CD 4.08Å; L74-L110 HydrophobicContact CD1-CD1 4.15Å; L74-L110 HydrophobicContact CD1-CD2 4.06Å; L74-L110 HydrophobicContact CD1-CG 4.49Å; L74-L110 HydrophobicContact CD2-CD2 3.89Å; L74-L110 HydrophobicContact CD2-CG 4.21Å; L74-L110 HydrophobicContact CG-CD2 4.01Å
75	D	94	Very high	94	Very high	126 Å²	126	59.4 Å²	59.4	67%	0.674	33%	0.325	S	S	*	.	H	α-helix	trans	-63.8	-36.6	-174.7	-68.6	-26.1	0	0	0	111.8	I78 A79	D75-I78 PolarHBondContact O-N 3.43Å; D75-A79 WeakPolarHBondContact O-CB 3.32Å; D75-A79 PolarHBondContact O-N 3.37Å
76	E	95.4	Very high	94.2	Very high	84 Å²	84	55.4 Å²	55.4	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-40.2	178.4	-67.7	83.2	170.5	0	0	112.3	L40 F73 L74 F80	L40-E76 HydrophobicContact CD1-CB 3.92Å; L40-E76 HydrophobicContact CD1-CG 4.33Å; L40-E76 HydrophobicContact CD2-CB 4.38Å; F73-E76 VanDerWaalsContact C-OE2 3.22Å; F73-E76 WeakPolarHBondContact CA-OE2 3.18Å; L74-E76 VanDerWaalsContact C-N 3.3Å; L74-E76 PolarHBondContact O-N 2.94Å; E76-F80 VanDerWaalsContact O-CD2 3.24Å; E76-F80 WeakPolarHBondContact O-CD2 3.31Å; E76-F80 WeakPolarHBondContact O-CE2 3.17Å
77	I	95.2	Very high	94.4	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-72.6	-42	175.5	-65.8	-69.2	0	0	0	110.6	L40 L55 V58 I62 F73 L74 A79 F80 F91 F95	L40-I77 HydrophobicContact CD2-CD1 3.62Å; L40-I77 HydrophobicContact CD2-CG1 4.35Å; L55-I77 HydrophobicContact CD2-CD1 3.9Å; V58-I77 HydrophobicContact CB-CD1 4.33Å; V58-I77 HydrophobicContact CG1-CD1 3.82Å; V58-I77 HydrophobicContact CG1-CG1 4.42Å; I62-I77 HydrophobicContact CD1-CG1 4.3Å; F73-I77 PolarHBondContact O-N 3.02Å; L74-I77 PolarHBondContact O-N 2.93Å; I77-A79 VanDerWaalsContact C-N 3.25Å; I77-A79 PolarHBondContact O-N 3.5Å; I77-F80 WeakPolarHBondContact O-CB 3.49Å; I77-F80 PolarHBondContact O-N 2.9Å; I77-F91 HydrophobicContact CG2-CE1 4.32Å; I77-F95 HydrophobicContact CB-CD1 4.27Å; I77-F95 HydrophobicContact CB-CE1 3.93Å; I77-F95 HydrophobicContact CB-CZ 4.11Å; I77-F95 HydrophobicContact CG1-CE2 4.42Å; I77-F95 HydrophobicContact CG1-CZ 4.21Å; I77-F95 HydrophobicContact CG2-CB 4.29Å; I77-F95 HydrophobicContact CG2-CD1 3.39Å; I77-F95 HydrophobicContact CG2-CD2 3.99Å; I77-F95 HydrophobicContact CG2-CE1 3.57Å; I77-F95 HydrophobicContact CG2-CE2 4.16Å; I77-F95 HydrophobicContact CG2-CG 3.61Å; I77-F95 HydrophobicContact CG2-CZ 3.95Å
78	I	96.4	Very high	94.6	Very high	11 Å²	11	54.6 Å²	54.6	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-28.4	-179.5	-63.8	-55.9	0	0	0	111.8	L74 D75 F80 Q81 V92 F95 I96 L110 N113	L74-I78 HydrophobicContact CG-CG1 4.39Å; L74-I78 VanDerWaalsContact O-CG1 3.23Å; L74-I78 WeakPolarHBondContact O-CG1 3.28Å; L74-I78 PolarHBondContact O-N 3.29Å; D75-I78 PolarHBondContact O-N 3.43Å; I78-F80 PolarHBondContact O-N 3.19Å; I78-F80 VanDerWaalsContact O-N 3.1Å; I78-Q81 VanDerWaalsContact O-CB 3.23Å; I78-Q81 WeakPolarHBondContact O-CB 3.27Å; I78-Q81 WeakPolarHBondContact O-CG 3.27Å; I78-Q81 PolarHBondContact O-N 2.89Å; I78-V92 HydrophobicContact CD1-CG1 3.95Å; I78-F95 HydrophobicContact CD1-CD1 4.25Å; I78-F95 HydrophobicContact CD1-CE1 4.42Å; I78-I96 HydrophobicContact CD1-CD1 4.05Å; I78-I96 HydrophobicContact CD1-CG1 3.72Å; I78-L110 HydrophobicContact CD1-CD2 3.54Å; I78-L110 HydrophobicContact CG1-CD2 3.62Å; I78-N113 HydrophobicContact CG2-CB 4.2Å
79	A	95.3	Very high	94.8	Very high	66 Å²	66	51 Å²	51	55%	0.545	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-54.9	-29.9	173.5	0	0	0	0	0	113.3	D75 I77 Q81 A82	D75-A79 WeakPolarHBondContact O-CB 3.32Å; D75-A79 PolarHBondContact O-N 3.37Å; I77-A79 VanDerWaalsContact C-N 3.25Å; I77-A79 PolarHBondContact O-N 3.5Å; A79-Q81 PolarHBondContact O-N 3.4Å; A79-A82 PolarHBondContact O-N 3.04Å
80	F	95.5	Very high	95	Very high	28 Å²	28	52.9 Å²	52.9	12%	0.123	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-70.5	-4.6	176.1	-70.1	-85.1	0	0	0	114	L40 A43 K51 L55 E76 I77 I78 A82 D83 V88 V92	L40-F80 HydrophobicContact CD2-CE2 4.42Å; A43-F80 HydrophobicContact CB-CZ 4.17Å; K51-F80 HydrophobicContact CD-CE1 4.4Å; L55-F80 HydrophobicContact CD1-CD1 4.29Å; L55-F80 HydrophobicContact CD1-CG 4.27Å; L55-F80 HydrophobicContact CD2-CD2 4.08Å; L55-F80 HydrophobicContact CD2-CE2 3.84Å; L55-F80 HydrophobicContact CD2-CZ 4.15Å; E76-F80 VanDerWaalsContact O-CD2 3.24Å; E76-F80 WeakPolarHBondContact O-CD2 3.31Å; E76-F80 WeakPolarHBondContact O-CE2 3.17Å; I77-F80 WeakPolarHBondContact O-CB 3.49Å; I77-F80 PolarHBondContact O-N 2.9Å; I78-F80 PolarHBondContact O-N 3.19Å; I78-F80 VanDerWaalsContact O-N 3.1Å; F80-A82 PolarHBondContact O-N 3.43Å; F80-D83 VanDerWaalsContact O-CB 3.23Å; F80-D83 WeakPolarHBondContact O-CB 3.37Å; F80-D83 PolarHBondContact O-N 3.31Å; F80-D83 VanDerWaalsContact O-N 3.1Å; F80-V88 HydrophobicContact CB-CG1 3.89Å; F80-V88 HydrophobicContact CD1-CG1 4.25Å; F80-V88 HydrophobicContact CG-CG1 4.47Å; F80-V92 HydrophobicContact CB-CG2 3.9Å
81	Q	95.9	Very high	95.2	Very high	35 Å²	35	53.4 Å²	53.4	16%	0.164	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-64.2	-22.7	172.8	80.9	-176.4	11.3	0	0	112.7	I78 A79 D83 R89 V92 N113 L117	I78-Q81 VanDerWaalsContact O-CB 3.23Å; I78-Q81 WeakPolarHBondContact O-CB 3.27Å; I78-Q81 WeakPolarHBondContact O-CG 3.27Å; I78-Q81 PolarHBondContact O-N 2.89Å; A79-Q81 PolarHBondContact O-N 3.4Å; Q81-D83 VanDerWaalsContact C-N 3.34Å; Q81-R89 WeakPolarHBondContact O-CD 3.41Å; Q81-R89 WeakPolarHBondContact O-CG 3.45Å; Q81-V92 HydrophobicContact CB-CG1 4.07Å; Q81-N113 PolarHBondContact NE2-OD1 3.48Å; Q81-N113 PolarHBondContact OE1-OD1 3.06Å; Q81-N113 VanDerWaalsContact OE1-OD1 3.12Å; Q81-L117 HydrophobicContact CB-CD1 4.27Å; Q81-L117 HydrophobicContact CB-CD2 4.32Å
82	A	94.4	Very high	95.5	Very high	82 Å²	82	49.5 Å²	49.5	68%	0.678	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-89.5	2.3	176.8	0	0	0	0	0	113.3	A79 F80	A79-A82 PolarHBondContact O-N 3.04Å; F80-A82 PolarHBondContact O-N 3.43Å
83	D	94.6	Very high	95.8	Very high	33 Å²	33	44.6 Å²	44.6	18%	0.176	24%	0.237	C	C	.	.			trans	-63.8	144.7	179.9	-163.7	-60.3	0	0	0	110.8	K51 F80 Q81 S85 V88 R89	K51-D83 IonicContact NZ-OD2 2.71Å; K51-D83 PolarHBondContact NZ-OD2 3.26Å; F80-D83 VanDerWaalsContact O-CB 3.23Å; F80-D83 WeakPolarHBondContact O-CB 3.37Å; F80-D83 PolarHBondContact O-N 3.31Å; F80-D83 VanDerWaalsContact O-N 3.1Å; Q81-D83 VanDerWaalsContact C-N 3.34Å; D83-S85 VanDerWaalsContact C-N 3.26Å; D83-S85 PolarHBondContact O-N 3.07Å; D83-S85 WeakPolarHBondContact OD1-CB 3.06Å; D83-S85 PolarHBondContact OD1-N 3.43Å; D83-V88 HydrophobicContact CB-CB 4.08Å; D83-V88 HydrophobicContact CB-CG1 3.69Å; D83-R89 WeakPolarHBondContact O-CD 3.29Å; D83-R89 WeakPolarHBondContact O-CG 3.2Å; D83-R89 PolarHBondContact O-NH1 2.61Å
84	K	92.3	Very high	95.9	Very high	193 Å²	193	44.5 Å²	44.5	84%	0.839	24%	0.241	S	C	*	.	S	Bend	trans	-67.2	-30	179.6	-62.3	-59.1	-175.6	-173.5	0	111.8	I86 R89	K84-I86 PolarHBondContact O-N 3.16Å; K84-R89 PolarHBondContact O-NH1 2.81Å
85	S	95.1	Very high	96.1	Very high	20 Å²	20	44.4 Å²	44.4	14%	0.14	24%	0.24	C	C	.	.			trans	-70.4	126.5	178.8	176.1	0	0	0	0	112	D49 D83 E87 V88 R89	D49-S85 VanDerWaalsContact OD1-CB 3.31Å; D49-S85 WeakPolarHBondContact OD1-CB 3.49Å; D49-S85 PolarHBondContact OD1-OG 3.33Å; D83-S85 VanDerWaalsContact C-N 3.26Å; D83-S85 PolarHBondContact O-N 3.07Å; D83-S85 WeakPolarHBondContact OD1-CB 3.06Å; D83-S85 PolarHBondContact OD1-N 3.43Å; S85-E87 VanDerWaalsContact C-N 3.29Å; S85-E87 PolarHBondContact O-N 3.14Å; S85-E87 PolarHBondContact OG-N 3.31Å; S85-V88 PolarHBondContact O-N 2.83Å; S85-R89 PolarHBondContact O-N 3.31Å
86	I	96.9	Very high	96.3	Very high	57 Å²	57	38.4 Å²	38.4	29%	0.292	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-39.8	176.9	-62.4	161.2	0	0	0	110.5	K84 V88 R89 K90 N122 N124 V125	K84-I86 PolarHBondContact O-N 3.16Å; I86-V88 VanDerWaalsContact C-N 3.35Å; I86-R89 PolarHBondContact O-N 3.12Å; I86-K90 HydrophobicContact CG2-CD 3.97Å; I86-K90 VanDerWaalsContact O-CG 3.32Å; I86-K90 WeakPolarHBondContact O-CG 3.45Å; I86-K90 PolarHBondContact O-N 3.09Å; I86-N122 WeakPolarHBondContact CD1-ND2 3.37Å; I86-N122 HydrophobicContact CG1-CB 4.47Å; I86-N124 HydrophobicContact CG2-CB 4.31Å; I86-V125 HydrophobicContact CG2-CG2 3.83Å
87	E	96	Very high	96.4	Very high	82 Å²	82	35.4 Å²	35.4	38%	0.383	19%	0.194	S	C	.	.	H	α-helix	trans	-71.2	-31.7	-177.3	-67.1	-59	144.4	0	0	112	I52 S85 K90 F91	I52-E87 HydrophobicContact CD1-CB 3.37Å; S85-E87 VanDerWaalsContact C-N 3.29Å; S85-E87 PolarHBondContact O-N 3.14Å; S85-E87 PolarHBondContact OG-N 3.31Å; E87-K90 PolarHBondContact O-N 3.43Å; E87-K90 IonicContact OE1-NZ 2.66Å; E87-K90 PolarHBondContact OE1-NZ 3.43Å; E87-K90 IonicContact OE2-NZ 3.27Å; E87-K90 PolarHBondContact OE2-NZ 3.38Å; E87-F91 WeakPolarHBondContact O-CB 3.43Å; E87-F91 PolarHBondContact O-N 3.12Å
88	V	96	Very high	96.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-46.1	173	178.5	0	0	0	0	110.6	K51 I52 L55 F80 D83 S85 I86 K90 F91 V92	K51-V88 HydrophobicContact CD-CG1 4.47Å; K51-V88 HydrophobicContact CD-CG2 3.77Å; K51-V88 HydrophobicContact CG-CG2 3.84Å; I52-V88 HydrophobicContact CD1-CG2 4.08Å; I52-V88 HydrophobicContact CG1-CG2 3.76Å; L55-V88 HydrophobicContact CD1-CG1 4.34Å; F80-V88 HydrophobicContact CB-CG1 3.89Å; F80-V88 HydrophobicContact CD1-CG1 4.25Å; F80-V88 HydrophobicContact CG-CG1 4.47Å; D83-V88 HydrophobicContact CB-CB 4.08Å; D83-V88 HydrophobicContact CB-CG1 3.69Å; S85-V88 PolarHBondContact O-N 2.83Å; I86-V88 VanDerWaalsContact C-N 3.35Å; V88-K90 VanDerWaalsContact C-N 3.33Å; V88-K90 PolarHBondContact O-N 3.31Å; V88-F91 WeakPolarHBondContact O-CA 3.23Å; V88-F91 VanDerWaalsContact O-CB 3.31Å; V88-F91 WeakPolarHBondContact O-CB 3.26Å; V88-F91 PolarHBondContact O-N 3.11Å; V88-F91 VanDerWaalsContact O-N 3.08Å; V88-V92 PolarHBondContact O-N 3.38Å
89	R	97.8	Very high	96.4	Very high	30 Å²	30	38.3 Å²	38.3	11%	0.113	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-39.4	175.5	-61.4	-159.9	-58.6	-78.3	5.9	112.3	Q81 D83 K84 S85 I86 F91 V92 I93 L117 D120 V125	Q81-R89 WeakPolarHBondContact O-CD 3.41Å; Q81-R89 WeakPolarHBondContact O-CG 3.45Å; D83-R89 WeakPolarHBondContact O-CD 3.29Å; D83-R89 WeakPolarHBondContact O-CG 3.2Å; D83-R89 PolarHBondContact O-NH1 2.61Å; K84-R89 PolarHBondContact O-NH1 2.81Å; S85-R89 PolarHBondContact O-N 3.31Å; I86-R89 PolarHBondContact O-N 3.12Å; R89-F91 VanDerWaalsContact C-N 3.32Å; R89-F91 PolarHBondContact O-N 3.46Å; R89-V92 PolarHBondContact O-N 3.21Å; R89-I93 WeakPolarHBondContact O-CG1 3.3Å; R89-I93 PolarHBondContact O-N 2.95Å; R89-I93 VanDerWaalsContact O-N 3.11Å; R89-L117 HydrophobicContact CB-CD2 4.16Å; R89-D120 IonicContact CZ-OD1 3.83Å; R89-D120 IonicContact CZ-OD2 3.94Å; R89-D120 IonicContact NE-OD1 3.61Å; R89-D120 IonicContact NE-OD2 3.86Å; R89-D120 PolarHBondContact NE-OD2 3Å; R89-D120 IonicContact NH2-OD1 3.23Å; R89-D120 PolarHBondContact NH2-OD1 2.84Å; R89-D120 IonicContact NH2-OD2 3.96Å; R89-D120 PolarHBondContact NH2-OD2 3.28Å; R89-V125 HydrophobicContact CB-CG1 4.31Å; R89-V125 HydrophobicContact CB-CG2 4.3Å
90	K	97.8	Very high	96.5	Very high	53 Å²	53	35.2 Å²	35.2	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-37	172.4	-73.8	166.5	66.9	-150.6	0	112.6	I86 E87 V88 I93 G94 N124 V125 K128	I86-K90 HydrophobicContact CG2-CD 3.97Å; I86-K90 VanDerWaalsContact O-CG 3.32Å; I86-K90 WeakPolarHBondContact O-CG 3.45Å; I86-K90 PolarHBondContact O-N 3.09Å; E87-K90 PolarHBondContact O-N 3.43Å; E87-K90 IonicContact OE1-NZ 2.66Å; E87-K90 PolarHBondContact OE1-NZ 3.43Å; E87-K90 IonicContact OE2-NZ 3.27Å; E87-K90 PolarHBondContact OE2-NZ 3.38Å; V88-K90 VanDerWaalsContact C-N 3.33Å; V88-K90 PolarHBondContact O-N 3.31Å; K90-I93 PolarHBondContact O-N 3.14Å; K90-G94 PolarHBondContact O-N 2.95Å; K90-G94 VanDerWaalsContact O-N 3.1Å; K90-N124 HydrophobicContact CD-CB 4.48Å; K90-V125 HydrophobicContact CG-CG2 4.34Å; K90-K128 HydrophobicContact CB-CG 4.4Å; K90-K128 HydrophobicContact CG-CB 4.23Å; K90-K128 HydrophobicContact CG-CG 4.47Å
91	F	98	Very high	96.4	Very high	16 Å²	16	38.2 Å²	38.2	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-45.9	172.8	164.9	-91.1	0	0	0	110.8	I52 L55 K56 Q59 I77 E87 V88 R89 I93 G94 F95	I52-F91 HydrophobicContact CG2-CB 4.29Å; I52-F91 HydrophobicContact CG2-CD2 4.25Å; I52-F91 HydrophobicContact CG2-CG 4.4Å; L55-F91 HydrophobicContact CB-CD1 4.1Å; L55-F91 HydrophobicContact CB-CE1 3.51Å; L55-F91 HydrophobicContact CB-CE2 4.22Å; L55-F91 HydrophobicContact CB-CZ 3.58Å; L55-F91 HydrophobicContact CD1-CD1 4.06Å; L55-F91 HydrophobicContact CD1-CE1 4.07Å; L55-F91 HydrophobicContact CG-CE1 4.29Å; L55-F91 WeakPolarHBondContact O-CZ 3.34Å; K56-F91 HydrophobicContact CB-CE2 4.42Å; K56-F91 HydrophobicContact CG-CD2 3.93Å; K56-F91 HydrophobicContact CG-CE2 3.62Å; Q59-F91 HydrophobicContact CB-CE2 4.4Å; Q59-F91 HydrophobicContact CB-CZ 4.2Å; I77-F91 HydrophobicContact CG2-CE1 4.32Å; E87-F91 WeakPolarHBondContact O-CB 3.43Å; E87-F91 PolarHBondContact O-N 3.12Å; V88-F91 WeakPolarHBondContact O-CA 3.23Å; V88-F91 VanDerWaalsContact O-CB 3.31Å; V88-F91 WeakPolarHBondContact O-CB 3.26Å; V88-F91 PolarHBondContact O-N 3.11Å; V88-F91 VanDerWaalsContact O-N 3.08Å; R89-F91 VanDerWaalsContact C-N 3.32Å; R89-F91 PolarHBondContact O-N 3.46Å; F91-I93 VanDerWaalsContact C-N 3.31Å; F91-I93 PolarHBondContact O-N 3.45Å; F91-G94 CarbonylContact O-C 3.08Å; F91-G94 WeakPolarHBondContact O-CA 3.44Å; F91-G94 PolarHBondContact O-N 3.31Å; F91-F95 HydrophobicContact CE1-CB 4.41Å; F91-F95 HydrophobicContact CZ-CB 4.45Å; F91-F95 PolarHBondContact O-N 3.17Å
92	V	98.1	Very high	96.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-41.5	178	178	0	0	0	0	111.7	I78 F80 Q81 V88 R89 G94 F95 I96 L117	I78-V92 HydrophobicContact CD1-CG1 3.95Å; F80-V92 HydrophobicContact CB-CG2 3.9Å; Q81-V92 HydrophobicContact CB-CG1 4.07Å; V88-V92 PolarHBondContact O-N 3.38Å; R89-V92 PolarHBondContact O-N 3.21Å; V92-G94 VanDerWaalsContact C-N 3.32Å; V92-G94 PolarHBondContact O-N 3.03Å; V92-F95 WeakPolarHBondContact O-CB 2.97Å; V92-F95 PolarHBondContact O-N 3.21Å; V92-I96 HydrophobicContact CG1-CD1 4.22Å; V92-I96 WeakPolarHBondContact O-CG1 3.46Å; V92-I96 PolarHBondContact O-N 3.32Å; V92-L117 HydrophobicContact CG1-CD1 4.31Å
93	I	98.2	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-44.7	173.1	-62.1	167.6	0	0	0	111.2	R89 K90 F91 F95 I96 E97 L114 L117 V125 K128 A129 T132	R89-I93 WeakPolarHBondContact O-CG1 3.3Å; R89-I93 PolarHBondContact O-N 2.95Å; R89-I93 VanDerWaalsContact O-N 3.11Å; K90-I93 PolarHBondContact O-N 3.14Å; F91-I93 VanDerWaalsContact C-N 3.31Å; F91-I93 PolarHBondContact O-N 3.45Å; I93-F95 VanDerWaalsContact C-N 3.31Å; I93-F95 PolarHBondContact O-N 3.46Å; I93-I96 PolarHBondContact O-N 3.2Å; I93-E97 PolarHBondContact O-N 2.96Å; I93-L114 HydrophobicContact CG2-CD1 4.05Å; I93-L117 HydrophobicContact CD1-CB 4.11Å; I93-L117 HydrophobicContact CD1-CD2 4.5Å; I93-L117 HydrophobicContact CG1-CB 4Å; I93-L117 HydrophobicContact CG1-CD1 3.73Å; I93-L117 HydrophobicContact CG1-CD2 4.34Å; I93-L117 HydrophobicContact CG1-CG 4.24Å; I93-V125 HydrophobicContact CD1-CG1 3.55Å; I93-V125 WeakPolarHBondContact CD1-O 3.29Å; I93-K128 HydrophobicContact CB-CG 4.02Å; I93-K128 HydrophobicContact CD1-CB 4.17Å; I93-K128 HydrophobicContact CD1-CG 4.18Å; I93-K128 HydrophobicContact CG2-CD 4.49Å; I93-K128 HydrophobicContact CG2-CG 3.84Å; I93-A129 HydrophobicContact CD1-CB 4.05Å; I93-T132 HydrophobicContact CG2-CG2 4.07Å; I93-T132 VanDerWaalsContact CG2-OG1 3.29Å; I93-T132 WeakPolarHBondContact CG2-OG1 3.46Å
94	G	97.6	Very high	96.4	Very high	16 Å²	16	41.4 Å²	41.4	17%	0.165	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-36.2	176.1	0	0	0	0	0	113	K90 F91 V92 E97 E98	K90-G94 PolarHBondContact O-N 2.95Å; K90-G94 VanDerWaalsContact O-N 3.1Å; F91-G94 CarbonylContact O-C 3.08Å; F91-G94 WeakPolarHBondContact O-CA 3.44Å; F91-G94 PolarHBondContact O-N 3.31Å; V92-G94 VanDerWaalsContact C-N 3.32Å; V92-G94 PolarHBondContact O-N 3.03Å; G94-E97 WeakPolarHBondContact O-CB 3.43Å; G94-E97 PolarHBondContact O-N 2.98Å; G94-E98 WeakPolarHBondContact O-CG 3.37Å; G94-E98 PolarHBondContact O-N 3.26Å; G94-E98 VanDerWaalsContact O-N 3.16Å
95	F	97.9	Very high	96.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-46.8	174.4	173.9	-96.2	0	0	0	111.4	Q59 I62 I63 L70 L74 I77 I78 F91 V92 I93 E97 E98 A99	Q59-F95 HydrophobicContact CB-CD2 4.22Å; Q59-F95 HydrophobicContact CG-CD2 3.93Å; Q59-F95 HydrophobicContact CG-CE2 4.47Å; I62-F95 HydrophobicContact CD1-CE2 3.76Å; I62-F95 HydrophobicContact CD1-CZ 3.88Å; I62-F95 HydrophobicContact CG1-CE2 4.22Å; I63-F95 HydrophobicContact CD1-CD2 4Å; I63-F95 HydrophobicContact CD1-CE2 3.91Å; I63-F95 HydrophobicContact CG1-CE2 4.2Å; L70-F95 HydrophobicContact CD1-CE2 4.12Å; L70-F95 HydrophobicContact CD1-CZ 3.64Å; L74-F95 HydrophobicContact CD1-CE1 3.91Å; L74-F95 HydrophobicContact CD1-CZ 4.28Å; I77-F95 HydrophobicContact CB-CD1 4.27Å; I77-F95 HydrophobicContact CB-CE1 3.93Å; I77-F95 HydrophobicContact CB-CZ 4.11Å; I77-F95 HydrophobicContact CG1-CE2 4.42Å; I77-F95 HydrophobicContact CG1-CZ 4.21Å; I77-F95 HydrophobicContact CG2-CB 4.29Å; I77-F95 HydrophobicContact CG2-CD1 3.39Å; I77-F95 HydrophobicContact CG2-CD2 3.99Å; I77-F95 HydrophobicContact CG2-CE1 3.57Å; I77-F95 HydrophobicContact CG2-CE2 4.16Å; I77-F95 HydrophobicContact CG2-CG 3.61Å; I77-F95 HydrophobicContact CG2-CZ 3.95Å; I78-F95 HydrophobicContact CD1-CD1 4.25Å; I78-F95 HydrophobicContact CD1-CE1 4.42Å; F91-F95 HydrophobicContact CE1-CB 4.41Å; F91-F95 HydrophobicContact CZ-CB 4.45Å; F91-F95 PolarHBondContact O-N 3.17Å; V92-F95 WeakPolarHBondContact O-CB 2.97Å; V92-F95 PolarHBondContact O-N 3.21Å; I93-F95 VanDerWaalsContact C-N 3.31Å; I93-F95 PolarHBondContact O-N 3.46Å; F95-E97 VanDerWaalsContact C-N 3.25Å; F95-E97 PolarHBondContact O-N 3.02Å; F95-E98 PolarHBondContact O-N 2.78Å; F95-A99 HydrophobicContact CE1-CB 4.39Å; F95-A99 VanDerWaalsContact O-CB 3.28Å; F95-A99 WeakPolarHBondContact O-CB 3.18Å; F95-A99 PolarHBondContact O-N 3.1Å
96	I	97.9	Very high	96.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-43.5	175.1	-68.2	167.6	0	0	0	110.6	I78 V92 I93 A99 C100 L110 N113 L114 L117 L136	I78-I96 HydrophobicContact CD1-CD1 4.05Å; I78-I96 HydrophobicContact CD1-CG1 3.72Å; V92-I96 HydrophobicContact CG1-CD1 4.22Å; V92-I96 WeakPolarHBondContact O-CG1 3.46Å; V92-I96 PolarHBondContact O-N 3.32Å; I93-I96 PolarHBondContact O-N 3.2Å; I96-A99 PolarHBondContact O-N 3.49Å; I96-C100 WeakPolarHBondContact O-CB 3.42Å; I96-C100 PolarHBondContact O-N 3.2Å; I96-C100 PolarHBondContact O-SG 3.35Å; I96-L110 HydrophobicContact CG1-CD1 4.42Å; I96-L110 HydrophobicContact CG1-CD2 4.39Å; I96-L110 HydrophobicContact CG2-CB 4.08Å; I96-L110 HydrophobicContact CG2-CD1 4.23Å; I96-N113 HydrophobicContact CD1-CB 4.35Å; I96-L114 HydrophobicContact CD1-CB 4.49Å; I96-L117 HydrophobicContact CD1-CD1 4.11Å; I96-L136 HydrophobicContact CG2-CD1 4.31Å
97	E	97.4	Very high	96.5	Very high	21 Å²	21	34.7 Å²	34.7	10%	0.098	16%	0.161	C	C	.	.	H	α-helix	trans	-57.6	-49.6	177.5	-168.5	-178.8	149.7	0	0	112.3	I93 G94 F95 K101 K128 T132	I93-E97 PolarHBondContact O-N 2.96Å; G94-E97 WeakPolarHBondContact O-CB 3.43Å; G94-E97 PolarHBondContact O-N 2.98Å; F95-E97 VanDerWaalsContact C-N 3.25Å; F95-E97 PolarHBondContact O-N 3.02Å; E97-K101 VanDerWaalsContact O-CG 3.28Å; E97-K101 WeakPolarHBondContact O-CG 3.46Å; E97-K101 PolarHBondContact O-N 3.01Å; E97-K101 VanDerWaalsContact O-N 3.13Å; E97-K101 IonicContact OE1-NZ 2.81Å; E97-K101 PolarHBondContact OE1-NZ 3.42Å; E97-K128 IonicContact OE2-NZ 3.87Å; E97-K128 PolarHBondContact OE2-NZ 3.15Å; E97-T132 HydrophobicContact CB-CG2 3.59Å; E97-T132 HydrophobicContact CG-CG2 3.92Å; E97-T132 PolarHBondContact OE2-OG1 3.26Å
98	E	96.6	Very high	96.5	Very high	72 Å²	72	33.7 Å²	33.7	34%	0.336	16%	0.158	S	C	.	.	H	α-helix	trans	-74.6	-35.4	-177.6	-64.1	-56.6	123.1	0	0	112.2	I63 G94 F95 K101 R102	I63-E98 HydrophobicContact CD1-CB 3.71Å; G94-E98 WeakPolarHBondContact O-CG 3.37Å; G94-E98 PolarHBondContact O-N 3.26Å; G94-E98 VanDerWaalsContact O-N 3.16Å; F95-E98 PolarHBondContact O-N 2.78Å; E98-K101 PolarHBondContact O-N 3.29Å; E98-K101 IonicContact OE1-NZ 3.04Å; E98-K101 PolarHBondContact OE1-NZ 3.32Å; E98-R102 WeakPolarHBondContact O-CB 3.4Å; E98-R102 PolarHBondContact O-N 3.47Å
99	A	95.9	Very high	96.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-48.5	174.5	0	0	0	0	0	110.6	L70 F95 I96 K101 R102 D103 L106 L110	L70-A99 HydrophobicContact CD1-CB 4.26Å; L70-A99 HydrophobicContact CD2-CB 4.2Å; F95-A99 HydrophobicContact CE1-CB 4.39Å; F95-A99 VanDerWaalsContact O-CB 3.28Å; F95-A99 WeakPolarHBondContact O-CB 3.18Å; F95-A99 PolarHBondContact O-N 3.1Å; I96-A99 PolarHBondContact O-N 3.49Å; A99-K101 VanDerWaalsContact C-N 3.34Å; A99-K101 PolarHBondContact O-N 3.08Å; A99-R102 PolarHBondContact O-N 3.3Å; A99-R102 VanDerWaalsContact O-N 3.16Å; A99-D103 PolarHBondContact O-N 2.99Å; A99-L106 HydrophobicContact CB-CD1 4.43Å; A99-L110 HydrophobicContact CB-CD1 4.19Å
100	C	96.8	Very high	96.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-69.1	-28.6	179.5	-64.3	0	0	0	0	113.4	I96 D103 I104 L136	I96-C100 WeakPolarHBondContact O-CB 3.42Å; I96-C100 PolarHBondContact O-N 3.2Å; I96-C100 PolarHBondContact O-SG 3.35Å; C100-D103 WeakPolarHBondContact CA-O 3.24Å; C100-D103 CarbonylContact O-C 3.59Å; C100-I104 HydrophobicContact CB-CD1 4.25Å; C100-I104 WeakPolarHBondContact O-CA 3.35Å; C100-I104 PolarHBondContact O-N 2.92Å; C100-L136 HydrophobicContact CB-CD1 4.17Å; C100-L136 HydrophobicContact CB-CD2 3.65Å
101	K	93.6	Very high	96.4	Very high	91 Å²	91	35.3 Å²	35.3	40%	0.396	17%	0.166	S	C	.	.	H	α-helix	trans	-71.6	-32.5	172.5	-76.3	173.6	-168	161.3	0	112.1	E97 E98 A99	E97-K101 VanDerWaalsContact O-CG 3.28Å; E97-K101 WeakPolarHBondContact O-CG 3.46Å; E97-K101 PolarHBondContact O-N 3.01Å; E97-K101 VanDerWaalsContact O-N 3.13Å; E97-K101 IonicContact OE1-NZ 2.81Å; E97-K101 PolarHBondContact OE1-NZ 3.42Å; E98-K101 PolarHBondContact O-N 3.29Å; E98-K101 IonicContact OE1-NZ 3.04Å; E98-K101 PolarHBondContact OE1-NZ 3.32Å; A99-K101 VanDerWaalsContact C-N 3.34Å; A99-K101 PolarHBondContact O-N 3.08Å
102	R	94.3	Very high	96.4	Very high	120 Å²	120	36.8 Å²	36.8	45%	0.453	18%	0.181	S	C	.	.	H	α-helix	trans	-75.6	-49.4	176.7	174.1	58.7	69	135.3	6.8	111.1	I63 N64 L70 E98 A99	I63-R102 HydrophobicContact CG2-CB 4.21Å; I63-R102 HydrophobicContact CG2-CG 4.43Å; I63-R102 PolarHBondContact O-NE 3.39Å; I63-R102 PolarHBondContact O-NH2 3.46Å; N64-R102 PolarHBondContact OD1-NH2 3.13Å; L70-R102 HydrophobicContact CD2-CG 4.42Å; E98-R102 WeakPolarHBondContact O-CB 3.4Å; E98-R102 PolarHBondContact O-N 3.47Å; A99-R102 PolarHBondContact O-N 3.3Å; A99-R102 VanDerWaalsContact O-N 3.16Å
103	D	94.9	Very high	96.3	Very high	68 Å²	68	38.2 Å²	38.2	36%	0.364	19%	0.189	S	C	.	.			trans	-139.5	107.9	177.5	-174.9	-2.8	0	0	0	110.1	A99 C100 E105 L106	A99-D103 PolarHBondContact O-N 2.99Å; C100-D103 WeakPolarHBondContact CA-O 3.24Å; C100-D103 CarbonylContact O-C 3.59Å; D103-E105 VanDerWaalsContact C-N 3.3Å; D103-E105 PolarHBondContact O-N 3.39Å; D103-E105 PolarHBondContact OD1-N 2.64Å; D103-E105 VanDerWaalsContact OD1-N 3.08Å; D103-L106 HydrophobicContact CB-CD1 4.08Å; D103-L106 HydrophobicContact CB-CG 4.14Å; D103-L106 PolarHBondContact O-N 3.35Å
104	I	95.3	Very high	96.3	Very high	29 Å²	29	38.2 Å²	38.2	15%	0.149	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-74.9	-18.6	-175	-168.6	56	0	0	0	112.8	C100 L106 L107 V139 W143	C100-I104 HydrophobicContact CB-CD1 4.25Å; C100-I104 WeakPolarHBondContact O-CA 3.35Å; C100-I104 PolarHBondContact O-N 2.92Å; I104-L106 PolarHBondContact O-N 3.15Å; I104-L107 HydrophobicContact CD1-CB 4.18Å; I104-L107 HydrophobicContact CD1-CD2 4Å; I104-L107 WeakPolarHBondContact O-CB 3.38Å; I104-L107 PolarHBondContact O-N 3.34Å; I104-V139 HydrophobicContact CD1-CB 4.49Å; I104-V139 HydrophobicContact CD1-CG1 3.71Å; I104-V139 HydrophobicContact CG1-CG1 4.11Å; I104-W143 HydrophobicContact CB-CG 4.42Å; I104-W143 HydrophobicContact CG1-CB 3.79Å; I104-W143 HydrophobicContact CG1-CD2 4.06Å; I104-W143 HydrophobicContact CG1-CE3 4.31Å; I104-W143 HydrophobicContact CG1-CG 3.88Å; I104-W143 HydrophobicContact CG2-CB 4.02Å; I104-W143 VanDerWaalsContact CG2-CD1 3.42Å; I104-W143 HydrophobicContact CG2-CD2 4.17Å; I104-W143 HydrophobicContact CG2-CG 3.62Å
105	E	94.3	Very high	96.3	Very high	118 Å²	118	38.7 Å²	38.7	55%	0.551	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-67	-25.6	177.8	-65.5	-168.1	174.4	0	0	111.8	D103 L107 L108 W143	D103-E105 VanDerWaalsContact C-N 3.3Å; D103-E105 PolarHBondContact O-N 3.39Å; D103-E105 PolarHBondContact OD1-N 2.64Å; D103-E105 VanDerWaalsContact OD1-N 3.08Å; E105-L107 PolarHBondContact O-N 2.99Å; E105-L107 VanDerWaalsContact O-N 3.13Å; E105-L108 WeakPolarHBondContact O-CB 3.21Å; E105-L108 WeakPolarHBondContact O-CG 3.37Å; E105-L108 PolarHBondContact O-N 3.45Å; E105-L108 VanDerWaalsContact O-N 3.16Å; E105-W143 HydrophobicContact CG-CZ2 4.19Å
106	L	95.7	Very high	96.3	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.047	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-62	-19	173.3	-60.3	179.9	0	0	0	112.8	L70 D71 L74 A99 D103 I104 L108 K109 L110	L70-L106 HydrophobicContact CD2-CD1 3.41Å; L70-L106 VanDerWaalsContact CD2-CD1 3.41Å; L70-L106 HydrophobicContact CG-CD1 3.66Å; D71-L106 WeakPolarHBondContact OD1-CD2 3.48Å; L74-L106 HydrophobicContact CD1-CD1 4.48Å; L74-L106 HydrophobicContact CD2-CD2 4.31Å; A99-L106 HydrophobicContact CB-CD1 4.43Å; D103-L106 HydrophobicContact CB-CD1 4.08Å; D103-L106 HydrophobicContact CB-CG 4.14Å; D103-L106 PolarHBondContact O-N 3.35Å; I104-L106 PolarHBondContact O-N 3.15Å; L106-L108 PolarHBondContact O-N 2.83Å; L106-L108 VanDerWaalsContact O-N 3.17Å; L106-K109 PolarHBondContact O-N 2.62Å; L106-L110 HydrophobicContact CB-CD1 4.07Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.45Å; L106-L110 PolarHBondContact O-N 3.13Å
107	L	96.6	Very high	96.2	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-57.3	-31.2	175.4	-169.5	64.5	0	0	0	111.9	I104 E105 K109 L110 I111 L136 A140 V161	I104-L107 HydrophobicContact CD1-CB 4.18Å; I104-L107 HydrophobicContact CD1-CD2 4Å; I104-L107 WeakPolarHBondContact O-CB 3.38Å; I104-L107 PolarHBondContact O-N 3.34Å; E105-L107 PolarHBondContact O-N 2.99Å; E105-L107 VanDerWaalsContact O-N 3.13Å; L107-K109 PolarHBondContact O-N 3.3Å; L107-L110 PolarHBondContact O-N 3.46Å; L107-I111 HydrophobicContact CD1-CB 4.19Å; L107-I111 HydrophobicContact CD1-CD1 4.15Å; L107-I111 HydrophobicContact CG-CB 4.32Å; L107-I111 VanDerWaalsContact O-CB 3.31Å; L107-I111 WeakPolarHBondContact O-CB 3.29Å; L107-I111 WeakPolarHBondContact O-CG2 3.44Å; L107-I111 PolarHBondContact O-N 3.13Å; L107-L136 HydrophobicContact CD1-CD1 4.49Å; L107-A140 HydrophobicContact CD2-CB 3.64Å; L107-V161 HydrophobicContact CD2-CG2 4.22Å
108	L	96	Very high	96.2	Very high	62 Å²	62	44.3 Å²	44.3	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-55.7	-36.5	174.8	-65	178.4	0	0	0	112.6	E105 L106 W143 L153 Q154 C157	E105-L108 WeakPolarHBondContact O-CB 3.21Å; E105-L108 WeakPolarHBondContact O-CG 3.37Å; E105-L108 PolarHBondContact O-N 3.45Å; E105-L108 VanDerWaalsContact O-N 3.16Å; L106-L108 PolarHBondContact O-N 2.83Å; L106-L108 VanDerWaalsContact O-N 3.17Å; L108-W143 HydrophobicContact CD1-CH2 4.37Å; L108-W143 HydrophobicContact CD2-CH2 3.74Å; L108-W143 HydrophobicContact CD2-CZ3 4.45Å; L108-W143 HydrophobicContact CG-CH2 3.87Å; L108-L153 HydrophobicContact CD2-CB 4.41Å; L108-L153 WeakPolarHBondContact CD2-O 3.39Å; L108-Q154 HydrophobicContact CD1-CG 4.47Å; L108-Q154 HydrophobicContact CD2-CG 4.03Å; L108-C157 HydrophobicContact CD2-CB 3.55Å
109	K	95.4	Very high	96.3	Very high	109 Å²	109	48.7 Å²	48.7	47%	0.474	23%	0.229	S	C	.	.	H	α-helix	trans	-90.9	-28.3	179.4	-57.9	-179.6	-172.8	175.2	0	112	D71 L74 L106 L107 N113	D71-K109 VanDerWaalsContact CG-NZ 3.33Å; D71-K109 IonicContact OD1-NZ 2.61Å; D71-K109 PolarHBondContact OD1-NZ 3.08Å; D71-K109 IonicContact OD2-NZ 3.82Å; D71-K109 PolarHBondContact OD2-NZ 3.43Å; L74-K109 HydrophobicContact CD2-CB 4.25Å; L74-K109 HydrophobicContact CD2-CD 4.08Å; L106-K109 PolarHBondContact O-N 2.62Å; L107-K109 PolarHBondContact O-N 3.3Å; K109-N113 PolarHBondContact O-ND2 2.95Å; K109-N113 VanDerWaalsContact O-ND2 3.1Å
110	L	97	Very high	96.3	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-97.1	-20.3	-169.4	-63.5	179.4	0	0	0	114.8	L74 I78 I96 A99 L106 L107 A112 N113 L114	L74-L110 HydrophobicContact CD1-CD1 4.15Å; L74-L110 HydrophobicContact CD1-CD2 4.06Å; L74-L110 HydrophobicContact CD1-CG 4.49Å; L74-L110 HydrophobicContact CD2-CD2 3.89Å; L74-L110 HydrophobicContact CD2-CG 4.21Å; L74-L110 HydrophobicContact CG-CD2 4.01Å; I78-L110 HydrophobicContact CD1-CD2 3.54Å; I78-L110 HydrophobicContact CG1-CD2 3.62Å; I96-L110 HydrophobicContact CG1-CD1 4.42Å; I96-L110 HydrophobicContact CG1-CD2 4.39Å; I96-L110 HydrophobicContact CG2-CB 4.08Å; I96-L110 HydrophobicContact CG2-CD1 4.23Å; A99-L110 HydrophobicContact CB-CD1 4.19Å; L106-L110 HydrophobicContact CB-CD1 4.07Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.45Å; L106-L110 PolarHBondContact O-N 3.13Å; L107-L110 PolarHBondContact O-N 3.46Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.36Å; L110-N113 WeakPolarHBondContact O-CB 3.44Å; L110-N113 PolarHBondContact O-N 3.49Å; L110-N113 VanDerWaalsContact O-N 3.16Å; L110-L114 PolarHBondContact O-N 3.14Å
111	I	97.2	Very high	96.2	Very high	7 Å²	7	59.8 Å²	59.8	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-38.7	-174.2	-170.6	60.4	0	0	0	112.7	L107 N113 L114 N115 M160 V161 M164	L107-I111 HydrophobicContact CD1-CB 4.19Å; L107-I111 HydrophobicContact CD1-CD1 4.15Å; L107-I111 HydrophobicContact CG-CB 4.32Å; L107-I111 VanDerWaalsContact O-CB 3.31Å; L107-I111 WeakPolarHBondContact O-CB 3.29Å; L107-I111 WeakPolarHBondContact O-CG2 3.44Å; L107-I111 PolarHBondContact O-N 3.13Å; I111-N113 VanDerWaalsContact C-N 3.32Å; I111-N113 PolarHBondContact O-N 3.44Å; I111-L114 PolarHBondContact O-N 3.25Å; I111-N115 PolarHBondContact O-N 3.06Å; I111-M160 HydrophobicContact CB-SD 4.43Å; I111-M160 HydrophobicContact CG1-CB 4.19Å; I111-M160 HydrophobicContact CG1-CG 3.94Å; I111-M160 HydrophobicContact CG1-SD 4Å; I111-M160 HydrophobicContact CG2-SD 3.87Å; I111-V161 HydrophobicContact CD1-CG2 3.59Å; I111-V161 HydrophobicContact CG1-CG2 3.96Å; I111-M164 HydrophobicContact CD1-CE 4.22Å; I111-M164 HydrophobicContact CD1-SD 3.54Å; I111-M164 VanDerWaalsContact CD1-SD 3.54Å; I111-M164 HydrophobicContact CG1-SD 3.98Å
112	A	96.9	Very high	96.4	Very high	47 Å²	47	57.4 Å²	57.4	39%	0.388	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-40.3	177	0	0	0	0	0	111.8	L110 N115 M116 M160	L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.36Å; A112-N115 WeakPolarHBondContact O-CB 3.47Å; A112-N115 PolarHBondContact O-N 2.82Å; A112-M116 WeakPolarHBondContact O-CG 3.36Å; A112-M116 PolarHBondContact O-N 3.19Å; A112-M160 HydrophobicContact CB-SD 4.32Å
113	N	97.7	Very high	96.5	Very high	30 Å²	30	54 Å²	54	16%	0.16	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-43.8	176.3	-67.4	-56.7	0	0	0	111.4	I78 Q81 I96 K109 L110 I111 N115 M116 L117	I78-N113 HydrophobicContact CG2-CB 4.2Å; Q81-N113 PolarHBondContact NE2-OD1 3.48Å; Q81-N113 PolarHBondContact OE1-OD1 3.06Å; Q81-N113 VanDerWaalsContact OE1-OD1 3.12Å; I96-N113 HydrophobicContact CD1-CB 4.35Å; K109-N113 PolarHBondContact O-ND2 2.95Å; K109-N113 VanDerWaalsContact O-ND2 3.1Å; L110-N113 WeakPolarHBondContact O-CB 3.44Å; L110-N113 PolarHBondContact O-N 3.49Å; L110-N113 VanDerWaalsContact O-N 3.16Å; I111-N113 VanDerWaalsContact C-N 3.32Å; I111-N113 PolarHBondContact O-N 3.44Å; N113-N115 VanDerWaalsContact C-N 3.31Å; N113-N115 PolarHBondContact O-N 3.39Å; N113-M116 PolarHBondContact O-N 3.46Å; N113-L117 WeakPolarHBondContact O-CG 3.49Å; N113-L117 PolarHBondContact O-N 2.92Å
114	L	97.9	Very high	96.6	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-36.9	175.4	-172.7	60.3	0	0	0	112.1	I93 I96 L110 I111 L117 L118 A129 T132 M133 L136 M164	I93-L114 HydrophobicContact CG2-CD1 4.05Å; I96-L114 HydrophobicContact CD1-CB 4.49Å; L110-L114 PolarHBondContact O-N 3.14Å; I111-L114 PolarHBondContact O-N 3.25Å; L114-L117 PolarHBondContact O-N 3.31Å; L114-L118 WeakPolarHBondContact O-CB 3.35Å; L114-L118 PolarHBondContact O-N 2.89Å; L114-A129 HydrophobicContact CD1-CB 4.39Å; L114-T132 HydrophobicContact CD1-CG2 4.19Å; L114-T132 HydrophobicContact CD2-CG2 4.22Å; L114-M133 HydrophobicContact CD2-CG 4.02Å; L114-M133 HydrophobicContact CD2-SD 3.58Å; L114-M133 VanDerWaalsContact CD2-SD 3.58Å; L114-M133 HydrophobicContact CG-SD 4.42Å; L114-L136 HydrophobicContact CD2-CD1 4Å; L114-M164 HydrophobicContact CB-CE 4.34Å; L114-M164 HydrophobicContact CD2-CE 4.4Å; L114-M164 HydrophobicContact CG-CE 4.04Å
115	N	97.9	Very high	96.7	Very high	26 Å²	26	52.6 Å²	52.6	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-41.6	174.8	-165	15.4	0	0	0	112.2	I111 A112 N113 L117 L118 R119 M164	I111-N115 PolarHBondContact O-N 3.06Å; A112-N115 WeakPolarHBondContact O-CB 3.47Å; A112-N115 PolarHBondContact O-N 2.82Å; N113-N115 VanDerWaalsContact C-N 3.31Å; N113-N115 PolarHBondContact O-N 3.39Å; N115-L117 VanDerWaalsContact C-N 3.31Å; N115-L117 PolarHBondContact O-N 3.5Å; N115-L118 PolarHBondContact O-N 2.83Å; N115-R119 PolarHBondContact O-N 3.19Å; N115-M164 HydrophobicContact CB-CE 3.93Å; N115-M164 HydrophobicContact CB-CG 4.18Å; N115-M164 HydrophobicContact CB-SD 3.55Å; N115-M164 VanDerWaalsContact CB-SD 3.55Å
116	M	96.8	Very high	96.9	Very high	124 Å²	124	47.3 Å²	47.3	61%	0.611	24%	0.235	S	C	*	.	H	α-helix	trans	-60.4	-42.5	173.8	-69.4	177.7	66.1	0	0	111.6	A112 N113 R119 D120	A112-M116 WeakPolarHBondContact O-CG 3.36Å; A112-M116 PolarHBondContact O-N 3.19Å; N113-M116 PolarHBondContact O-N 3.46Å; M116-R119 CarbonylContact O-C 3.5Å; M116-R119 PolarHBondContact O-N 2.9Å; M116-R119 VanDerWaalsContact O-N 3.17Å; M116-D120 PolarHBondContact O-N 3.49Å
117	L	96.6	Very high	97.1	Very high	5 Å²	5	49 Å²	49	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-71.6	-27.4	178.3	-72.1	160.5	0	0	0	113.4	Q81 R89 V92 I93 I96 N113 L114 N115 R119 D120 V125	Q81-L117 HydrophobicContact CB-CD1 4.27Å; Q81-L117 HydrophobicContact CB-CD2 4.32Å; R89-L117 HydrophobicContact CB-CD2 4.16Å; V92-L117 HydrophobicContact CG1-CD1 4.31Å; I93-L117 HydrophobicContact CD1-CB 4.11Å; I93-L117 HydrophobicContact CD1-CD2 4.5Å; I93-L117 HydrophobicContact CG1-CB 4Å; I93-L117 HydrophobicContact CG1-CD1 3.73Å; I93-L117 HydrophobicContact CG1-CD2 4.34Å; I93-L117 HydrophobicContact CG1-CG 4.24Å; I96-L117 HydrophobicContact CD1-CD1 4.11Å; N113-L117 WeakPolarHBondContact O-CG 3.49Å; N113-L117 PolarHBondContact O-N 2.92Å; L114-L117 PolarHBondContact O-N 3.31Å; N115-L117 VanDerWaalsContact C-N 3.31Å; N115-L117 PolarHBondContact O-N 3.5Å; L117-R119 PolarHBondContact O-N 3.12Å; L117-D120 WeakPolarHBondContact O-CB 3.34Å; L117-D120 PolarHBondContact O-N 3.4Å; L117-V125 HydrophobicContact CD2-CG1 4.03Å
118	L	97.8	Very high	97.1	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-26.6	170.5	-176.2	64.9	0	0	0	111.8	L114 N115 V126 A129 I130 M164 I168 L171	L114-L118 WeakPolarHBondContact O-CB 3.35Å; L114-L118 PolarHBondContact O-N 2.89Å; N115-L118 PolarHBondContact O-N 2.83Å; L118-V126 HydrophobicContact CD1-CG1 4.26Å; L118-V126 WeakPolarHBondContact O-CG2 3.41Å; L118-A129 HydrophobicContact CB-CB 4.16Å; L118-A129 HydrophobicContact CD1-CB 3.94Å; L118-I130 HydrophobicContact CD1-CG1 3.77Å; L118-M164 HydrophobicContact CD2-CB 4.43Å; L118-M164 HydrophobicContact CD2-CE 4.07Å; L118-I168 HydrophobicContact CD1-CD1 4.4Å; L118-I168 HydrophobicContact CD1-CG1 4.1Å; L118-I168 HydrophobicContact CD2-CD1 4.27Å; L118-I168 HydrophobicContact CD2-CG1 3.92Å; L118-L171 HydrophobicContact CD1-CD1 4.43Å
119	R	97.1	Very high	97.3	Very high	164 Å²	164	48.3 Å²	48.3	62%	0.619	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	19.3	177.8	-62.1	177	179.6	-177.5	-1.6	113	N115 M116 L117 D167	N115-R119 PolarHBondContact O-N 3.19Å; M116-R119 CarbonylContact O-C 3.5Å; M116-R119 PolarHBondContact O-N 2.9Å; M116-R119 VanDerWaalsContact O-N 3.17Å; L117-R119 PolarHBondContact O-N 3.12Å; R119-D167 IonicContact CZ-OD2 2.77Å; R119-D167 IonicContact NE-OD2 2.78Å; R119-D167 IonicContact NH2-OD2 3.73Å; R119-D167 PolarHBondContact NH2-OD2 3.36Å
120	D	97.3	Very high	97.4	Very high	33 Å²	33	43.1 Å²	43.1	18%	0.176	21%	0.213	C	C	.	.			trans	-64.6	147	177.4	-163.6	-84.2	0	0	0	111.4	R89 M116 L117 N122 V125 V126	R89-D120 IonicContact CZ-OD1 3.83Å; R89-D120 IonicContact CZ-OD2 3.94Å; R89-D120 IonicContact NE-OD1 3.61Å; R89-D120 IonicContact NE-OD2 3.86Å; R89-D120 PolarHBondContact NE-OD2 3Å; R89-D120 IonicContact NH2-OD1 3.23Å; R89-D120 PolarHBondContact NH2-OD1 2.84Å; R89-D120 IonicContact NH2-OD2 3.96Å; R89-D120 PolarHBondContact NH2-OD2 3.28Å; M116-D120 PolarHBondContact O-N 3.49Å; L117-D120 WeakPolarHBondContact O-CB 3.34Å; L117-D120 PolarHBondContact O-N 3.4Å; D120-N122 PolarHBondContact O-N 2.74Å; D120-N122 VanDerWaalsContact OD1-CB 3.28Å; D120-N122 WeakPolarHBondContact OD1-CB 3.42Å; D120-N122 PolarHBondContact OD1-N 2.81Å; D120-V125 HydrophobicContact CB-CB 3.9Å; D120-V125 HydrophobicContact CB-CG1 3.72Å; D120-V126 HydrophobicContact CB-CG2 4.33Å; D120-V126 VanDerWaalsContact O-CG2 3.3Å; D120-V126 WeakPolarHBondContact O-CG2 3.25Å
121	E	94.3	Very high	97.4	Very high	201 Å²	201	46.6 Å²	46.6	94%	0.939	23%	0.231	S	C	*	.	S	Bend	trans	-64.6	-25.9	177.1	-60.8	-177.2	169.2	0	0	112.2
122	N	97.1	Very high	97.5	Very high	40 Å²	40	46.2 Å²	46.2	21%	0.214	23%	0.23	C	C	.	.	S	Bend	trans	-91.7	120.1	-177.9	-166.7	-79.2	0	0	0	112.7	I86 D120 N124 V125 V126	I86-N122 WeakPolarHBondContact CD1-ND2 3.37Å; I86-N122 HydrophobicContact CG1-CB 4.47Å; D120-N122 PolarHBondContact O-N 2.74Å; D120-N122 VanDerWaalsContact OD1-CB 3.28Å; D120-N122 WeakPolarHBondContact OD1-CB 3.42Å; D120-N122 PolarHBondContact OD1-N 2.81Å; N122-N124 PolarHBondContact O-N 3.38Å; N122-N124 VanDerWaalsContact O-N 3.08Å; N122-N124 VanDerWaalsContact OD1-CB 3.3Å; N122-N124 WeakPolarHBondContact OD1-CB 3.31Å; N122-N124 PolarHBondContact OD1-N 2.86Å; N122-V125 HydrophobicContact CB-CB 4.5Å; N122-V125 HydrophobicContact CB-CG2 3.96Å; N122-V125 WeakPolarHBondContact O-CB 3.48Å; N122-V125 PolarHBondContact O-N 2.91Å; N122-V126 PolarHBondContact O-N 2.7Å
123	V	97.2	Very high	97.6	Very high	49 Å²	49	44.1 Å²	44.1	30%	0.297	21%	0.212	S	C	.	.	H	α-helix	trans	-57.9	-27.6	-179.5	-56.3	0	0	0	0	114.5	K127 N176 I179	V123-K127 WeakPolarHBondContact O-CB 3.49Å; V123-K127 VanDerWaalsContact O-CE 3.31Å; V123-K127 WeakPolarHBondContact O-CE 3.36Å; V123-K127 VanDerWaalsContact O-CG 3.23Å; V123-K127 WeakPolarHBondContact O-CG 3.42Å; V123-K127 PolarHBondContact O-N 3.09Å; V123-N176 HydrophobicContact CG1-CB 4.28Å; V123-I179 HydrophobicContact CB-CD1 4.05Å; V123-I179 HydrophobicContact CB-CG1 4.38Å; V123-I179 HydrophobicContact CG1-CD1 3.97Å
124	N	96.9	Very high	97.6	Very high	67 Å²	67	44 Å²	44	36%	0.358	21%	0.212	S	C	.	.	H	α-helix	trans	-74.9	-29.7	178.3	-62.7	-45.4	0	0	0	112.4	I86 K90 N122 K127 K128	I86-N124 HydrophobicContact CG2-CB 4.31Å; K90-N124 HydrophobicContact CD-CB 4.48Å; N122-N124 PolarHBondContact O-N 3.38Å; N122-N124 VanDerWaalsContact O-N 3.08Å; N122-N124 VanDerWaalsContact OD1-CB 3.3Å; N122-N124 WeakPolarHBondContact OD1-CB 3.31Å; N122-N124 PolarHBondContact OD1-N 2.86Å; N124-K127 WeakPolarHBondContact OD1-CE 3.35Å; N124-K127 PolarHBondContact OD1-NZ 3.33Å; N124-K128 PolarHBondContact O-N 2.85Å
125	V	98	Very high	97.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.8	-48.8	173.6	-176.9	0	0	0	0	109	I86 R89 K90 I93 L117 D120 N122 K127 K128 A129	I86-V125 HydrophobicContact CG2-CG2 3.83Å; R89-V125 HydrophobicContact CB-CG1 4.31Å; R89-V125 HydrophobicContact CB-CG2 4.3Å; K90-V125 HydrophobicContact CG-CG2 4.34Å; I93-V125 HydrophobicContact CD1-CG1 3.55Å; I93-V125 WeakPolarHBondContact CD1-O 3.29Å; L117-V125 HydrophobicContact CD2-CG1 4.03Å; D120-V125 HydrophobicContact CB-CB 3.9Å; D120-V125 HydrophobicContact CB-CG1 3.72Å; N122-V125 HydrophobicContact CB-CB 4.5Å; N122-V125 HydrophobicContact CB-CG2 3.96Å; N122-V125 WeakPolarHBondContact O-CB 3.48Å; N122-V125 PolarHBondContact O-N 2.91Å; V125-K127 PolarHBondContact O-N 3.29Å; V125-K128 PolarHBondContact O-N 2.94Å; V125-A129 PolarHBondContact O-N 2.89Å
126	V	98.4	Very high	97.5	Very high	8 Å²	8	46.1 Å²	46.1	5%	0.048	22%	0.221	C	C	.	.	H	α-helix	trans	-56.7	-47.3	176.1	-179.1	0	0	0	0	111.7	L118 D120 N122 K128 A129 I130 L171 I179	L118-V126 HydrophobicContact CD1-CG1 4.26Å; L118-V126 WeakPolarHBondContact O-CG2 3.41Å; D120-V126 HydrophobicContact CB-CG2 4.33Å; D120-V126 VanDerWaalsContact O-CG2 3.3Å; D120-V126 WeakPolarHBondContact O-CG2 3.25Å; N122-V126 PolarHBondContact O-N 2.7Å; V126-K128 VanDerWaalsContact C-N 3.28Å; V126-K128 PolarHBondContact O-N 2.97Å; V126-A129 WeakPolarHBondContact O-CB 3.42Å; V126-A129 PolarHBondContact O-N 3.26Å; V126-A129 VanDerWaalsContact O-N 3.09Å; V126-I130 HydrophobicContact CG1-CD1 4.09Å; V126-I130 HydrophobicContact CG1-CG1 4.48Å; V126-I130 WeakPolarHBondContact O-CG1 3.04Å; V126-I130 PolarHBondContact O-N 3.13Å; V126-L171 HydrophobicContact CG1-CD1 4.22Å; V126-I179 HydrophobicContact CB-CD1 4.27Å; V126-I179 HydrophobicContact CG1-CD1 4.04Å; V126-I179 HydrophobicContact CG1-CG1 4.4Å
127	K	98.1	Very high	97.5	Very high	44 Å²	44	40.5 Å²	40.5	19%	0.191	19%	0.193	C	C	.	.	H	α-helix	trans	-56.3	-41.3	175.4	-76.1	179.5	-59.9	-176.4	0	112.4	V123 N124 V125 L131 I179	V123-K127 WeakPolarHBondContact O-CB 3.49Å; V123-K127 VanDerWaalsContact O-CE 3.31Å; V123-K127 WeakPolarHBondContact O-CE 3.36Å; V123-K127 VanDerWaalsContact O-CG 3.23Å; V123-K127 WeakPolarHBondContact O-CG 3.42Å; V123-K127 PolarHBondContact O-N 3.09Å; N124-K127 WeakPolarHBondContact OD1-CE 3.35Å; N124-K127 PolarHBondContact OD1-NZ 3.33Å; V125-K127 PolarHBondContact O-N 3.29Å; K127-L131 WeakPolarHBondContact O-CG 3.49Å; K127-L131 PolarHBondContact O-N 3.39Å; K127-I179 HydrophobicContact CG-CG1 4.1Å
128	K	98.3	Very high	97.5	Very high	50 Å²	50	41.6 Å²	41.6	22%	0.217	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-37.2	176.9	179.9	52.7	-174.3	147.3	0	111.6	K90 I93 E97 N124 V125 V126 L131 T132	K90-K128 HydrophobicContact CB-CG 4.4Å; K90-K128 HydrophobicContact CG-CB 4.23Å; K90-K128 HydrophobicContact CG-CG 4.47Å; I93-K128 HydrophobicContact CB-CG 4.02Å; I93-K128 HydrophobicContact CD1-CB 4.17Å; I93-K128 HydrophobicContact CD1-CG 4.18Å; I93-K128 HydrophobicContact CG2-CD 4.49Å; I93-K128 HydrophobicContact CG2-CG 3.84Å; E97-K128 IonicContact OE2-NZ 3.87Å; E97-K128 PolarHBondContact OE2-NZ 3.15Å; N124-K128 PolarHBondContact O-N 2.85Å; V125-K128 PolarHBondContact O-N 2.94Å; V126-K128 VanDerWaalsContact C-N 3.28Å; V126-K128 PolarHBondContact O-N 2.97Å; K128-L131 PolarHBondContact O-N 3.32Å; K128-T132 PolarHBondContact NZ-OG1 2.99Å; K128-T132 PolarHBondContact O-N 3.21Å; K128-T132 PolarHBondContact O-OG1 3.49Å
129	A	98.5	Very high	97.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-43.5	174.6	0	0	0	0	0	111.9	I93 L114 L118 V125 V126 L131 T132 M133	I93-A129 HydrophobicContact CD1-CB 4.05Å; L114-A129 HydrophobicContact CD1-CB 4.39Å; L118-A129 HydrophobicContact CB-CB 4.16Å; L118-A129 HydrophobicContact CD1-CB 3.94Å; V125-A129 PolarHBondContact O-N 2.89Å; V126-A129 WeakPolarHBondContact O-CB 3.42Å; V126-A129 PolarHBondContact O-N 3.26Å; V126-A129 VanDerWaalsContact O-N 3.09Å; A129-L131 PolarHBondContact O-N 2.77Å; A129-T132 PolarHBondContact O-N 3.44Å; A129-M133 PolarHBondContact O-N 2.92Å
130	I	98.5	Very high	97.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.6	-43.7	175.8	-63.7	166.5	0	0	0	111.2	L118 V126 T132 M133 T134 I168 L171 I179 H182 F186	L118-I130 HydrophobicContact CD1-CG1 3.77Å; V126-I130 HydrophobicContact CG1-CD1 4.09Å; V126-I130 HydrophobicContact CG1-CG1 4.48Å; V126-I130 WeakPolarHBondContact O-CG1 3.04Å; V126-I130 PolarHBondContact O-N 3.13Å; I130-T132 VanDerWaalsContact C-N 3.31Å; I130-T132 PolarHBondContact O-N 3.24Å; I130-M133 PolarHBondContact O-N 2.63Å; I130-T134 PolarHBondContact O-N 3.36Å; I130-T134 PolarHBondContact O-OG1 3.25Å; I130-I168 HydrophobicContact CG1-CD1 4.47Å; I130-I168 HydrophobicContact CG1-CG1 4.3Å; I130-I168 HydrophobicContact CG1-CG2 4.3Å; I130-I168 HydrophobicContact CG2-CG2 3.94Å; I130-L171 HydrophobicContact CD1-CD1 3.91Å; I130-L171 HydrophobicContact CG1-CD1 4.4Å; I130-I179 HydrophobicContact CD1-CG2 4.04Å; I130-H182 HydrophobicContact CB-CB 4.19Å; I130-H182 HydrophobicContact CD1-CB 4.17Å; I130-H182 HydrophobicContact CG2-CB 3.88Å; I130-H182 WeakPolarHBondContact CG2-O 3.3Å; I130-F186 HydrophobicContact CG2-CB 3.87Å
131	L	97.9	Very high	97.4	Very high	73 Å²	73	33.8 Å²	33.8	38%	0.382	17%	0.17	S	C	.	.	H	α-helix	trans	-60.1	-42.5	176.3	-72.2	174.2	0	0	0	112.1	K127 K128 A129 T134 Q135	K127-L131 WeakPolarHBondContact O-CG 3.49Å; K127-L131 PolarHBondContact O-N 3.39Å; K128-L131 PolarHBondContact O-N 3.32Å; A129-L131 PolarHBondContact O-N 2.77Å; L131-T134 WeakPolarHBondContact O-CB 3.42Å; L131-T134 PolarHBondContact O-N 3.27Å; L131-Q135 PolarHBondContact O-N 3.1Å
132	T	98.3	Very high	97.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-42.9	178.5	-68.5	0	0	0	0	111.2	I93 E97 L114 K128 A129 I130 T134 Q135 L136	I93-T132 HydrophobicContact CG2-CG2 4.07Å; I93-T132 VanDerWaalsContact CG2-OG1 3.29Å; I93-T132 WeakPolarHBondContact CG2-OG1 3.46Å; E97-T132 HydrophobicContact CB-CG2 3.59Å; E97-T132 HydrophobicContact CG-CG2 3.92Å; E97-T132 PolarHBondContact OE2-OG1 3.26Å; L114-T132 HydrophobicContact CD1-CG2 4.19Å; L114-T132 HydrophobicContact CD2-CG2 4.22Å; K128-T132 PolarHBondContact NZ-OG1 2.99Å; K128-T132 PolarHBondContact O-N 3.21Å; K128-T132 PolarHBondContact O-OG1 3.49Å; A129-T132 PolarHBondContact O-N 3.44Å; I130-T132 VanDerWaalsContact C-N 3.31Å; I130-T132 PolarHBondContact O-N 3.24Å; T132-T134 VanDerWaalsContact C-N 3.26Å; T132-T134 PolarHBondContact O-N 3.01Å; T132-Q135 PolarHBondContact O-N 3.49Å; T132-L136 HydrophobicContact CG2-CD1 3.71Å; T132-L136 HydrophobicContact CG2-CG 4.08Å; T132-L136 WeakPolarHBondContact O-CG 3.47Å; T132-L136 PolarHBondContact O-N 3.08Å
133	M	98.4	Very high	97.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-35.1	171.9	-80.6	-61.8	-67.6	0	0	112.8	L114 A129 I130 Q135 L136 Y137 V161 M164 I168 F186	L114-M133 HydrophobicContact CD2-CG 4.02Å; L114-M133 HydrophobicContact CD2-SD 3.58Å; L114-M133 VanDerWaalsContact CD2-SD 3.58Å; L114-M133 HydrophobicContact CG-SD 4.42Å; A129-M133 PolarHBondContact O-N 2.92Å; I130-M133 PolarHBondContact O-N 2.63Å; M133-Q135 PolarHBondContact O-N 2.78Å; M133-L136 PolarHBondContact O-N 2.96Å; M133-Y137 VanDerWaalsContact O-CB 3.27Å; M133-Y137 WeakPolarHBondContact O-CB 3.32Å; M133-Y137 PolarHBondContact O-N 2.95Å; M133-V161 HydrophobicContact CE-CG1 4.37Å; M133-M164 HydrophobicContact CE-CB 3.82Å; M133-M164 HydrophobicContact CE-CE 4.18Å; M133-M164 HydrophobicContact CG-CE 4.08Å; M133-M164 HydrophobicContact SD-CE 3.68Å; M133-I168 HydrophobicContact CB-CD1 3.63Å; M133-I168 HydrophobicContact CG-CD1 3.92Å; M133-F186 HydrophobicContact CB-CD2 4.28Å; M133-F186 HydrophobicContact CB-CE2 3.99Å
134	T	97.4	Very high	97.4	Very high	27 Å²	27	23.9 Å²	23.9	17%	0.166	12%	0.118	C	C	.	.	H	α-helix	trans	-60.9	-32	175.3	-52	0	0	0	0	112.1	I130 L131 T132	I130-T134 PolarHBondContact O-N 3.36Å; I130-T134 PolarHBondContact O-OG1 3.25Å; L131-T134 WeakPolarHBondContact O-CB 3.42Å; L131-T134 PolarHBondContact O-N 3.27Å; T132-T134 VanDerWaalsContact C-N 3.26Å; T132-T134 PolarHBondContact O-N 3.01Å
135	Q	96.4	Very high	97.3	Very high	69 Å²	69	21.8 Å²	21.8	32%	0.322	11%	0.108	S	C	.	.	H	α-helix	trans	-84.4	-44.2	174.5	-58.4	-48.6	-54.7	0	0	111.9	L131 T132 M133 K138 V139	L131-Q135 PolarHBondContact O-N 3.1Å; T132-Q135 PolarHBondContact O-N 3.49Å; M133-Q135 PolarHBondContact O-N 2.78Å; Q135-K138 VanDerWaalsContact O-CG 3.24Å; Q135-K138 WeakPolarHBondContact O-CG 3.43Å; Q135-V139 WeakPolarHBondContact O-CG2 3.47Å
136	L	97.4	Very high	97.1	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-76.1	-29.2	-171.6	-64.9	-173.5	0	0	0	113.6	I96 C100 L107 L114 T132 M133 K138 V139 A140	I96-L136 HydrophobicContact CG2-CD1 4.31Å; C100-L136 HydrophobicContact CB-CD1 4.17Å; C100-L136 HydrophobicContact CB-CD2 3.65Å; L107-L136 HydrophobicContact CD1-CD1 4.49Å; L114-L136 HydrophobicContact CD2-CD1 4Å; T132-L136 HydrophobicContact CG2-CD1 3.71Å; T132-L136 HydrophobicContact CG2-CG 4.08Å; T132-L136 WeakPolarHBondContact O-CG 3.47Å; T132-L136 PolarHBondContact O-N 3.08Å; M133-L136 PolarHBondContact O-N 2.96Å; L136-K138 PolarHBondContact O-N 2.82Å; L136-V139 PolarHBondContact O-N 3.4Å; L136-V139 VanDerWaalsContact O-N 3.14Å; L136-A140 VanDerWaalsContact O-CB 3.3Å; L136-A140 WeakPolarHBondContact O-CB 3.37Å; L136-A140 PolarHBondContact O-N 3.31Å
137	Y	98.3	Very high	96.8	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.02	14%	0.144	C	C	.	.	H	α-helix	trans	-55.9	-51	-179	-178.5	-88	0	0	0	112.3	M133 V139 A140 L141 W158 V161 A165 F186 L190 T193 L194	M133-Y137 VanDerWaalsContact O-CB 3.27Å; M133-Y137 WeakPolarHBondContact O-CB 3.32Å; M133-Y137 PolarHBondContact O-N 2.95Å; Y137-V139 VanDerWaalsContact C-N 3.33Å; Y137-V139 PolarHBondContact O-N 3.27Å; Y137-A140 PolarHBondContact O-N 3.31Å; Y137-L141 HydrophobicContact CE1-CD2 4.45Å; Y137-L141 WeakPolarHBondContact O-CB 3.46Å; Y137-L141 PolarHBondContact O-N 2.93Å; Y137-W158 HydrophobicContact CE2-CH2 4.17Å; Y137-W158 AromaticContact CZ-CH2 3.98Å; Y137-V161 HydrophobicContact CD2-CG1 3.73Å; Y137-V161 HydrophobicContact CE2-CG1 4.17Å; Y137-A165 HydrophobicContact CD2-CB 3.94Å; Y137-A165 HydrophobicContact CE2-CB 3.7Å; Y137-F186 HydrophobicContact CD2-CZ 4.46Å; Y137-L190 HydrophobicContact CD1-CD1 3.86Å; Y137-L190 HydrophobicContact CD2-CD1 4.34Å; Y137-L190 HydrophobicContact CE1-CD1 3.3Å; Y137-L190 HydrophobicContact CE2-CD1 3.82Å; Y137-L190 HydrophobicContact CG-CD1 4.36Å; Y137-T193 HydrophobicContact CD1-CG2 4.32Å; Y137-T193 HydrophobicContact CE1-CG2 4.14Å; Y137-L194 HydrophobicContact CE1-CD2 4.1Å; Y137-L194 HydrophobicContact CE1-CG 4.42Å
138	K	95.3	Very high	96.1	Very high	28 Å²	28	39 Å²	39	12%	0.122	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-32	178.2	58.5	178.5	-178.2	172.3	0	113.1	Q135 L136 Q142 T193 D210 I211	Q135-K138 VanDerWaalsContact O-CG 3.24Å; Q135-K138 WeakPolarHBondContact O-CG 3.43Å; L136-K138 PolarHBondContact O-N 2.82Å; K138-Q142 VanDerWaalsContact O-CB 3.27Å; K138-Q142 WeakPolarHBondContact O-CB 3.44Å; K138-Q142 PolarHBondContact O-N 3.47Å; K138-T193 HydrophobicContact CB-CG2 4.24Å; K138-D210 HydrophobicContact CD-CB 4.21Å; K138-D210 VanDerWaalsContact NZ-CG 3.27Å; K138-D210 IonicContact NZ-OD1 2.96Å; K138-D210 PolarHBondContact NZ-OD1 3.07Å; K138-D210 IonicContact NZ-OD2 3.31Å; K138-D210 PolarHBondContact NZ-OD2 3.21Å; K138-I211 HydrophobicContact CB-CG2 4.33Å; K138-I211 VanDerWaalsContact O-CG2 3.27Å; K138-I211 WeakPolarHBondContact O-CG2 3.28Å
139	V	96.6	Very high	95.6	Very high	42 Å²	42	42.5 Å²	42.5	26%	0.255	20%	0.204	S	C	.	.	H	α-helix	trans	-71.7	-43.1	177	-179.2	0	0	0	0	110.2	I104 Q135 L136 Y137 Q142 W143	I104-V139 HydrophobicContact CD1-CB 4.49Å; I104-V139 HydrophobicContact CD1-CG1 3.71Å; I104-V139 HydrophobicContact CG1-CG1 4.11Å; Q135-V139 WeakPolarHBondContact O-CG2 3.47Å; L136-V139 PolarHBondContact O-N 3.4Å; L136-V139 VanDerWaalsContact O-N 3.14Å; Y137-V139 VanDerWaalsContact C-N 3.33Å; Y137-V139 PolarHBondContact O-N 3.27Å; V139-Q142 PolarHBondContact O-N 3.23Å; V139-W143 WeakPolarHBondContact O-CB 3.47Å; V139-W143 PolarHBondContact O-N 3.15Å
140	A	97.4	Very high	95.4	Very high	2 Å²	2	43.8 Å²	43.8	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-46.6	175.2	0	0	0	0	0	111.2	L107 L136 Y137 Q142 W143 M144 W158 V161	L107-A140 HydrophobicContact CD2-CB 3.64Å; L136-A140 VanDerWaalsContact O-CB 3.3Å; L136-A140 WeakPolarHBondContact O-CB 3.37Å; L136-A140 PolarHBondContact O-N 3.31Å; Y137-A140 PolarHBondContact O-N 3.31Å; A140-Q142 VanDerWaalsContact C-N 3.33Å; A140-Q142 PolarHBondContact O-N 2.85Å; A140-W143 WeakPolarHBondContact O-CB 3.4Å; A140-W143 PolarHBondContact O-N 3.04Å; A140-W143 VanDerWaalsContact O-N 3.15Å; A140-M144 WeakPolarHBondContact O-CG 3.49Å; A140-M144 PolarHBondContact O-N 3.21Å; A140-W158 HydrophobicContact CB-CZ3 4.33Å; A140-V161 HydrophobicContact CB-CG1 4.32Å; A140-V161 HydrophobicContact CB-CG2 4.41Å
141	L	97	Very high	95.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-43	176.4	-179.6	57	0	0	0	111.4	Y137 W143 M144 V145 W158 T193 L194 I211 I216 I223 L228	Y137-L141 HydrophobicContact CE1-CD2 4.45Å; Y137-L141 WeakPolarHBondContact O-CB 3.46Å; Y137-L141 PolarHBondContact O-N 2.93Å; L141-W143 VanDerWaalsContact C-N 3.28Å; L141-W143 PolarHBondContact O-N 3.13Å; L141-M144 PolarHBondContact O-N 2.94Å; L141-V145 HydrophobicContact CD1-CG2 4.08Å; L141-V145 VanDerWaalsContact O-CG2 3.29Å; L141-V145 WeakPolarHBondContact O-CG2 3.48Å; L141-V145 PolarHBondContact O-N 3.26Å; L141-W158 VanDerWaalsContact CA-CZ3 3.5Å; L141-W158 HydrophobicContact CB-CH2 3.64Å; L141-W158 HydrophobicContact CB-CZ3 3.71Å; L141-W158 HydrophobicContact CD1-CH2 3.49Å; L141-W158 VanDerWaalsContact CD1-CH2 3.49Å; L141-W158 HydrophobicContact CD1-CZ2 3.82Å; L141-W158 HydrophobicContact CD1-CZ3 4.07Å; L141-W158 HydrophobicContact CD2-CH2 4.43Å; L141-W158 HydrophobicContact CG-CH2 4.01Å; L141-W158 HydrophobicContact CG-CZ3 4.46Å; L141-T193 HydrophobicContact CD2-CG2 3.68Å; L141-L194 HydrophobicContact CD2-CD2 3.93Å; L141-I211 HydrophobicContact CB-CG2 4.16Å; L141-I211 HydrophobicContact CD2-CG2 4.07Å; L141-I211 HydrophobicContact CG-CD1 4.44Å; L141-I211 HydrophobicContact CG-CG2 4.11Å; L141-I216 HydrophobicContact CD1-CD1 4.19Å; L141-I216 HydrophobicContact CD2-CD1 4.06Å; L141-I216 HydrophobicContact CG-CD1 4.37Å; L141-I223 HydrophobicContact CD1-CD1 4.45Å; L141-I223 HydrophobicContact CD1-CG2 4.2Å; L141-L228 HydrophobicContact CD1-CD1 4Å; L141-L228 HydrophobicContact CD2-CD1 4.43Å
142	Q	96.1	Very high	94.8	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.252	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-37.8	176.2	-174.2	178.7	-57.6	0	0	112.5	K138 V139 A140 K146 H209 I211	K138-Q142 VanDerWaalsContact O-CB 3.27Å; K138-Q142 WeakPolarHBondContact O-CB 3.44Å; K138-Q142 PolarHBondContact O-N 3.47Å; V139-Q142 PolarHBondContact O-N 3.23Å; A140-Q142 VanDerWaalsContact C-N 3.33Å; A140-Q142 PolarHBondContact O-N 2.85Å; Q142-K146 HydrophobicContact CG-CD 4.04Å; Q142-K146 WeakPolarHBondContact O-CB 3.46Å; Q142-K146 VanDerWaalsContact O-CG 3.3Å; Q142-K146 WeakPolarHBondContact O-CG 3.39Å; Q142-K146 PolarHBondContact O-N 2.83Å; Q142-H209 PolarHBondContact OE1-O 3.45Å; Q142-I211 HydrophobicContact CB-CB 4.02Å; Q142-I211 HydrophobicContact CB-CD1 4.17Å; Q142-I211 HydrophobicContact CB-CG2 4.08Å; Q142-I211 HydrophobicContact CG-CB 4.41Å; Q142-I211 HydrophobicContact CG-CD1 4.42Å
143	W	96.6	Very high	94.5	Very high	26 Å²	26	56.8 Å²	56.8	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-45.8	175.5	171.4	61.2	0	0	0	111.9	I104 E105 L108 V139 A140 L141 V145 K146 S147 Q154	I104-W143 HydrophobicContact CB-CG 4.42Å; I104-W143 HydrophobicContact CG1-CB 3.79Å; I104-W143 HydrophobicContact CG1-CD2 4.06Å; I104-W143 HydrophobicContact CG1-CE3 4.31Å; I104-W143 HydrophobicContact CG1-CG 3.88Å; I104-W143 HydrophobicContact CG2-CB 4.02Å; I104-W143 VanDerWaalsContact CG2-CD1 3.42Å; I104-W143 HydrophobicContact CG2-CD2 4.17Å; I104-W143 HydrophobicContact CG2-CG 3.62Å; E105-W143 HydrophobicContact CG-CZ2 4.19Å; L108-W143 HydrophobicContact CD1-CH2 4.37Å; L108-W143 HydrophobicContact CD2-CH2 3.74Å; L108-W143 HydrophobicContact CD2-CZ3 4.45Å; L108-W143 HydrophobicContact CG-CH2 3.87Å; V139-W143 WeakPolarHBondContact O-CB 3.47Å; V139-W143 PolarHBondContact O-N 3.15Å; A140-W143 WeakPolarHBondContact O-CB 3.4Å; A140-W143 PolarHBondContact O-N 3.04Å; A140-W143 VanDerWaalsContact O-N 3.15Å; L141-W143 VanDerWaalsContact C-N 3.28Å; L141-W143 PolarHBondContact O-N 3.13Å; W143-V145 VanDerWaalsContact C-N 3.31Å; W143-V145 PolarHBondContact O-N 3.27Å; W143-K146 PolarHBondContact O-N 3.25Å; W143-S147 PolarHBondContact O-N 3.09Å; W143-S147 PolarHBondContact O-OG 2.91Å; W143-Q154 HydrophobicContact CH2-CB 4.39Å; W143-Q154 HydrophobicContact CH2-CG 3.55Å; W143-Q154 HydrophobicContact CZ2-CG 3.79Å; W143-Q154 HydrophobicContact CZ3-CG 4.29Å
144	M	95.5	Very high	94.3	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-57.5	-44.8	176	-67.2	-57.7	-70.3	0	0	111.6	A140 L141 S147 I150 Q154 W158 H220 Y222 I223	A140-M144 WeakPolarHBondContact O-CG 3.49Å; A140-M144 PolarHBondContact O-N 3.21Å; L141-M144 PolarHBondContact O-N 2.94Å; M144-S147 PolarHBondContact O-N 3.48Å; M144-I150 HydrophobicContact CE-CD1 4.34Å; M144-I150 HydrophobicContact CE-CG2 3.66Å; M144-Q154 HydrophobicContact CE-CB 4.37Å; M144-Q154 HydrophobicContact SD-CB 4.22Å; M144-W158 HydrophobicContact CE-CB 3.68Å; M144-W158 HydrophobicContact CE-CG 4.21Å; M144-W158 HydrophobicContact CG-CB 4.18Å; M144-W158 HydrophobicContact CG-CD2 4.01Å; M144-W158 HydrophobicContact CG-CE3 3.65Å; M144-W158 HydrophobicContact CG-CG 4.25Å; M144-W158 HydrophobicContact CG-CZ3 4.47Å; M144-W158 HydrophobicContact SD-CB 4.07Å; M144-H220 PolarHBondContact O-NE2 3.2Å; M144-Y222 HydrophobicContact CE-CD1 4.26Å; M144-I223 HydrophobicContact CB-CD1 4.15Å; M144-I223 HydrophobicContact CB-CG1 4.02Å
145	V	95.3	Very high	94.1	Very high	22 Å²	22	59.5 Å²	59.5	13%	0.133	29%	0.289	C	S	.	.	H	α-helix	trans	-71.6	-30.2	-178.3	174.1	0	0	0	0	113	L141 W143 I211 I216	L141-V145 HydrophobicContact CD1-CG2 4.08Å; L141-V145 VanDerWaalsContact O-CG2 3.29Å; L141-V145 WeakPolarHBondContact O-CG2 3.48Å; L141-V145 PolarHBondContact O-N 3.26Å; W143-V145 VanDerWaalsContact C-N 3.31Å; W143-V145 PolarHBondContact O-N 3.27Å; V145-I211 HydrophobicContact CB-CD1 3.85Å; V145-I211 HydrophobicContact CG1-CD1 4.08Å; V145-I211 HydrophobicContact CG2-CD1 3.88Å; V145-I216 HydrophobicContact CG2-CD1 4.36Å; V145-I216 HydrophobicContact CG2-CG1 4.14Å; V145-I216 HydrophobicContact CG2-CG2 4.16Å
146	K	93.8	Very high	94.1	Very high	148 Å²	148	58.9 Å²	58.9	64%	0.643	30%	0.296	S	S	*	.	H	α-helix	trans	-80.9	-21.1	177.3	-76.8	179.3	174	177.9	0	113	Q142 W143 R148	Q142-K146 HydrophobicContact CG-CD 4.04Å; Q142-K146 WeakPolarHBondContact O-CB 3.46Å; Q142-K146 VanDerWaalsContact O-CG 3.3Å; Q142-K146 WeakPolarHBondContact O-CG 3.39Å; Q142-K146 PolarHBondContact O-N 2.83Å; W143-K146 PolarHBondContact O-N 3.25Å; K146-R148 PolarHBondContact O-N 3.28Å
147	S	91.9	Very high	94.1	Very high	24 Å²	24	59 Å²	59	17%	0.168	30%	0.297	C	S	.	.			trans	-71.2	118.4	179.4	-70.5	0	0	0	0	110.9	W143 M144	W143-S147 PolarHBondContact O-N 3.09Å; W143-S147 PolarHBondContact O-OG 2.91Å; M144-S147 PolarHBondContact O-N 3.48Å
148	R	83.1	Confident	94	Very high	241 Å²	241	59.6 Å²	59.6	91%	0.909	30%	0.299	S	S	*	.	S	Bend	trans	-72.1	-33	-179.6	-66.6	-176.5	-179.1	-179	0.3	113.1	K146	K146-R148 PolarHBondContact O-N 3.28Å
149	V	89.1	Confident	94.1	Very high	125 Å²	125	62.1 Å²	62.1	76%	0.758	31%	0.314	S	S	*	.	S	Bend	trans	-128.9	128.6	177.1	-178.8	0	0	0	0	105.9
150	I	92.4	Very high	94.1	Very high	26 Å²	26	63.2 Å²	63.2	13%	0.133	32%	0.317	C	S	.	.			trans	-105.7	125.2	-177.6	-54.3	173	0	0	0	106.7	M144 Q154 E155 H220	M144-I150 HydrophobicContact CE-CD1 4.34Å; M144-I150 HydrophobicContact CE-CG2 3.66Å; I150-Q154 HydrophobicContact CG2-CB 3.77Å; I150-E155 HydrophobicContact CG2-CG 3.62Å; I150-H220 WeakPolarHBondContact CD1-CE1 3.5Å
151	S	92.8	Very high	94.2	Very high	50 Å²	50	63.3 Å²	63.3	35%	0.35	32%	0.317	S	S	.	.			trans	-82.4	155.9	174.6	62.8	0	0	0	0	111.2	L153 Q154 E155	S151-L153 PolarHBondContact O-N 3.04Å; S151-L153 VanDerWaalsContact O-N 3.15Å; S151-Q154 WeakPolarHBondContact O-CA 3.29Å; S151-Q154 WeakPolarHBondContact O-CB 3.39Å; S151-Q154 PolarHBondContact O-N 3.02Å; S151-Q154 VanDerWaalsContact OG-CG 3.26Å; S151-Q154 WeakPolarHBondContact OG-CG 3.28Å; S151-Q154 PolarHBondContact OG-N 3.47Å; S151-Q154 PolarHBondContact OG-OE1 3.49Å; S151-Q154 VanDerWaalsContact OG-OE1 3.12Å; S151-E155 PolarHBondContact O-N 3.39Å
152	E	92.8	Very high	94.2	Very high	167 Å²	167	64.8 Å²	64.8	78%	0.78	33%	0.328	S	S	*	.	H	α-helix	trans	-55.2	-33.6	175.9	-62.2	177.6	-177.2	0	0	112.5	E155 A156	E152-E155 PolarHBondContact O-N 3.4Å; E152-A156 WeakPolarHBondContact O-CB 3.38Å; E152-A156 PolarHBondContact O-N 2.91Å
153	L	92.1	Very high	94.2	Very high	130 Å²	130	65 Å²	65	68%	0.681	34%	0.338	S	S	*	.	H	α-helix	trans	-66.9	-38	175	-74.4	162	0	0	0	112.3	L108 S151 C157	L108-L153 HydrophobicContact CD2-CB 4.41Å; L108-L153 WeakPolarHBondContact CD2-O 3.39Å; S151-L153 PolarHBondContact O-N 3.04Å; S151-L153 VanDerWaalsContact O-N 3.15Å; L153-C157 VanDerWaalsContact O-CB 3.31Å; L153-C157 WeakPolarHBondContact O-CB 3.35Å; L153-C157 PolarHBondContact O-N 3.27Å
154	Q	92.8	Very high	94.3	Very high	21 Å²	21	63.8 Å²	63.8	10%	0.098	33%	0.334	C	S	.	.	H	α-helix	trans	-70.1	-38.7	175.4	-73.1	171.3	-44	0	0	111.8	L108 W143 M144 I150 S151 C157 W158	L108-Q154 HydrophobicContact CD1-CG 4.47Å; L108-Q154 HydrophobicContact CD2-CG 4.03Å; W143-Q154 HydrophobicContact CH2-CB 4.39Å; W143-Q154 HydrophobicContact CH2-CG 3.55Å; W143-Q154 HydrophobicContact CZ2-CG 3.79Å; W143-Q154 HydrophobicContact CZ3-CG 4.29Å; M144-Q154 HydrophobicContact CE-CB 4.37Å; M144-Q154 HydrophobicContact SD-CB 4.22Å; I150-Q154 HydrophobicContact CG2-CB 3.77Å; S151-Q154 WeakPolarHBondContact O-CA 3.29Å; S151-Q154 WeakPolarHBondContact O-CB 3.39Å; S151-Q154 PolarHBondContact O-N 3.02Å; S151-Q154 VanDerWaalsContact OG-CG 3.26Å; S151-Q154 WeakPolarHBondContact OG-CG 3.28Å; S151-Q154 PolarHBondContact OG-N 3.47Å; S151-Q154 PolarHBondContact OG-OE1 3.49Å; S151-Q154 VanDerWaalsContact OG-OE1 3.12Å; Q154-C157 WeakPolarHBondContact O-CB 3.46Å; Q154-C157 PolarHBondContact O-N 2.96Å; Q154-W158 PolarHBondContact O-N 3.26Å
155	E	94.6	Very high	94.4	Very high	65 Å²	65	63.7 Å²	63.7	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-52.7	173.2	-64.9	-176	171.8	0	0	110.7	I150 S151 E152 C157 W158 D159 Y222	I150-E155 HydrophobicContact CG2-CG 3.62Å; S151-E155 PolarHBondContact O-N 3.39Å; E152-E155 PolarHBondContact O-N 3.4Å; E155-C157 VanDerWaalsContact C-N 3.28Å; E155-C157 PolarHBondContact O-N 3.07Å; E155-W158 PolarHBondContact O-N 2.94Å; E155-W158 VanDerWaalsContact O-N 3.09Å; E155-D159 PolarHBondContact O-N 3.35Å; E155-Y222 HydrophobicContact CB-CD2 4.24Å; E155-Y222 HydrophobicContact CB-CE1 4.15Å; E155-Y222 HydrophobicContact CB-CE2 3.64Å; E155-Y222 VanDerWaalsContact CD-CD2 3.41Å; E155-Y222 HydrophobicContact CG-CD1 4.35Å; E155-Y222 HydrophobicContact CG-CD2 3.54Å; E155-Y222 HydrophobicContact CG-CE1 4.27Å; E155-Y222 HydrophobicContact CG-CE2 3.45Å; E155-Y222 VanDerWaalsContact CG-CE2 3.45Å; E155-Y222 HydrophobicContact CG-CG 4.02Å; E155-Y222 WeakPolarHBondContact OE1-CD2 3.41Å
156	A	95.3	Very high	94.5	Very high	56 Å²	56	63.9 Å²	63.9	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-36.4	177.3	0	0	0	0	0	112.9	E152 M160	E152-A156 WeakPolarHBondContact O-CB 3.38Å; E152-A156 PolarHBondContact O-N 2.91Å; A156-M160 PolarHBondContact O-N 3.19Å; A156-M160 VanDerWaalsContact O-N 3.09Å
157	C	96.8	Very high	94.7	Very high	6 Å²	6	59.2 Å²	59.2	4%	0.041	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-43.4	174.5	-176.8	0	0	0	0	111.7	L108 L153 Q154 E155 M160 V161	L108-C157 HydrophobicContact CD2-CB 3.55Å; L153-C157 VanDerWaalsContact O-CB 3.31Å; L153-C157 WeakPolarHBondContact O-CB 3.35Å; L153-C157 PolarHBondContact O-N 3.27Å; Q154-C157 WeakPolarHBondContact O-CB 3.46Å; Q154-C157 PolarHBondContact O-N 2.96Å; E155-C157 VanDerWaalsContact C-N 3.28Å; E155-C157 PolarHBondContact O-N 3.07Å; C157-M160 PolarHBondContact O-N 2.71Å; C157-V161 WeakPolarHBondContact O-CG2 3.2Å; C157-V161 PolarHBondContact O-N 2.78Å
158	W	97.6	Very high	95	Very high	16 Å²	16	58 Å²	58	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-42.3	177.4	177.8	-98.7	0	0	0	112	Y137 A140 L141 M144 Q154 E155 M160 V161 S162 Y222 I223 L228	Y137-W158 HydrophobicContact CE2-CH2 4.17Å; Y137-W158 AromaticContact CZ-CH2 3.98Å; A140-W158 HydrophobicContact CB-CZ3 4.33Å; L141-W158 VanDerWaalsContact CA-CZ3 3.5Å; L141-W158 HydrophobicContact CB-CH2 3.64Å; L141-W158 HydrophobicContact CB-CZ3 3.71Å; L141-W158 HydrophobicContact CD1-CH2 3.49Å; L141-W158 VanDerWaalsContact CD1-CH2 3.49Å; L141-W158 HydrophobicContact CD1-CZ2 3.82Å; L141-W158 HydrophobicContact CD1-CZ3 4.07Å; L141-W158 HydrophobicContact CD2-CH2 4.43Å; L141-W158 HydrophobicContact CG-CH2 4.01Å; L141-W158 HydrophobicContact CG-CZ3 4.46Å; M144-W158 HydrophobicContact CE-CB 3.68Å; M144-W158 HydrophobicContact CE-CG 4.21Å; M144-W158 HydrophobicContact CG-CB 4.18Å; M144-W158 HydrophobicContact CG-CD2 4.01Å; M144-W158 HydrophobicContact CG-CE3 3.65Å; M144-W158 HydrophobicContact CG-CG 4.25Å; M144-W158 HydrophobicContact CG-CZ3 4.47Å; M144-W158 HydrophobicContact SD-CB 4.07Å; Q154-W158 PolarHBondContact O-N 3.26Å; E155-W158 PolarHBondContact O-N 2.94Å; E155-W158 VanDerWaalsContact O-N 3.09Å; W158-M160 PolarHBondContact O-N 2.69Å; W158-V161 HydrophobicContact CE3-CB 4.44Å; W158-V161 HydrophobicContact CE3-CG1 4.35Å; W158-V161 HydrophobicContact CZ3-CG1 4.09Å; W158-V161 PolarHBondContact O-N 2.88Å; W158-V161 VanDerWaalsContact O-N 3.1Å; W158-S162 WeakPolarHBondContact O-CB 3.22Å; W158-S162 PolarHBondContact O-N 3.22Å; W158-Y222 HydrophobicContact CB-CE1 4.41Å; W158-Y222 AromaticContact CD1-CE1 3.79Å; W158-Y222 HydrophobicContact CG-CE1 4.4Å; W158-I223 HydrophobicContact CD2-CD1 3.71Å; W158-I223 HydrophobicContact CG-CD1 3.83Å; W158-I223 HydrophobicContact CZ2-CD1 4Å; W158-I223 VanDerWaalsContact NE1-CD1 3.27Å; W158-L228 HydrophobicContact CZ2-CD2 4.27Å
159	D	96.8	Very high	95.7	Very high	82 Å²	82	47.8 Å²	47.8	44%	0.439	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-40	176.1	-69.6	-5.8	0	0	0	111.2	E155 S162 A163 Y222	E155-D159 PolarHBondContact O-N 3.35Å; D159-S162 PolarHBondContact O-N 3.1Å; D159-A163 VanDerWaalsContact O-CB 3.26Å; D159-A163 WeakPolarHBondContact O-CB 3.37Å; D159-A163 PolarHBondContact O-N 2.97Å; D159-Y222 PolarHBondContact OD1-OH 3.19Å; D159-Y222 PolarHBondContact OD2-OH 2.92Å
160	M	97.4	Very high	96	Very high	65 Å²	65	47.5 Å²	47.5	32%	0.32	27%	0.27	S	S	.	.	H	α-helix	trans	-66.6	-41.8	174.4	-168.4	171	-63.3	0	0	112.2	I111 A112 A156 C157 W158 A163 M164	I111-M160 HydrophobicContact CB-SD 4.43Å; I111-M160 HydrophobicContact CG1-CB 4.19Å; I111-M160 HydrophobicContact CG1-CG 3.94Å; I111-M160 HydrophobicContact CG1-SD 4Å; I111-M160 HydrophobicContact CG2-SD 3.87Å; A112-M160 HydrophobicContact CB-SD 4.32Å; A156-M160 PolarHBondContact O-N 3.19Å; A156-M160 VanDerWaalsContact O-N 3.09Å; C157-M160 PolarHBondContact O-N 2.71Å; W158-M160 PolarHBondContact O-N 2.69Å; M160-A163 PolarHBondContact O-N 3Å; M160-M164 HydrophobicContact CG-CG 4.47Å; M160-M164 HydrophobicContact CG-SD 4.13Å; M160-M164 WeakPolarHBondContact O-CB 3.47Å; M160-M164 WeakPolarHBondContact O-CG 3.4Å; M160-M164 PolarHBondContact O-N 3.06Å
161	V	97.9	Very high	96.3	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-44	175.5	170	0	0	0	0	111.4	L107 I111 M133 Y137 A140 C157 W158 M164 A165	L107-V161 HydrophobicContact CD2-CG2 4.22Å; I111-V161 HydrophobicContact CD1-CG2 3.59Å; I111-V161 HydrophobicContact CG1-CG2 3.96Å; M133-V161 HydrophobicContact CE-CG1 4.37Å; Y137-V161 HydrophobicContact CD2-CG1 3.73Å; Y137-V161 HydrophobicContact CE2-CG1 4.17Å; A140-V161 HydrophobicContact CB-CG1 4.32Å; A140-V161 HydrophobicContact CB-CG2 4.41Å; C157-V161 WeakPolarHBondContact O-CG2 3.2Å; C157-V161 PolarHBondContact O-N 2.78Å; W158-V161 HydrophobicContact CE3-CB 4.44Å; W158-V161 HydrophobicContact CE3-CG1 4.35Å; W158-V161 HydrophobicContact CZ3-CG1 4.09Å; W158-V161 PolarHBondContact O-N 2.88Å; W158-V161 VanDerWaalsContact O-N 3.1Å; V161-M164 PolarHBondContact O-N 3.21Å; V161-A165 PolarHBondContact O-N 3.39Å
162	S	96.9	Very high	96.4	Very high	32 Å²	32	46.1 Å²	46.1	22%	0.224	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-45	177.7	175.4	0	0	0	0	111.4	W158 D159 M164 A165 G166	W158-S162 WeakPolarHBondContact O-CB 3.22Å; W158-S162 PolarHBondContact O-N 3.22Å; D159-S162 PolarHBondContact O-N 3.1Å; S162-M164 VanDerWaalsContact C-N 3.34Å; S162-M164 PolarHBondContact O-N 3.45Å; S162-A165 WeakPolarHBondContact O-CB 3.32Å; S162-A165 PolarHBondContact O-N 3.01Å; S162-A165 VanDerWaalsContact O-N 3.13Å; S162-G166 PolarHBondContact O-N 2.62Å
163	A	97.4	Very high	96.5	Very high	57 Å²	57	44.3 Å²	44.3	47%	0.471	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-43.4	174.1	0	0	0	0	0	112.2	D159 M160 A165 G166 D167	D159-A163 VanDerWaalsContact O-CB 3.26Å; D159-A163 WeakPolarHBondContact O-CB 3.37Å; D159-A163 PolarHBondContact O-N 2.97Å; M160-A163 PolarHBondContact O-N 3Å; A163-A165 VanDerWaalsContact C-N 3.32Å; A163-A165 PolarHBondContact O-N 3.32Å; A163-G166 WeakPolarHBondContact O-CA 3.49Å; A163-G166 PolarHBondContact O-N 3.25Å; A163-D167 PolarHBondContact O-N 3.3Å
164	M	98.1	Very high	96.7	Very high	1 Å²	1	39 Å²	39	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-34.6	175.6	-72.8	173.6	66.9	0	0	112.6	I111 L114 N115 L118 M133 M160 V161 S162 G166 D167 I168	I111-M164 HydrophobicContact CD1-CE 4.22Å; I111-M164 HydrophobicContact CD1-SD 3.54Å; I111-M164 VanDerWaalsContact CD1-SD 3.54Å; I111-M164 HydrophobicContact CG1-SD 3.98Å; L114-M164 HydrophobicContact CB-CE 4.34Å; L114-M164 HydrophobicContact CD2-CE 4.4Å; L114-M164 HydrophobicContact CG-CE 4.04Å; N115-M164 HydrophobicContact CB-CE 3.93Å; N115-M164 HydrophobicContact CB-CG 4.18Å; N115-M164 HydrophobicContact CB-SD 3.55Å; N115-M164 VanDerWaalsContact CB-SD 3.55Å; L118-M164 HydrophobicContact CD2-CB 4.43Å; L118-M164 HydrophobicContact CD2-CE 4.07Å; M133-M164 HydrophobicContact CE-CB 3.82Å; M133-M164 HydrophobicContact CE-CE 4.18Å; M133-M164 HydrophobicContact CG-CE 4.08Å; M133-M164 HydrophobicContact SD-CE 3.68Å; M160-M164 HydrophobicContact CG-CG 4.47Å; M160-M164 HydrophobicContact CG-SD 4.13Å; M160-M164 WeakPolarHBondContact O-CB 3.47Å; M160-M164 WeakPolarHBondContact O-CG 3.4Å; M160-M164 PolarHBondContact O-N 3.06Å; V161-M164 PolarHBondContact O-N 3.21Å; S162-M164 VanDerWaalsContact C-N 3.34Å; S162-M164 PolarHBondContact O-N 3.45Å; M164-G166 VanDerWaalsContact C-N 3.34Å; M164-D167 PolarHBondContact O-N 3.42Å; M164-I168 WeakPolarHBondContact O-CG1 3.38Å; M164-I168 PolarHBondContact O-N 3.02Å
165	A	97.9	Very high	96.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-42.8	172.5	0	0	0	0	0	111.2	Y137 V161 S162 A163 I168 I169 F186	Y137-A165 HydrophobicContact CD2-CB 3.94Å; Y137-A165 HydrophobicContact CE2-CB 3.7Å; V161-A165 PolarHBondContact O-N 3.39Å; S162-A165 WeakPolarHBondContact O-CB 3.32Å; S162-A165 PolarHBondContact O-N 3.01Å; S162-A165 VanDerWaalsContact O-N 3.13Å; A163-A165 VanDerWaalsContact C-N 3.32Å; A163-A165 PolarHBondContact O-N 3.32Å; A165-I168 PolarHBondContact O-N 2.98Å; A165-I169 WeakPolarHBondContact O-CG1 3.46Å; A165-I169 PolarHBondContact O-N 3.45Å; A165-I169 VanDerWaalsContact O-N 3.09Å; A165-F186 HydrophobicContact CB-CE1 3.94Å; A165-F186 HydrophobicContact CB-CZ 3.61Å
166	G	96.9	Very high	96.9	Very high	26 Å²	26	44.3 Å²	44.3	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-57.7	-46.9	170.8	0	0	0	0	0	112.9	S162 A163 M164 I168 I169 L170	S162-G166 PolarHBondContact O-N 2.62Å; A163-G166 WeakPolarHBondContact O-CA 3.49Å; A163-G166 PolarHBondContact O-N 3.25Å; M164-G166 VanDerWaalsContact C-N 3.34Å; G166-I168 VanDerWaalsContact C-N 3.29Å; G166-I168 PolarHBondContact O-N 3.09Å; G166-I169 WeakPolarHBondContact O-CB 3.31Å; G166-I169 PolarHBondContact O-N 2.93Å; G166-I169 VanDerWaalsContact O-N 3.11Å; G166-L170 PolarHBondContact O-N 2.91Å; G166-L170 VanDerWaalsContact O-N 3.13Å
167	D	97.6	Very high	96.8	Very high	50 Å²	50	44.2 Å²	44.2	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-58	-40.4	176.2	-76.8	-7.8	0	0	0	111.4	R119 A163 M164 L170 L171	R119-D167 IonicContact CZ-OD2 2.77Å; R119-D167 IonicContact NE-OD2 2.78Å; R119-D167 IonicContact NH2-OD2 3.73Å; R119-D167 PolarHBondContact NH2-OD2 3.36Å; A163-D167 PolarHBondContact O-N 3.3Å; M164-D167 PolarHBondContact O-N 3.42Å; D167-L170 WeakPolarHBondContact O-CB 3.26Å; D167-L170 PolarHBondContact O-N 3.35Å; D167-L171 WeakPolarHBondContact O-CG 3.42Å; D167-L171 PolarHBondContact O-N 3.12Å
168	I	98.1	Very high	96.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-33.5	177.4	-62.6	166.7	0	0	0	112.1	L118 I130 M133 M164 A165 G166 L170 L171 A183 F186	L118-I168 HydrophobicContact CD1-CD1 4.4Å; L118-I168 HydrophobicContact CD1-CG1 4.1Å; L118-I168 HydrophobicContact CD2-CD1 4.27Å; L118-I168 HydrophobicContact CD2-CG1 3.92Å; I130-I168 HydrophobicContact CG1-CD1 4.47Å; I130-I168 HydrophobicContact CG1-CG1 4.3Å; I130-I168 HydrophobicContact CG1-CG2 4.3Å; I130-I168 HydrophobicContact CG2-CG2 3.94Å; M133-I168 HydrophobicContact CB-CD1 3.63Å; M133-I168 HydrophobicContact CG-CD1 3.92Å; M164-I168 WeakPolarHBondContact O-CG1 3.38Å; M164-I168 PolarHBondContact O-N 3.02Å; A165-I168 PolarHBondContact O-N 2.98Å; G166-I168 VanDerWaalsContact C-N 3.29Å; G166-I168 PolarHBondContact O-N 3.09Å; I168-L170 VanDerWaalsContact C-N 3.3Å; I168-L170 PolarHBondContact O-N 3.15Å; I168-L171 WeakPolarHBondContact O-CB 3.48Å; I168-L171 PolarHBondContact O-N 3.24Å; I168-L171 VanDerWaalsContact O-N 3.13Å; I168-A183 HydrophobicContact CG2-CB 4.2Å; I168-F186 HydrophobicContact CB-CD1 3.75Å; I168-F186 HydrophobicContact CB-CE1 3.89Å; I168-F186 HydrophobicContact CB-CG 4.29Å; I168-F186 HydrophobicContact CD1-CD1 4.28Å; I168-F186 HydrophobicContact CD1-CD2 3.99Å; I168-F186 HydrophobicContact CD1-CE1 4.18Å; I168-F186 HydrophobicContact CD1-CE2 3.91Å; I168-F186 HydrophobicContact CD1-CG 4.19Å; I168-F186 HydrophobicContact CD1-CZ 4.01Å; I168-F186 HydrophobicContact CG2-CB 3.78Å; I168-F186 HydrophobicContact CG2-CD1 3.33Å; I168-F186 HydrophobicContact CG2-CD2 4.43Å; I168-F186 HydrophobicContact CG2-CE1 4.01Å; I168-F186 HydrophobicContact CG2-CG 3.58Å
169	I	97.5	Very high	96.8	Very high	26 Å²	26	44.5 Å²	44.5	13%	0.133	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-42.7	172.6	-66	163.8	0	0	0	109.9	A165 G166 L171 L172 V187 L190 A235 Q238	A165-I169 WeakPolarHBondContact O-CG1 3.46Å; A165-I169 PolarHBondContact O-N 3.45Å; A165-I169 VanDerWaalsContact O-N 3.09Å; G166-I169 WeakPolarHBondContact O-CB 3.31Å; G166-I169 PolarHBondContact O-N 2.93Å; G166-I169 VanDerWaalsContact O-N 3.11Å; I169-L171 PolarHBondContact O-N 3.29Å; I169-L172 HydrophobicContact CG2-CD1 4.5Å; I169-L172 VanDerWaalsContact O-CB 3.29Å; I169-L172 WeakPolarHBondContact O-CB 3.29Å; I169-L172 VanDerWaalsContact O-CG 3.27Å; I169-L172 WeakPolarHBondContact O-CG 3.48Å; I169-L172 PolarHBondContact O-N 2.99Å; I169-L172 VanDerWaalsContact O-N 3.07Å; I169-V187 HydrophobicContact CG1-CG2 4Å; I169-L190 HydrophobicContact CD1-CD2 3.76Å; I169-L190 HydrophobicContact CG1-CD2 4.27Å; I169-A235 HydrophobicContact CD1-CB 4.34Å; I169-Q238 HydrophobicContact CG2-CB 4.23Å; I169-Q238 HydrophobicContact CG2-CG 4.04Å
170	L	97.1	Very high	96.8	Very high	118 Å²	118	42.5 Å²	42.5	62%	0.618	24%	0.244	S	C	*	.	H	α-helix	trans	-63.8	-24.9	176.2	-61.5	174.7	0	0	0	112.7	G166 D167 I168 L172 D173	G166-L170 PolarHBondContact O-N 2.91Å; G166-L170 VanDerWaalsContact O-N 3.13Å; D167-L170 WeakPolarHBondContact O-CB 3.26Å; D167-L170 PolarHBondContact O-N 3.35Å; I168-L170 VanDerWaalsContact C-N 3.3Å; I168-L170 PolarHBondContact O-N 3.15Å; L170-L172 PolarHBondContact O-N 3.38Å; L170-D173 PolarHBondContact O-N 3.37Å; L170-D173 VanDerWaalsContact O-N 3.13Å
171	L	97.6	Very high	96.9	Very high	43 Å²	43	40.6 Å²	40.6	23%	0.225	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-71	-4.8	174.5	-66	178.1	0	0	0	114	L118 V126 I130 D167 I168 I169 D173 S174 I179 A183	L118-L171 HydrophobicContact CD1-CD1 4.43Å; V126-L171 HydrophobicContact CG1-CD1 4.22Å; I130-L171 HydrophobicContact CD1-CD1 3.91Å; I130-L171 HydrophobicContact CG1-CD1 4.4Å; D167-L171 WeakPolarHBondContact O-CG 3.42Å; D167-L171 PolarHBondContact O-N 3.12Å; I168-L171 WeakPolarHBondContact O-CB 3.48Å; I168-L171 PolarHBondContact O-N 3.24Å; I168-L171 VanDerWaalsContact O-N 3.13Å; I169-L171 PolarHBondContact O-N 3.29Å; L171-D173 PolarHBondContact O-N 3.13Å; L171-S174 WeakPolarHBondContact O-CB 3.46Å; L171-S174 PolarHBondContact O-N 2.7Å; L171-S174 VanDerWaalsContact O-N 3.14Å; L171-I179 HydrophobicContact CB-CG2 3.84Å; L171-I179 HydrophobicContact CD1-CG2 4.11Å; L171-I179 HydrophobicContact CD2-CG2 4.28Å; L171-I179 HydrophobicContact CG-CG2 4.3Å; L171-A183 HydrophobicContact CB-CB 4.28Å
172	L	96.3	Very high	96.9	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-59.5	-29.7	164.4	-69.3	175.2	0	0	0	111.7	I169 L170 R180 A183 I184 V187 Q238 F242	I169-L172 HydrophobicContact CG2-CD1 4.5Å; I169-L172 VanDerWaalsContact O-CB 3.29Å; I169-L172 WeakPolarHBondContact O-CB 3.29Å; I169-L172 VanDerWaalsContact O-CG 3.27Å; I169-L172 WeakPolarHBondContact O-CG 3.48Å; I169-L172 PolarHBondContact O-N 2.99Å; I169-L172 VanDerWaalsContact O-N 3.07Å; L170-L172 PolarHBondContact O-N 3.38Å; L172-R180 WeakPolarHBondContact O-CD 3.48Å; L172-R180 VanDerWaalsContact O-CG 3.28Å; L172-R180 WeakPolarHBondContact O-CG 3.48Å; L172-A183 HydrophobicContact CD2-CB 3.89Å; L172-A183 HydrophobicContact CG-CB 4.32Å; L172-I184 HydrophobicContact CD2-CG1 3.69Å; L172-V187 HydrophobicContact CD1-CG2 4.27Å; L172-Q238 HydrophobicContact CD1-CB 4.3Å; L172-F242 HydrophobicContact CB-CD2 4.2Å; L172-F242 WeakPolarHBondContact O-CE2 3.32Å
173	D	94.8	Very high	97	Very high	129 Å²	129	41.2 Å²	41.2	69%	0.69	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-93.1	10.6	176.9	-64.4	-36	0	0	0	113.2	L170 L171	L170-D173 PolarHBondContact O-N 3.37Å; L170-D173 VanDerWaalsContact O-N 3.13Å; L171-D173 PolarHBondContact O-N 3.13Å
174	S	96.1	Very high	97	Very high	17 Å²	17	38.5 Å²	38.5	12%	0.119	21%	0.212	C	C	.	.			trans	-59.9	145.6	175.1	176.9	0	0	0	0	111	L171 N176 R180	L171-S174 WeakPolarHBondContact O-CB 3.46Å; L171-S174 PolarHBondContact O-N 2.7Å; L171-S174 VanDerWaalsContact O-N 3.14Å; S174-N176 VanDerWaalsContact C-N 3.26Å; S174-N176 PolarHBondContact O-N 3.35Å; S174-N176 PolarHBondContact OG-N 2.86Å; S174-R180 VanDerWaalsContact O-CD 3.24Å; S174-R180 WeakPolarHBondContact O-CD 3.31Å; S174-R180 WeakPolarHBondContact O-CG 3.4Å; S174-R180 PolarHBondContact O-NH1 3.43Å
175	D	93.6	Very high	97	Very high	153 Å²	153	42.1 Å²	42.1	82%	0.818	23%	0.228	S	C	*	.	S	Bend	trans	-66.1	-26.8	171.8	59.9	-18.4	0	0	0	112.8	R180	D175-R180 VanDerWaalsContact C-NH1 3.3Å; D175-R180 PolarHBondContact O-NH1 3.09Å
176	N	96.3	Very high	97	Very high	46 Å²	46	42.3 Å²	42.3	25%	0.246	23%	0.229	C	C	.	.			trans	-82.8	119.5	179.7	-168	-84.3	0	0	0	113.1	V123 S174 G178 I179 R180	V123-N176 HydrophobicContact CG1-CB 4.28Å; S174-N176 VanDerWaalsContact C-N 3.26Å; S174-N176 PolarHBondContact O-N 3.35Å; S174-N176 PolarHBondContact OG-N 2.86Å; N176-G178 VanDerWaalsContact C-N 3.29Å; N176-G178 PolarHBondContact O-N 2.85Å; N176-G178 WeakPolarHBondContact OD1-CA 3.47Å; N176-G178 PolarHBondContact OD1-N 3.12Å; N176-I179 HydrophobicContact CB-CB 4.07Å; N176-I179 HydrophobicContact CB-CD1 3.87Å; N176-I179 HydrophobicContact CB-CG1 3.9Å; N176-I179 PolarHBondContact O-N 2.73Å; N176-I179 VanDerWaalsContact O-N 3.1Å; N176-I179 PolarHBondContact OD1-N 3.28Å; N176-I179 VanDerWaalsContact OD1-N 3.11Å; N176-R180 PolarHBondContact O-N 2.82Å; N176-R180 VanDerWaalsContact O-N 3.1Å
177	D	93.8	Very high	97.1	Very high	53 Å²	53	41 Å²	41	28%	0.283	22%	0.216	S	C	.	.	H	α-helix	trans	-60.3	-34.7	-179.5	-166.7	69.4	0	0	0	114.7	R180 T181 S249 I251 N252	D177-R180 VanDerWaalsContact CA-NH2 3.34Å; D177-R180 IonicContact OD1-CZ 3.56Å; D177-R180 IonicContact OD1-NH2 2.66Å; D177-R180 PolarHBondContact OD1-NH2 3.31Å; D177-T181 PolarHBondContact O-N 2.97Å; D177-T181 VanDerWaalsContact O-N 3.11Å; D177-T181 PolarHBondContact O-OG1 3.05Å; D177-S249 WeakPolarHBondContact OD1-CB 3.23Å; D177-S249 PolarHBondContact OD1-OG 2.84Å; D177-I251 WeakPolarHBondContact OD2-CG2 3.48Å; D177-N252 PolarHBondContact O-ND2 2.93Å; D177-N252 PolarHBondContact OD1-ND2 2.78Å; D177-N252 PolarHBondContact OD1-OD1 2.88Å
178	G	95.8	Very high	97.2	Very high	18 Å²	18	39.4 Å²	39.4	19%	0.186	21%	0.207	C	C	.	.	H	α-helix	trans	-70.2	-38.9	176.1	0	0	0	0	0	112.3	N176 T181 H182	N176-G178 VanDerWaalsContact C-N 3.29Å; N176-G178 PolarHBondContact O-N 2.85Å; N176-G178 WeakPolarHBondContact OD1-CA 3.47Å; N176-G178 PolarHBondContact OD1-N 3.12Å; G178-T181 PolarHBondContact O-N 3.4Å; G178-H182 PolarHBondContact O-N 3.4Å; G178-H182 PolarHBondContact O-ND1 3.29Å
179	I	98	Very high	97.1	Very high	11 Å²	11	40.6 Å²	40.6	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-48.9	175.9	-68.4	-179.9	0	0	0	109.8	V123 V126 K127 I130 L171 N176 T181 H182 A183	V123-I179 HydrophobicContact CB-CD1 4.05Å; V123-I179 HydrophobicContact CB-CG1 4.38Å; V123-I179 HydrophobicContact CG1-CD1 3.97Å; V126-I179 HydrophobicContact CB-CD1 4.27Å; V126-I179 HydrophobicContact CG1-CD1 4.04Å; V126-I179 HydrophobicContact CG1-CG1 4.4Å; K127-I179 HydrophobicContact CG-CG1 4.1Å; I130-I179 HydrophobicContact CD1-CG2 4.04Å; L171-I179 HydrophobicContact CB-CG2 3.84Å; L171-I179 HydrophobicContact CD1-CG2 4.11Å; L171-I179 HydrophobicContact CD2-CG2 4.28Å; L171-I179 HydrophobicContact CG-CG2 4.3Å; N176-I179 HydrophobicContact CB-CB 4.07Å; N176-I179 HydrophobicContact CB-CD1 3.87Å; N176-I179 HydrophobicContact CB-CG1 3.9Å; N176-I179 PolarHBondContact O-N 2.73Å; N176-I179 VanDerWaalsContact O-N 3.1Å; N176-I179 PolarHBondContact OD1-N 3.28Å; N176-I179 VanDerWaalsContact OD1-N 3.11Å; I179-T181 VanDerWaalsContact C-N 3.28Å; I179-T181 PolarHBondContact O-N 3.46Å; I179-H182 PolarHBondContact O-N 2.92Å; I179-A183 PolarHBondContact O-N 3.42Å
180	R	98	Very high	97.2	Very high	40 Å²	40	39.4 Å²	39.4	15%	0.151	21%	0.213	C	C	.	.	H	α-helix	trans	-54.2	-44.4	176.1	-64.4	-167.1	-62.9	-94.7	1.2	112.2	L172 S174 D175 N176 D177 H182 A183 I184 F242 N252	L172-R180 WeakPolarHBondContact O-CD 3.48Å; L172-R180 VanDerWaalsContact O-CG 3.28Å; L172-R180 WeakPolarHBondContact O-CG 3.48Å; S174-R180 VanDerWaalsContact O-CD 3.24Å; S174-R180 WeakPolarHBondContact O-CD 3.31Å; S174-R180 WeakPolarHBondContact O-CG 3.4Å; S174-R180 PolarHBondContact O-NH1 3.43Å; D175-R180 VanDerWaalsContact C-NH1 3.3Å; D175-R180 PolarHBondContact O-NH1 3.09Å; N176-R180 PolarHBondContact O-N 2.82Å; N176-R180 VanDerWaalsContact O-N 3.1Å; D177-R180 VanDerWaalsContact CA-NH2 3.34Å; D177-R180 IonicContact OD1-CZ 3.56Å; D177-R180 IonicContact OD1-NH2 2.66Å; D177-R180 PolarHBondContact OD1-NH2 3.31Å; R180-H182 VanDerWaalsContact C-N 3.32Å; R180-H182 PolarHBondContact O-N 2.64Å; R180-A183 PolarHBondContact O-N 2.71Å; R180-I184 VanDerWaalsContact O-CG1 3.26Å; R180-I184 WeakPolarHBondContact O-CG1 3.21Å; R180-I184 PolarHBondContact O-N 3.05Å; R180-F242 HydrophobicContact CB-CZ 4.38Å; R180-N252 WeakPolarHBondContact CB-OD1 3.47Å; R180-N252 PolarHBondContact NE-OD1 2.97Å; R180-N252 PolarHBondContact NH2-OD1 3.43Å
181	T	98.1	Very high	97.2	Very high	24 Å²	24	33.9 Å²	33.9	15%	0.147	18%	0.184	C	C	.	.	H	α-helix	trans	-56.8	-43.9	176.5	-55.8	0	0	0	0	112.3	D177 G178 I179 K185 N252 T255	D177-T181 PolarHBondContact O-N 2.97Å; D177-T181 VanDerWaalsContact O-N 3.11Å; D177-T181 PolarHBondContact O-OG1 3.05Å; G178-T181 PolarHBondContact O-N 3.4Å; I179-T181 VanDerWaalsContact C-N 3.28Å; I179-T181 PolarHBondContact O-N 3.46Å; T181-K185 PolarHBondContact O-N 3.1Å; T181-N252 PolarHBondContact OG1-ND2 2.81Å; T181-T255 HydrophobicContact CG2-CG2 4.09Å
182	H	98.4	Very high	97.2	Very high	48 Å²	48	32.6 Å²	32.6	22%	0.222	18%	0.178	C	C	.	.	H	α-helix	trans	-73.7	-37	-179.6	-71.6	78.4	0	0	0	111.8	I130 G178 I179 R180 I184 K185 F186	I130-H182 HydrophobicContact CB-CB 4.19Å; I130-H182 HydrophobicContact CD1-CB 4.17Å; I130-H182 HydrophobicContact CG2-CB 3.88Å; I130-H182 WeakPolarHBondContact CG2-O 3.3Å; G178-H182 PolarHBondContact O-N 3.4Å; G178-H182 PolarHBondContact O-ND1 3.29Å; I179-H182 PolarHBondContact O-N 2.92Å; R180-H182 VanDerWaalsContact C-N 3.32Å; R180-H182 PolarHBondContact O-N 2.64Å; H182-I184 PolarHBondContact O-N 3.45Å; H182-K185 PolarHBondContact O-N 2.88Å; H182-F186 PolarHBondContact O-N 3.29Å
183	A	98.5	Very high	97.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-43.2	174.1	0	0	0	0	0	111.5	I168 L171 L172 I179 R180 K185 F186 V187	I168-A183 HydrophobicContact CG2-CB 4.2Å; L171-A183 HydrophobicContact CB-CB 4.28Å; L172-A183 HydrophobicContact CD2-CB 3.89Å; L172-A183 HydrophobicContact CG-CB 4.32Å; I179-A183 PolarHBondContact O-N 3.42Å; R180-A183 PolarHBondContact O-N 2.71Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.08Å; A183-F186 WeakPolarHBondContact O-CB 3.35Å; A183-F186 PolarHBondContact O-N 3.47Å; A183-F186 VanDerWaalsContact O-N 3.12Å; A183-V187 VanDerWaalsContact O-CG2 3.31Å; A183-V187 WeakPolarHBondContact O-CG2 3.41Å; A183-V187 PolarHBondContact O-N 3.19Å
184	I	98.6	Very high	97.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.6	-44.8	174.4	-66	161.3	0	0	0	111.3	L172 R180 H182 V187 E188 L239 F242 N252 T255 A256 S259	L172-I184 HydrophobicContact CD2-CG1 3.69Å; R180-I184 VanDerWaalsContact O-CG1 3.26Å; R180-I184 WeakPolarHBondContact O-CG1 3.21Å; R180-I184 PolarHBondContact O-N 3.05Å; H182-I184 PolarHBondContact O-N 3.45Å; I184-V187 PolarHBondContact O-N 3.4Å; I184-E188 PolarHBondContact O-N 3.46Å; I184-L239 HydrophobicContact CG1-CD1 4.36Å; I184-L239 HydrophobicContact CG2-CD1 4.03Å; I184-F242 HydrophobicContact CD1-CD1 4.29Å; I184-F242 HydrophobicContact CD1-CE1 3.55Å; I184-F242 HydrophobicContact CD1-CZ 4.22Å; I184-F242 HydrophobicContact CG1-CD1 4.4Å; I184-F242 HydrophobicContact CG1-CE1 4.05Å; I184-N252 HydrophobicContact CD1-CB 3.99Å; I184-T255 HydrophobicContact CB-CG2 4.3Å; I184-T255 HydrophobicContact CG2-CG2 3.91Å; I184-A256 HydrophobicContact CD1-CB 4.47Å; I184-A256 HydrophobicContact CG2-CB 4.3Å; I184-S259 WeakPolarHBondContact CG2-OG 3.49Å
185	K	98.3	Very high	97.5	Very high	78 Å²	78	25.9 Å²	25.9	34%	0.339	14%	0.141	S	C	.	.	H	α-helix	trans	-68.5	-33.7	179	-67	-56.4	-54.6	179.7	0	112.9	T181 H182 A183 E188 G189 T255	T181-K185 PolarHBondContact O-N 3.1Å; H182-K185 PolarHBondContact O-N 2.88Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.08Å; K185-E188 VanDerWaalsContact CE-OE2 3.31Å; K185-E188 WeakPolarHBondContact CE-OE2 3.41Å; K185-E188 VanDerWaalsContact NZ-CD 3.26Å; K185-E188 IonicContact NZ-OE1 3.93Å; K185-E188 PolarHBondContact NZ-OE1 2.73Å; K185-E188 VanDerWaalsContact NZ-OE1 3.17Å; K185-E188 IonicContact NZ-OE2 3.64Å; K185-E188 PolarHBondContact NZ-OE2 3.06Å; K185-G189 PolarHBondContact O-N 3.2Å; K185-T255 HydrophobicContact CD-CG2 3.88Å; K185-T255 HydrophobicContact CG-CG2 4.16Å
186	F	98.6	Very high	97.7	Very high	3 Å²	3	19.8 Å²	19.8	1%	0.013	11%	0.11	C	C	.	.	H	α-helix	trans	-65.3	-48.8	171.7	174.8	-95.4	0	0	0	110.9	I130 M133 Y137 A165 I168 H182 A183 E188 G189 L190	I130-F186 HydrophobicContact CG2-CB 3.87Å; M133-F186 HydrophobicContact CB-CD2 4.28Å; M133-F186 HydrophobicContact CB-CE2 3.99Å; Y137-F186 HydrophobicContact CD2-CZ 4.46Å; A165-F186 HydrophobicContact CB-CE1 3.94Å; A165-F186 HydrophobicContact CB-CZ 3.61Å; I168-F186 HydrophobicContact CB-CD1 3.75Å; I168-F186 HydrophobicContact CB-CE1 3.89Å; I168-F186 HydrophobicContact CB-CG 4.29Å; I168-F186 HydrophobicContact CD1-CD1 4.28Å; I168-F186 HydrophobicContact CD1-CD2 3.99Å; I168-F186 HydrophobicContact CD1-CE1 4.18Å; I168-F186 HydrophobicContact CD1-CE2 3.91Å; I168-F186 HydrophobicContact CD1-CG 4.19Å; I168-F186 HydrophobicContact CD1-CZ 4.01Å; I168-F186 HydrophobicContact CG2-CB 3.78Å; I168-F186 HydrophobicContact CG2-CD1 3.33Å; I168-F186 HydrophobicContact CG2-CD2 4.43Å; I168-F186 HydrophobicContact CG2-CE1 4.01Å; I168-F186 HydrophobicContact CG2-CG 3.58Å; H182-F186 PolarHBondContact O-N 3.29Å; A183-F186 WeakPolarHBondContact O-CB 3.35Å; A183-F186 PolarHBondContact O-N 3.47Å; A183-F186 VanDerWaalsContact O-N 3.12Å; F186-E188 VanDerWaalsContact C-N 3.33Å; F186-E188 PolarHBondContact O-N 2.89Å; F186-G189 WeakPolarHBondContact O-CA 3.36Å; F186-G189 PolarHBondContact O-N 3.36Å; F186-L190 HydrophobicContact CE1-CB 4.49Å; F186-L190 HydrophobicContact CE1-CD2 4.14Å; F186-L190 PolarHBondContact O-N 3.42Å
187	V	98.5	Very high	97.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-39.8	179.7	171.6	0	0	0	0	111.6	I169 L172 A183 I184 G189 L190 I191 A235 L239	I169-V187 HydrophobicContact CG1-CG2 4Å; L172-V187 HydrophobicContact CD1-CG2 4.27Å; A183-V187 VanDerWaalsContact O-CG2 3.31Å; A183-V187 WeakPolarHBondContact O-CG2 3.41Å; A183-V187 PolarHBondContact O-N 3.19Å; I184-V187 PolarHBondContact O-N 3.4Å; V187-G189 PolarHBondContact O-N 2.91Å; V187-L190 WeakPolarHBondContact O-CB 3.26Å; V187-L190 PolarHBondContact O-N 3.48Å; V187-I191 HydrophobicContact CG1-CD1 3.7Å; V187-I191 HydrophobicContact CG1-CG1 4.3Å; V187-I191 WeakPolarHBondContact O-CD1 3.49Å; V187-I191 VanDerWaalsContact O-CG1 3.23Å; V187-I191 WeakPolarHBondContact O-CG1 3.48Å; V187-I191 PolarHBondContact O-N 2.93Å; V187-A235 HydrophobicContact CG1-CB 4.31Å; V187-L239 HydrophobicContact CG1-CB 4.18Å; V187-L239 HydrophobicContact CG1-CD2 4.46Å
188	E	98.2	Very high	97.6	Very high	15 Å²	15	21.1 Å²	21.1	7%	0.07	11%	0.112	C	C	.	.	H	α-helix	trans	-55.6	-49.2	170.3	176.8	-171.5	149.9	0	0	112.2	I184 K185 F186 L190 I191 V192 S259 N262 I263	I184-E188 PolarHBondContact O-N 3.46Å; K185-E188 VanDerWaalsContact CE-OE2 3.31Å; K185-E188 WeakPolarHBondContact CE-OE2 3.41Å; K185-E188 VanDerWaalsContact NZ-CD 3.26Å; K185-E188 IonicContact NZ-OE1 3.93Å; K185-E188 PolarHBondContact NZ-OE1 2.73Å; K185-E188 VanDerWaalsContact NZ-OE1 3.17Å; K185-E188 IonicContact NZ-OE2 3.64Å; K185-E188 PolarHBondContact NZ-OE2 3.06Å; F186-E188 VanDerWaalsContact C-N 3.33Å; F186-E188 PolarHBondContact O-N 2.89Å; E188-L190 VanDerWaalsContact C-N 3.32Å; E188-L190 PolarHBondContact O-N 3.47Å; E188-I191 PolarHBondContact O-N 3.35Å; E188-V192 WeakPolarHBondContact O-CG2 3.35Å; E188-V192 PolarHBondContact O-N 3.34Å; E188-V192 VanDerWaalsContact O-N 3.1Å; E188-S259 WeakPolarHBondContact OE2-CA 3.39Å; E188-S259 WeakPolarHBondContact OE2-CB 3.3Å; E188-S259 PolarHBondContact OE2-OG 3Å; E188-N262 HydrophobicContact CG-CB 4.5Å; E188-N262 WeakPolarHBondContact OE1-CB 3.45Å; E188-N262 PolarHBondContact OE1-ND2 3.28Å; E188-I263 HydrophobicContact CG-CD1 4.45Å; E188-I263 HydrophobicContact CG-CG1 4.19Å
189	G	97.4	Very high	97.4	Very high	25 Å²	25	25.9 Å²	25.9	26%	0.258	15%	0.149	S	C	.	.	H	α-helix	trans	-62.1	-41.5	177.8	0	0	0	0	0	112	K185 F186 V187 V192 T193	K185-G189 PolarHBondContact O-N 3.2Å; F186-G189 WeakPolarHBondContact O-CA 3.36Å; F186-G189 PolarHBondContact O-N 3.36Å; V187-G189 PolarHBondContact O-N 2.91Å; G189-V192 PolarHBondContact O-N 3.09Å; G189-T193 WeakPolarHBondContact O-CB 3.38Å; G189-T193 PolarHBondContact O-N 2.98Å; G189-T193 PolarHBondContact O-OG1 3.1Å; G189-T193 VanDerWaalsContact O-OG1 3.09Å
190	L	98.3	Very high	97.1	Very high	2 Å²	2	28 Å²	28	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-49.8	177.8	-173.2	65.9	0	0	0	111.5	Y137 I169 F186 V187 E188 V192 T193 L194 A235	Y137-L190 HydrophobicContact CD1-CD1 3.86Å; Y137-L190 HydrophobicContact CD2-CD1 4.34Å; Y137-L190 HydrophobicContact CE1-CD1 3.3Å; Y137-L190 HydrophobicContact CE2-CD1 3.82Å; Y137-L190 HydrophobicContact CG-CD1 4.36Å; I169-L190 HydrophobicContact CD1-CD2 3.76Å; I169-L190 HydrophobicContact CG1-CD2 4.27Å; F186-L190 HydrophobicContact CE1-CB 4.49Å; F186-L190 HydrophobicContact CE1-CD2 4.14Å; F186-L190 PolarHBondContact O-N 3.42Å; V187-L190 WeakPolarHBondContact O-CB 3.26Å; V187-L190 PolarHBondContact O-N 3.48Å; E188-L190 VanDerWaalsContact C-N 3.32Å; E188-L190 PolarHBondContact O-N 3.47Å; L190-V192 VanDerWaalsContact C-N 3.32Å; L190-V192 PolarHBondContact O-N 3.24Å; L190-T193 PolarHBondContact O-N 3.45Å; L190-L194 HydrophobicContact CD1-CD1 3.64Å; L190-L194 HydrophobicContact CD1-CG 3.98Å; L190-L194 HydrophobicContact CG-CD1 3.96Å; L190-L194 HydrophobicContact CG-CG 4.38Å; L190-L194 WeakPolarHBondContact O-CB 3.38Å; L190-L194 WeakPolarHBondContact O-CG 3.35Å; L190-L194 PolarHBondContact O-N 3.28Å; L190-A235 HydrophobicContact CD2-CB 4.16Å
191	I	98.4	Very high	97	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-45.7	178.6	-66.6	160	0	0	0	110.3	V187 E188 L194 S195 A235 L236 L239 I263 F270	V187-I191 HydrophobicContact CG1-CD1 3.7Å; V187-I191 HydrophobicContact CG1-CG1 4.3Å; V187-I191 WeakPolarHBondContact O-CD1 3.49Å; V187-I191 VanDerWaalsContact O-CG1 3.23Å; V187-I191 WeakPolarHBondContact O-CG1 3.48Å; V187-I191 PolarHBondContact O-N 2.93Å; E188-I191 PolarHBondContact O-N 3.35Å; I191-L194 PolarHBondContact O-N 2.87Å; I191-S195 WeakPolarHBondContact O-CB 3.29Å; I191-S195 PolarHBondContact O-N 3.49Å; I191-S195 PolarHBondContact O-OG 3.48Å; I191-A235 HydrophobicContact CG1-CB 3.93Å; I191-L236 HydrophobicContact CD1-CB 3.93Å; I191-L236 HydrophobicContact CD1-CD1 4.12Å; I191-L236 HydrophobicContact CG1-CB 4.25Å; I191-L239 HydrophobicContact CD1-CD2 4.2Å; I191-I263 HydrophobicContact CB-CD1 4.3Å; I191-I263 HydrophobicContact CD1-CD1 3.66Å; I191-I263 HydrophobicContact CG2-CD1 4.2Å; I191-I263 HydrophobicContact CG2-CG1 4.23Å; I191-I263 HydrophobicContact CG2-CG2 3.9Å; I191-F270 HydrophobicContact CG2-CD2 4.36Å; I191-F270 HydrophobicContact CG2-CE2 4.06Å
192	V	97.9	Very high	96.8	Very high	16 Å²	16	30.4 Å²	30.4	10%	0.097	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-44.5	178.4	170.6	0	0	0	0	110.5	E188 G189 L190 S195 I263 Q266 R267	E188-V192 WeakPolarHBondContact O-CG2 3.35Å; E188-V192 PolarHBondContact O-N 3.34Å; E188-V192 VanDerWaalsContact O-N 3.1Å; G189-V192 PolarHBondContact O-N 3.09Å; L190-V192 VanDerWaalsContact C-N 3.32Å; L190-V192 PolarHBondContact O-N 3.24Å; V192-S195 PolarHBondContact O-OG 2.91Å; V192-I263 HydrophobicContact CG2-CG1 4.31Å; V192-Q266 HydrophobicContact CG2-CB 4.39Å; V192-R267 PolarHBondContact O-NE 3.34Å; V192-R267 VanDerWaalsContact O-NE 3.16Å; V192-R267 PolarHBondContact O-NH2 3.34Å
193	T	98.1	Very high	96.6	Very high	10 Å²	10	29.2 Å²	29.2	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-39.6	179.2	-67.2	0	0	0	0	112.4	Y137 K138 L141 G189 L190 S195 I211 S212 L213	Y137-T193 HydrophobicContact CD1-CG2 4.32Å; Y137-T193 HydrophobicContact CE1-CG2 4.14Å; K138-T193 HydrophobicContact CB-CG2 4.24Å; L141-T193 HydrophobicContact CD2-CG2 3.68Å; G189-T193 WeakPolarHBondContact O-CB 3.38Å; G189-T193 PolarHBondContact O-N 2.98Å; G189-T193 PolarHBondContact O-OG1 3.1Å; G189-T193 VanDerWaalsContact O-OG1 3.09Å; L190-T193 PolarHBondContact O-N 3.45Å; T193-S195 VanDerWaalsContact C-N 3.33Å; T193-S195 PolarHBondContact O-N 2.91Å; T193-I211 HydrophobicContact CG2-CG2 4.04Å; T193-S212 WeakPolarHBondContact O-CA 3.46Å; T193-L213 PolarHBondContact O-N 3.5Å
194	L	97.8	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	18.2	-176.1	-58.5	-170.3	0	0	0	114.5	Y137 L141 L190 I191 L228 E231	Y137-L194 HydrophobicContact CE1-CD2 4.1Å; Y137-L194 HydrophobicContact CE1-CG 4.42Å; L141-L194 HydrophobicContact CD2-CD2 3.93Å; L190-L194 HydrophobicContact CD1-CD1 3.64Å; L190-L194 HydrophobicContact CD1-CG 3.98Å; L190-L194 HydrophobicContact CG-CD1 3.96Å; L190-L194 HydrophobicContact CG-CG 4.38Å; L190-L194 WeakPolarHBondContact O-CB 3.38Å; L190-L194 WeakPolarHBondContact O-CG 3.35Å; L190-L194 PolarHBondContact O-N 3.28Å; I191-L194 PolarHBondContact O-N 2.87Å; L194-L228 HydrophobicContact CD2-CB 4.14Å; L194-L228 HydrophobicContact CD2-CD1 4.21Å; L194-L228 HydrophobicContact CD2-CD2 3.96Å; L194-L228 HydrophobicContact CD2-CG 4.33Å; L194-E231 HydrophobicContact CD1-CB 4.14Å; L194-E231 HydrophobicContact CD1-CG 4.06Å
195	S	97.3	Very high	96	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	23%	0.23	C	C	.	.	S	Bend	trans	-130.8	148.9	171.5	54.5	0	0	0	0	111.4	I191 V192 T193 L213 R267	I191-S195 WeakPolarHBondContact O-CB 3.29Å; I191-S195 PolarHBondContact O-N 3.49Å; I191-S195 PolarHBondContact O-OG 3.48Å; V192-S195 PolarHBondContact O-OG 2.91Å; T193-S195 VanDerWaalsContact C-N 3.33Å; T193-S195 PolarHBondContact O-N 2.91Å; S195-L213 VanDerWaalsContact C-CB 3.43Å; S195-L213 PolarHBondContact O-N 3.21Å; S195-R267 PolarHBondContact O-NE 3.32Å; S195-R267 WeakPolarHBondContact OG-CD 3.5Å; S195-R267 WeakPolarHBondContact OG-CG 3.36Å; S195-R267 PolarHBondContact OG-NE 2.96Å
196	P	96.9	Very high	95.7	Very high	25 Å²	25	50.9 Å²	50.9	16%	0.162	26%	0.256	C	S	.	.			trans	-74.9	148.1	-174.9	31.3	-32.6	0	0	0	110.8	L213 D214 W229 R267 M269	P196-L213 HydrophobicContact CB-CB 4.4Å; P196-D214 HydrophobicContact CB-CB 3.9Å; P196-W229 HydrophobicContact CG-CZ3 4.24Å; P196-R267 WeakPolarHBondContact O-CD 3.32Å; P196-R267 PolarHBondContact O-NE 3.04Å; P196-M269 HydrophobicContact CG-SD 4.17Å; P196-M269 WeakPolarHBondContact O-CE 3.32Å
197	R	95.8	Very high	95.3	Very high	51 Å²	51	53.8 Å²	53.8	19%	0.192	27%	0.27	C	S	.	.			trans	-72.5	143.4	167	-64.9	175.9	71.7	168.9	-1.2	110.1	I203 E208 S212 D214 R215	R197-I203 VanDerWaalsContact NE-CG1 3.29Å; R197-I203 VanDerWaalsContact NH2-CB 3.34Å; R197-E208 IonicContact CZ-OE1 3.91Å; R197-E208 VanDerWaalsContact CZ-OE1 3.27Å; R197-E208 PolarHBondContact NH1-O 3.39Å; R197-E208 VanDerWaalsContact NH1-O 3.15Å; R197-E208 IonicContact NH1-OE1 2.78Å; R197-E208 PolarHBondContact NH1-OE1 3.04Å; R197-E208 IonicContact NH2-OE1 3.2Å; R197-E208 PolarHBondContact NH2-OE1 3.37Å; R197-E208 IonicContact NH2-OE2 2.66Å; R197-S212 WeakPolarHBondContact CD-OG 3.39Å; R197-D214 PolarHBondContact N-OD1 3.26Å; R197-R215 VanDerWaalsContact NH1-NH2 3.14Å
198	M	93.3	Very high	95	Very high	75 Å²	75	57.1 Å²	57.1	37%	0.369	29%	0.285	S	S	.	.			trans	-110.1	169.8	170.4	-68.1	-167.8	-46.1	0	0	110.5	D200 S201 P268 M269	M198-D200 WeakPolarHBondContact CB-OD1 3.48Å; M198-D200 WeakPolarHBondContact CE-OD1 3.5Å; M198-D200 PolarHBondContact O-N 3.07Å; M198-S201 PolarHBondContact N-OG 3.24Å; M198-S201 VanDerWaalsContact O-CB 3.28Å; M198-S201 WeakPolarHBondContact O-CB 3.47Å; M198-S201 PolarHBondContact O-N 3.4Å; M198-S201 VanDerWaalsContact O-N 3.11Å; M198-S201 PolarHBondContact O-OG 2.98Å; M198-P268 HydrophobicContact CE-CB 3.57Å; M198-P268 HydrophobicContact CE-CG 4.02Å; M198-M269 HydrophobicContact CB-CE 4.35Å; M198-M269 HydrophobicContact CE-CB 4.15Å; M198-M269 HydrophobicContact CE-CE 3.54Å; M198-M269 VanDerWaalsContact CE-N 3.25Å; M198-M269 HydrophobicContact CG-CE 3.45Å; M198-M269 VanDerWaalsContact CG-CE 3.45Å; M198-M269 HydrophobicContact SD-CB 4.24Å; M198-M269 HydrophobicContact SD-CE 3.58Å; M198-M269 VanDerWaalsContact SD-CE 3.58Å
199	A	91.2	Very high	94.6	Very high	118 Å²	118	63.9 Å²	63.9	98%	0.975	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-29.2	-179	0	0	0	0	0	113
200	D	92.1	Very high	94.5	Very high	56 Å²	56	64.5 Å²	64.5	30%	0.299	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	1.9	178.8	61.6	-21.8	0	0	0	113.3	M198 E202 P268 H311 A313	M198-D200 WeakPolarHBondContact CB-OD1 3.48Å; M198-D200 WeakPolarHBondContact CE-OD1 3.5Å; M198-D200 PolarHBondContact O-N 3.07Å; D200-E202 PolarHBondContact O-N 3.17Å; D200-P268 WeakPolarHBondContact OD2-CB 3.46Å; D200-H311 PolarHBondContact O-CE1 3.2Å; D200-H311 PolarHBondContact O-NE2 3.06Å; D200-A313 VanDerWaalsContact OD2-CB 3.3Å; D200-A313 WeakPolarHBondContact OD2-CB 3.38Å
201	S	95	Very high	94.4	Very high	17 Å²	17	64.9 Å²	64.9	12%	0.119	32%	0.316	C	S	.	.			trans	-63.7	116.9	176.7	-77	0	0	0	0	112.6	M198 I203 Q266	M198-S201 PolarHBondContact N-OG 3.24Å; M198-S201 VanDerWaalsContact O-CB 3.28Å; M198-S201 WeakPolarHBondContact O-CB 3.47Å; M198-S201 PolarHBondContact O-N 3.4Å; M198-S201 VanDerWaalsContact O-N 3.11Å; M198-S201 PolarHBondContact O-OG 2.98Å; S201-I203 PolarHBondContact O-N 3.16Å; S201-Q266 WeakPolarHBondContact CB-O 3.3Å; S201-Q266 PolarHBondContact OG-O 3.08Å
202	E	95	Very high	94.2	Very high	97 Å²	97	65 Å²	65	45%	0.453	32%	0.317	S	S	.	.			trans	-83.1	93.9	175.4	-170.9	-165.7	160.6	0	0	111.2	D200 R265 Q266 H311	D200-E202 PolarHBondContact O-N 3.17Å; E202-R265 HydrophobicContact CB-CB 4.48Å; E202-R265 PolarHBondContact N-O 3.1Å; E202-R265 IonicContact OE1-NH1 2.81Å; E202-R265 IonicContact OE2-NH1 3.39Å; E202-Q266 WeakPolarHBondContact O-CG 3.46Å; E202-H311 IonicContact OE2-CD2 2.76Å
203	I	94.2	Very high	94.1	Very high	24 Å²	24	64.2 Å²	64.2	12%	0.123	31%	0.312	C	S	.	.			trans	-95.1	128.8	-178.6	-55.8	-43.6	0	0	0	112.1	R197 S201 Q207 Q266 R267	R197-I203 VanDerWaalsContact NE-CG1 3.29Å; R197-I203 VanDerWaalsContact NH2-CB 3.34Å; S201-I203 PolarHBondContact O-N 3.16Å; I203-Q207 HydrophobicContact CG2-CB 4.06Å; I203-Q266 HydrophobicContact CD1-CB 3.76Å; I203-Q266 HydrophobicContact CD1-CG 3.9Å; I203-R267 VanDerWaalsContact CD1-NH1 3.33Å
204	P	93.2	Very high	93.9	Very high	57 Å²	57	67.2 Å²	67.2	37%	0.37	33%	0.328	S	S	.	.			trans	-60.4	139.1	172.5	-24.3	34.3	0	0	0	112.1	R206 Q207 E208	P204-R206 PolarHBondContact O-N 2.66Å; P204-Q207 WeakPolarHBondContact O-CA 3.43Å; P204-Q207 PolarHBondContact O-N 3.2Å; P204-E208 PolarHBondContact O-N 3.13Å
205	R	91.6	Very high	93.8	Very high	239 Å²	239	72.3 Å²	72.3	90%	0.902	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-51	-32.7	-179.2	-70.7	-173.9	176.7	176.4	-1	114.8	Q207	R205-Q207 PolarHBondContact O-N 2.96Å
206	R	90.9	Very high	93.7	Very high	237 Å²	237	72.6 Å²	72.6	89%	0.894	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67.6	-24.8	178.2	-171.7	-177.2	-68.5	168.7	-1.6	112.7	P204	P204-R206 PolarHBondContact O-N 2.66Å
207	Q	91.4	Very high	93.4	Very high	64 Å²	64	73.9 Å²	73.9	30%	0.299	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-106.7	5.7	-173.1	-63.5	173.7	-10.6	0	0	112.5	I203 P204 R205 H209 D210	I203-Q207 HydrophobicContact CG2-CB 4.06Å; P204-Q207 WeakPolarHBondContact O-CA 3.43Å; P204-Q207 PolarHBondContact O-N 3.2Å; R205-Q207 PolarHBondContact O-N 2.96Å; Q207-H209 PolarHBondContact O-N 3.27Å; Q207-D210 WeakPolarHBondContact CA-OD2 3.36Å; Q207-D210 WeakPolarHBondContact CB-OD2 3.39Å; Q207-D210 WeakPolarHBondContact CG-OD2 3.47Å; Q207-D210 WeakPolarHBondContact O-CB 3.17Å; Q207-D210 PolarHBondContact O-N 3.5Å; Q207-D210 VanDerWaalsContact O-N 3.09Å
208	E	90.4	Very high	93.3	Very high	70 Å²	70	79.1 Å²	79.1	33%	0.327	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-36.5	-174.8	-169	57.4	-116.2	0	0	113.2	R197 P204 R215	R197-E208 IonicContact CZ-OE1 3.91Å; R197-E208 VanDerWaalsContact CZ-OE1 3.27Å; R197-E208 PolarHBondContact NH1-O 3.39Å; R197-E208 VanDerWaalsContact NH1-O 3.15Å; R197-E208 IonicContact NH1-OE1 2.78Å; R197-E208 PolarHBondContact NH1-OE1 3.04Å; R197-E208 IonicContact NH2-OE1 3.2Å; R197-E208 PolarHBondContact NH2-OE1 3.37Å; R197-E208 IonicContact NH2-OE2 2.66Å; P204-E208 PolarHBondContact O-N 3.13Å; E208-R215 PolarHBondContact O-NH1 3.06Å; E208-R215 PolarHBondContact O-NH2 2.92Å; E208-R215 VanDerWaalsContact O-NH2 3.12Å
209	H	91.5	Very high	93.1	Very high	156 Å²	156	82.3 Å²	82.3	72%	0.722	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.1	-178.2	-56.7	-56.7	0	0	0	113.6	Q142 Q207	Q142-H209 PolarHBondContact OE1-O 3.45Å; Q207-H209 PolarHBondContact O-N 3.27Å
210	D	93.9	Very high	93.2	Very high	38 Å²	38	77.7 Å²	77.7	20%	0.203	35%	0.353	C	S	.	.	S	Bend	trans	-65.1	147.6	177.6	-69.2	-22.1	0	0	0	110.3	K138 Q207 R215	K138-D210 HydrophobicContact CD-CB 4.21Å; K138-D210 VanDerWaalsContact NZ-CG 3.27Å; K138-D210 IonicContact NZ-OD1 2.96Å; K138-D210 PolarHBondContact NZ-OD1 3.07Å; K138-D210 IonicContact NZ-OD2 3.31Å; K138-D210 PolarHBondContact NZ-OD2 3.21Å; Q207-D210 WeakPolarHBondContact CA-OD2 3.36Å; Q207-D210 WeakPolarHBondContact CB-OD2 3.39Å; Q207-D210 WeakPolarHBondContact CG-OD2 3.47Å; Q207-D210 WeakPolarHBondContact O-CB 3.17Å; Q207-D210 PolarHBondContact O-N 3.5Å; Q207-D210 VanDerWaalsContact O-N 3.09Å; D210-R215 PolarHBondContact O-NH1 3.08Å
211	I	95.9	Very high	93.1	Very high	11 Å²	11	80.5 Å²	80.5	6%	0.056	38%	0.375	C	S	.	.			trans	-69.1	146	175.2	-164.9	155.8	0	0	0	111	K138 L141 Q142 V145 T193 R215 I216	K138-I211 HydrophobicContact CB-CG2 4.33Å; K138-I211 VanDerWaalsContact O-CG2 3.27Å; K138-I211 WeakPolarHBondContact O-CG2 3.28Å; L141-I211 HydrophobicContact CB-CG2 4.16Å; L141-I211 HydrophobicContact CD2-CG2 4.07Å; L141-I211 HydrophobicContact CG-CD1 4.44Å; L141-I211 HydrophobicContact CG-CG2 4.11Å; Q142-I211 HydrophobicContact CB-CB 4.02Å; Q142-I211 HydrophobicContact CB-CD1 4.17Å; Q142-I211 HydrophobicContact CB-CG2 4.08Å; Q142-I211 HydrophobicContact CG-CB 4.41Å; Q142-I211 HydrophobicContact CG-CD1 4.42Å; V145-I211 HydrophobicContact CB-CD1 3.85Å; V145-I211 HydrophobicContact CG1-CD1 4.08Å; V145-I211 HydrophobicContact CG2-CD1 3.88Å; T193-I211 HydrophobicContact CG2-CG2 4.04Å; I211-R215 HydrophobicContact CG1-CB 4.49Å; I211-I216 HydrophobicContact CD1-CG1 4.32Å
212	S	95.8	Very high	93	Very high	2 Å²	2	82.5 Å²	82.5	1%	0.014	38%	0.38	C	S	.	.			trans	-142.6	160.2	177.4	32.3	0	0	0	0	108.1	T193 R197 D214 R215	T193-S212 WeakPolarHBondContact O-CA 3.46Å; R197-S212 WeakPolarHBondContact CD-OG 3.39Å; S212-D214 WeakPolarHBondContact CB-OD1 3.36Å; S212-D214 PolarHBondContact O-N 3.23Å; S212-D214 VanDerWaalsContact O-N 3.17Å; S212-D214 PolarHBondContact OG-OD1 3.17Å; S212-R215 PolarHBondContact O-N 2.99Å
213	L	95.6	Very high	93	Very high	0 Å²	0	78 Å²	78	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-61.7	-29.4	-168.9	-160	78.3	0	0	0	113.2	T193 S195 P196 R215 I216 Y225 L228 W229	T193-L213 PolarHBondContact O-N 3.5Å; S195-L213 VanDerWaalsContact C-CB 3.43Å; S195-L213 PolarHBondContact O-N 3.21Å; P196-L213 HydrophobicContact CB-CB 4.4Å; L213-R215 PolarHBondContact O-N 3.08Å; L213-I216 HydrophobicContact CD1-CD1 3.97Å; L213-I216 PolarHBondContact O-N 3.21Å; L213-I216 VanDerWaalsContact O-N 3.14Å; L213-Y225 HydrophobicContact CD1-CD2 4.48Å; L213-Y225 HydrophobicContact CD1-CE2 4.49Å; L213-Y225 HydrophobicContact CD2-CD1 4.31Å; L213-Y225 HydrophobicContact CD2-CD2 4.44Å; L213-Y225 HydrophobicContact CD2-CE1 3.64Å; L213-Y225 HydrophobicContact CD2-CE2 3.85Å; L213-Y225 HydrophobicContact CG-CD2 4.03Å; L213-Y225 HydrophobicContact CG-CE1 4.26Å; L213-Y225 HydrophobicContact CG-CE2 3.58Å; L213-Y225 VanDerWaalsContact O-CE2 3.23Å; L213-Y225 WeakPolarHBondContact O-CE2 3.35Å; L213-L228 HydrophobicContact CD1-CB 3.7Å; L213-L228 HydrophobicContact CD1-CD1 4.31Å; L213-W229 HydrophobicContact CD2-CB 3.86Å; L213-W229 HydrophobicContact CD2-CD2 4.24Å; L213-W229 HydrophobicContact CD2-CE3 3.61Å; L213-W229 HydrophobicContact CD2-CG 4.4Å
214	D	93.8	Very high	93	Very high	74 Å²	74	83 Å²	83	40%	0.396	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-62.2	-22.6	175.9	54.8	-69.7	0	0	0	113.8	P196 R197 S212	P196-D214 HydrophobicContact CB-CB 3.9Å; R197-D214 PolarHBondContact N-OD1 3.26Å; S212-D214 WeakPolarHBondContact CB-OD1 3.36Å; S212-D214 PolarHBondContact O-N 3.23Å; S212-D214 VanDerWaalsContact O-N 3.17Å; S212-D214 PolarHBondContact OG-OD1 3.17Å
215	R	94.6	Very high	93.1	Very high	106 Å²	106	81.5 Å²	81.5	40%	0.4	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-91.7	0.2	179.1	-57.7	-177.4	-176.3	170.5	-1.5	113.3	R197 E208 D210 I211 S212 L213	R197-R215 VanDerWaalsContact NH1-NH2 3.14Å; E208-R215 PolarHBondContact O-NH1 3.06Å; E208-R215 PolarHBondContact O-NH2 2.92Å; E208-R215 VanDerWaalsContact O-NH2 3.12Å; D210-R215 PolarHBondContact O-NH1 3.08Å; I211-R215 HydrophobicContact CG1-CB 4.49Å; S212-R215 PolarHBondContact O-N 2.99Å; L213-R215 PolarHBondContact O-N 3.08Å
216	I	94.8	Very high	93.2	Very high	7 Å²	7	75.1 Å²	75.1	4%	0.036	35%	0.353	C	S	.	.	S	Bend	trans	-92.5	121.6	-179.5	-54.5	-170.9	0	0	0	109.5	L141 V145 I211 L213 R218 I223 Y225 L228	L141-I216 HydrophobicContact CD1-CD1 4.19Å; L141-I216 HydrophobicContact CD2-CD1 4.06Å; L141-I216 HydrophobicContact CG-CD1 4.37Å; V145-I216 HydrophobicContact CG2-CD1 4.36Å; V145-I216 HydrophobicContact CG2-CG1 4.14Å; V145-I216 HydrophobicContact CG2-CG2 4.16Å; I211-I216 HydrophobicContact CD1-CG1 4.32Å; L213-I216 HydrophobicContact CD1-CD1 3.97Å; L213-I216 PolarHBondContact O-N 3.21Å; L213-I216 VanDerWaalsContact O-N 3.14Å; I216-R218 PolarHBondContact O-N 3.31Å; I216-I223 HydrophobicContact CG2-CG2 4.14Å; I216-Y225 HydrophobicContact CB-CD2 4.44Å; I216-L228 HydrophobicContact CD1-CD1 3.6Å
217	P	92.5	Very high	93.4	Very high	53 Å²	53	67.7 Å²	67.7	34%	0.344	33%	0.333	S	S	.	.			trans	-60.5	136	174.8	-19.8	31.4	0	0	0	111.2	D219 H220	P217-D219 WeakPolarHBondContact CB-OD1 3.5Å; P217-D219 PolarHBondContact O-N 3.04Å; P217-H220 HydrophobicContact CB-CB 4.25Å; P217-H220 WeakPolarHBondContact O-CB 3.29Å; P217-H220 PolarHBondContact O-N 3.26Å
218	R	91.7	Very high	93.7	Very high	161 Å²	161	64.9 Å²	64.9	61%	0.608	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.7	179.4	-68.7	-78.9	-173.4	150.9	2.9	112.5	I216 Y225 N226	I216-R218 PolarHBondContact O-N 3.31Å; R218-Y225 VanDerWaalsContact CD-CG 3.49Å; R218-Y225 VanDerWaalsContact CZ-CZ 3.42Å; R218-Y225 VanDerWaalsContact NH1-CE1 3.27Å; R218-Y225 VanDerWaalsContact NH2-CZ 3.25Å; R218-Y225 PolarHBondContact NH2-OH 2.96Å; R218-N226 PolarHBondContact NH1-OD1 3.13Å
219	D	90.4	Very high	93.9	Very high	141 Å²	141	64.4 Å²	64.4	75%	0.754	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	19	-177.2	61.5	-31.8	0	0	0	112.8	P217	P217-D219 WeakPolarHBondContact CB-OD1 3.5Å; P217-D219 PolarHBondContact O-N 3.04Å
220	H	92.6	Very high	94.1	Very high	21 Å²	21	62.4 Å²	62.4	10%	0.097	31%	0.307	C	S	.	.			trans	-65.5	136.8	-179.5	-175.5	-82.9	0	0	0	111.6	M144 I150 P217 Y222 I223	M144-H220 PolarHBondContact O-NE2 3.2Å; I150-H220 WeakPolarHBondContact CD1-CE1 3.5Å; P217-H220 HydrophobicContact CB-CB 4.25Å; P217-H220 WeakPolarHBondContact O-CB 3.29Å; P217-H220 PolarHBondContact O-N 3.26Å; H220-Y222 VanDerWaalsContact C-N 3.33Å; H220-Y222 PolarHBondContact ND1-N 3.02Å; H220-Y222 PolarHBondContact O-N 3.34Å; H220-I223 WeakPolarHBondContact ND1-CB 3.41Å; H220-I223 PolarHBondContact ND1-N 3.33Å
221	P	89.9	Confident	94.2	Very high	115 Å²	115	62.6 Å²	62.6	75%	0.747	31%	0.306	S	S	*	.	S	Bend	trans	-61.6	-32.6	-167.8	-26	34.4	0	0	0	115.9
222	Y	93.1	Very high	94.2	Very high	59 Å²	59	62.1 Å²	62.1	23%	0.231	31%	0.305	C	S	.	.	S	Bend	trans	-119.1	-58.5	-175	-167.5	-101	0	0	0	112.5	M144 E155 W158 D159 H220 Q224	M144-Y222 HydrophobicContact CE-CD1 4.26Å; E155-Y222 HydrophobicContact CB-CD2 4.24Å; E155-Y222 HydrophobicContact CB-CE1 4.15Å; E155-Y222 HydrophobicContact CB-CE2 3.64Å; E155-Y222 VanDerWaalsContact CD-CD2 3.41Å; E155-Y222 HydrophobicContact CG-CD1 4.35Å; E155-Y222 HydrophobicContact CG-CD2 3.54Å; E155-Y222 HydrophobicContact CG-CE1 4.27Å; E155-Y222 HydrophobicContact CG-CE2 3.45Å; E155-Y222 VanDerWaalsContact CG-CE2 3.45Å; E155-Y222 HydrophobicContact CG-CG 4.02Å; E155-Y222 WeakPolarHBondContact OE1-CD2 3.41Å; W158-Y222 HydrophobicContact CB-CE1 4.41Å; W158-Y222 AromaticContact CD1-CE1 3.79Å; W158-Y222 HydrophobicContact CG-CE1 4.4Å; D159-Y222 PolarHBondContact OD1-OH 3.19Å; D159-Y222 PolarHBondContact OD2-OH 2.92Å; H220-Y222 VanDerWaalsContact C-N 3.33Å; H220-Y222 PolarHBondContact ND1-N 3.02Å; H220-Y222 PolarHBondContact O-N 3.34Å; Y222-Q224 PolarHBondContact O-N 3.12Å
223	I	94.9	Very high	94.2	Very high	3 Å²	3	66 Å²	66	2%	0.015	32%	0.321	C	S	.	.			trans	-65	117.2	177.5	-55.8	-62.9	0	0	0	111.2	L141 M144 W158 I216 H220 L228	L141-I223 HydrophobicContact CD1-CD1 4.45Å; L141-I223 HydrophobicContact CD1-CG2 4.2Å; M144-I223 HydrophobicContact CB-CD1 4.15Å; M144-I223 HydrophobicContact CB-CG1 4.02Å; W158-I223 HydrophobicContact CD2-CD1 3.71Å; W158-I223 HydrophobicContact CG-CD1 3.83Å; W158-I223 HydrophobicContact CZ2-CD1 4Å; W158-I223 VanDerWaalsContact NE1-CD1 3.27Å; I216-I223 HydrophobicContact CG2-CG2 4.14Å; H220-I223 WeakPolarHBondContact ND1-CB 3.41Å; H220-I223 PolarHBondContact ND1-N 3.33Å; I223-L228 HydrophobicContact CG2-CD1 3.42Å; I223-L228 VanDerWaalsContact CG2-CD1 3.42Å; I223-L228 HydrophobicContact CG2-CG 4.24Å
224	Q	94.1	Very high	94.3	Very high	128 Å²	128	68.2 Å²	68.2	60%	0.598	34%	0.339	S	S	*	.			trans	-98.1	117.5	-179.7	-63.3	178.7	26.9	0	0	111.3	Y222 N226 V227 L228	Y222-Q224 PolarHBondContact O-N 3.12Å; Q224-N226 VanDerWaalsContact C-N 3.33Å; Q224-N226 PolarHBondContact O-N 3.37Å; Q224-V227 HydrophobicContact CB-CB 4.1Å; Q224-V227 HydrophobicContact CB-CG2 3.78Å; Q224-V227 PolarHBondContact O-N 3.04Å; Q224-L228 PolarHBondContact O-N 3.15Å
225	Y	95.1	Very high	94.4	Very high	27 Å²	27	64.8 Å²	64.8	11%	0.106	32%	0.321	C	S	.	.	H	α-helix	trans	-53	-46.9	179.9	-177.7	-74.4	0	0	0	113.1	L213 I216 R218 V227 L228 W229	L213-Y225 HydrophobicContact CD1-CD2 4.48Å; L213-Y225 HydrophobicContact CD1-CE2 4.49Å; L213-Y225 HydrophobicContact CD2-CD1 4.31Å; L213-Y225 HydrophobicContact CD2-CD2 4.44Å; L213-Y225 HydrophobicContact CD2-CE1 3.64Å; L213-Y225 HydrophobicContact CD2-CE2 3.85Å; L213-Y225 HydrophobicContact CG-CD2 4.03Å; L213-Y225 HydrophobicContact CG-CE1 4.26Å; L213-Y225 HydrophobicContact CG-CE2 3.58Å; L213-Y225 VanDerWaalsContact O-CE2 3.23Å; L213-Y225 WeakPolarHBondContact O-CE2 3.35Å; I216-Y225 HydrophobicContact CB-CD2 4.44Å; R218-Y225 VanDerWaalsContact CD-CG 3.49Å; R218-Y225 VanDerWaalsContact CZ-CZ 3.42Å; R218-Y225 VanDerWaalsContact NH1-CE1 3.27Å; R218-Y225 VanDerWaalsContact NH2-CZ 3.25Å; R218-Y225 PolarHBondContact NH2-OH 2.96Å; Y225-V227 VanDerWaalsContact C-N 3.33Å; Y225-V227 PolarHBondContact O-N 3.37Å; Y225-L228 PolarHBondContact O-N 3.36Å; Y225-W229 HydrophobicContact CE1-CB 4.32Å; Y225-W229 WeakPolarHBondContact O-CB 3.48Å; Y225-W229 PolarHBondContact O-N 2.8Å
226	N	94.3	Very high	94.6	Very high	105 Å²	105	60 Å²	60	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-68.3	-34.6	-174.1	-63.5	-18.2	0	0	0	111.8	R218 Q224 W229 E230	R218-N226 PolarHBondContact NH1-OD1 3.13Å; Q224-N226 VanDerWaalsContact C-N 3.33Å; Q224-N226 PolarHBondContact O-N 3.37Å; N226-W229 PolarHBondContact O-N 2.96Å; N226-E230 WeakPolarHBondContact O-CG 3.45Å; N226-E230 PolarHBondContact O-N 3.39Å; N226-E230 VanDerWaalsContact O-N 3.08Å
227	V	95.6	Very high	94.6	Very high	80 Å²	80	64.4 Å²	64.4	49%	0.485	32%	0.324	S	S	.	.	H	α-helix	trans	-65.4	-47.6	176.4	177.5	0	0	0	0	109.8	Q224 Y225 W229 E230 E231	Q224-V227 HydrophobicContact CB-CB 4.1Å; Q224-V227 HydrophobicContact CB-CG2 3.78Å; Q224-V227 PolarHBondContact O-N 3.04Å; Y225-V227 VanDerWaalsContact C-N 3.33Å; Y225-V227 PolarHBondContact O-N 3.37Å; V227-W229 VanDerWaalsContact C-N 3.34Å; V227-W229 PolarHBondContact O-N 3.39Å; V227-E230 PolarHBondContact O-N 3.48Å; V227-E231 WeakPolarHBondContact O-CB 3.28Å; V227-E231 PolarHBondContact O-N 3.38Å
228	L	96.4	Very high	94.8	Very high	6 Å²	6	65.7 Å²	65.7	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-39.5	177.3	-70.2	-172.5	0	0	0	112.8	L141 W158 L194 L213 I216 I223 Q224 Y225 E231 G232	L141-L228 HydrophobicContact CD1-CD1 4Å; L141-L228 HydrophobicContact CD2-CD1 4.43Å; W158-L228 HydrophobicContact CZ2-CD2 4.27Å; L194-L228 HydrophobicContact CD2-CB 4.14Å; L194-L228 HydrophobicContact CD2-CD1 4.21Å; L194-L228 HydrophobicContact CD2-CD2 3.96Å; L194-L228 HydrophobicContact CD2-CG 4.33Å; L213-L228 HydrophobicContact CD1-CB 3.7Å; L213-L228 HydrophobicContact CD1-CD1 4.31Å; I216-L228 HydrophobicContact CD1-CD1 3.6Å; I223-L228 HydrophobicContact CG2-CD1 3.42Å; I223-L228 VanDerWaalsContact CG2-CD1 3.42Å; I223-L228 HydrophobicContact CG2-CG 4.24Å; Q224-L228 PolarHBondContact O-N 3.15Å; Y225-L228 PolarHBondContact O-N 3.36Å; L228-E231 PolarHBondContact O-N 3.17Å; L228-G232 PolarHBondContact O-N 3.44Å
229	W	96	Very high	95.1	Very high	60 Å²	60	58 Å²	58	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-60.4	-50.1	175.7	174.9	-112	0	0	0	112.1	P196 L213 Y225 N226 V227 E231 G232 K233 F270	P196-W229 HydrophobicContact CG-CZ3 4.24Å; L213-W229 HydrophobicContact CD2-CB 3.86Å; L213-W229 HydrophobicContact CD2-CD2 4.24Å; L213-W229 HydrophobicContact CD2-CE3 3.61Å; L213-W229 HydrophobicContact CD2-CG 4.4Å; Y225-W229 HydrophobicContact CE1-CB 4.32Å; Y225-W229 WeakPolarHBondContact O-CB 3.48Å; Y225-W229 PolarHBondContact O-N 2.8Å; N226-W229 PolarHBondContact O-N 2.96Å; V227-W229 VanDerWaalsContact C-N 3.34Å; V227-W229 PolarHBondContact O-N 3.39Å; W229-E231 VanDerWaalsContact C-N 3.32Å; W229-E231 PolarHBondContact O-N 3.19Å; W229-G232 PolarHBondContact O-N 3.41Å; W229-K233 HydrophobicContact CD2-CD 4.44Å; W229-K233 HydrophobicContact CZ2-CD 3.89Å; W229-K233 HydrophobicContact CZ2-CG 4.39Å; W229-K233 WeakPolarHBondContact O-CG 3.36Å; W229-K233 PolarHBondContact O-N 2.85Å; W229-K233 VanDerWaalsContact O-N 3.08Å; W229-F270 HydrophobicContact CH2-CZ 4.23Å; W229-F270 HydrophobicContact CZ3-CZ 4.26Å
230	E	95.9	Very high	95.4	Very high	113 Å²	113	53.3 Å²	53.3	53%	0.528	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-36.8	178.2	-67.1	-56.6	143.7	0	0	111.6	N226 V227 K233 A234	N226-E230 WeakPolarHBondContact O-CG 3.45Å; N226-E230 PolarHBondContact O-N 3.39Å; N226-E230 VanDerWaalsContact O-N 3.08Å; V227-E230 PolarHBondContact O-N 3.48Å; E230-K233 PolarHBondContact O-N 3.15Å; E230-A234 VanDerWaalsContact O-CB 3.3Å; E230-A234 WeakPolarHBondContact O-CB 3.43Å; E230-A234 PolarHBondContact O-N 3.37Å
231	E	95.7	Very high	95.4	Very high	42 Å²	42	57.3 Å²	57.3	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-42.1	174.6	-170.8	174.8	-178.3	0	0	111.9	L194 V227 L228 W229 A234 A235	L194-E231 HydrophobicContact CD1-CB 4.14Å; L194-E231 HydrophobicContact CD1-CG 4.06Å; V227-E231 WeakPolarHBondContact O-CB 3.28Å; V227-E231 PolarHBondContact O-N 3.38Å; L228-E231 PolarHBondContact O-N 3.17Å; W229-E231 VanDerWaalsContact C-N 3.32Å; W229-E231 PolarHBondContact O-N 3.19Å; E231-A234 PolarHBondContact O-N 3.24Å; E231-A235 WeakPolarHBondContact O-CB 3.22Å; E231-A235 PolarHBondContact O-N 3.35Å
232	G	95.8	Very high	95.7	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-41.9	173.9	0	0	0	0	0	113.1	L228 W229 A235 L236	L228-G232 PolarHBondContact O-N 3.44Å; W229-G232 PolarHBondContact O-N 3.41Å; G232-A235 PolarHBondContact O-N 3.37Å; G232-L236 PolarHBondContact O-N 3.12Å; G232-L236 VanDerWaalsContact O-N 3.16Å
233	K	95.8	Very high	95.7	Very high	84 Å²	84	50 Å²	50	37%	0.365	25%	0.246	S	C	.	.	H	α-helix	trans	-69	-42	176.1	-65.7	-172.8	96.3	-174.6	0	112.2	W229 E230 A235 L236 E237 F270	W229-K233 HydrophobicContact CD2-CD 4.44Å; W229-K233 HydrophobicContact CZ2-CD 3.89Å; W229-K233 HydrophobicContact CZ2-CG 4.39Å; W229-K233 WeakPolarHBondContact O-CG 3.36Å; W229-K233 PolarHBondContact O-N 2.85Å; W229-K233 VanDerWaalsContact O-N 3.08Å; E230-K233 PolarHBondContact O-N 3.15Å; K233-A235 VanDerWaalsContact C-N 3.3Å; K233-A235 PolarHBondContact O-N 2.73Å; K233-L236 WeakPolarHBondContact O-CB 3.45Å; K233-L236 PolarHBondContact O-N 2.9Å; K233-E237 PolarHBondContact O-N 3.22Å; K233-F270 HydrophobicContact CG-CE1 4.38Å; K233-F270 HydrophobicContact CG-CZ 4.45Å
234	A	96.5	Very high	95.5	Very high	46 Å²	46	54.1 Å²	54.1	38%	0.38	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-41	175.8	0	0	0	0	0	111.2	E230 E231 L236 E237 Q238	E230-A234 VanDerWaalsContact O-CB 3.3Å; E230-A234 WeakPolarHBondContact O-CB 3.43Å; E230-A234 PolarHBondContact O-N 3.37Å; E231-A234 PolarHBondContact O-N 3.24Å; A234-L236 PolarHBondContact O-N 3.35Å; A234-E237 WeakPolarHBondContact O-CB 3.21Å; A234-E237 PolarHBondContact O-N 3.45Å; A234-Q238 WeakPolarHBondContact O-CG 3.3Å; A234-Q238 PolarHBondContact O-N 3.49Å
235	A	97.5	Very high	95.3	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-39.5	175.2	0	0	0	0	0	112.5	I169 V187 L190 I191 E231 G232 K233 Q238 L239	I169-A235 HydrophobicContact CD1-CB 4.34Å; V187-A235 HydrophobicContact CG1-CB 4.31Å; L190-A235 HydrophobicContact CD2-CB 4.16Å; I191-A235 HydrophobicContact CG1-CB 3.93Å; E231-A235 WeakPolarHBondContact O-CB 3.22Å; E231-A235 PolarHBondContact O-N 3.35Å; G232-A235 PolarHBondContact O-N 3.37Å; K233-A235 VanDerWaalsContact C-N 3.3Å; K233-A235 PolarHBondContact O-N 2.73Å; A235-Q238 PolarHBondContact O-N 2.9Å; A235-L239 PolarHBondContact O-N 3.39Å; A235-L239 VanDerWaalsContact O-N 3.11Å
236	L	97.7	Very high	94.9	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-44.3	172.5	178.7	62.7	0	0	0	111.4	I191 G232 K233 A234 Q238 L239 L240 L260 I263 F270	I191-L236 HydrophobicContact CD1-CB 3.93Å; I191-L236 HydrophobicContact CD1-CD1 4.12Å; I191-L236 HydrophobicContact CG1-CB 4.25Å; G232-L236 PolarHBondContact O-N 3.12Å; G232-L236 VanDerWaalsContact O-N 3.16Å; K233-L236 WeakPolarHBondContact O-CB 3.45Å; K233-L236 PolarHBondContact O-N 2.9Å; A234-L236 PolarHBondContact O-N 3.35Å; L236-Q238 VanDerWaalsContact C-N 3.31Å; L236-Q238 PolarHBondContact O-N 3.24Å; L236-L239 PolarHBondContact O-N 3.5Å; L236-L239 VanDerWaalsContact O-N 3.14Å; L236-L240 HydrophobicContact CD1-CD1 4.47Å; L236-L240 HydrophobicContact CD1-CG 4.29Å; L236-L240 HydrophobicContact CG-CD1 4.11Å; L236-L240 HydrophobicContact CG-CG 4.38Å; L236-L240 VanDerWaalsContact O-CG 3.31Å; L236-L240 WeakPolarHBondContact O-CG 3.49Å; L236-L240 PolarHBondContact O-N 3.12Å; L236-L260 HydrophobicContact CD1-CD2 3.96Å; L236-I263 HydrophobicContact CD1-CD1 4.48Å; L236-F270 HydrophobicContact CD2-CB 4.04Å; L236-F270 HydrophobicContact CD2-CD1 3.46Å; L236-F270 VanDerWaalsContact CD2-CD1 3.46Å; L236-F270 HydrophobicContact CD2-CD2 4.27Å; L236-F270 HydrophobicContact CD2-CE1 3.9Å; L236-F270 HydrophobicContact CD2-CG 3.68Å; L236-F270 HydrophobicContact CD2-CZ 4.47Å
237	E	96.3	Very high	94.7	Very high	98 Å²	98	53.2 Å²	53.2	46%	0.458	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-40	177.8	-167	-174.1	162.5	0	0	112.2	K233 A234 L240 K241	K233-E237 PolarHBondContact O-N 3.22Å; A234-E237 WeakPolarHBondContact O-CB 3.21Å; A234-E237 PolarHBondContact O-N 3.45Å; E237-L240 PolarHBondContact O-N 3.41Å; E237-K241 HydrophobicContact CG-CD 4.42Å; E237-K241 WeakPolarHBondContact O-CB 3.48Å; E237-K241 WeakPolarHBondContact O-CG 3.25Å; E237-K241 PolarHBondContact O-N 3.41Å; E237-K241 WeakPolarHBondContact OE1-CE 3.37Å; E237-K241 IonicContact OE1-NZ 2.72Å; E237-K241 PolarHBondContact OE1-NZ 3.36Å
238	Q	96.6	Very high	94.6	Very high	80 Å²	80	49.6 Å²	49.6	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-42.4	173.9	-65.4	-55.8	-38.8	0	0	111.9	I169 L172 A234 A235 L236 L240 K241 F242	I169-Q238 HydrophobicContact CG2-CB 4.23Å; I169-Q238 HydrophobicContact CG2-CG 4.04Å; L172-Q238 HydrophobicContact CD1-CB 4.3Å; A234-Q238 WeakPolarHBondContact O-CG 3.3Å; A234-Q238 PolarHBondContact O-N 3.49Å; A235-Q238 PolarHBondContact O-N 2.9Å; L236-Q238 VanDerWaalsContact C-N 3.31Å; L236-Q238 PolarHBondContact O-N 3.24Å; Q238-L240 PolarHBondContact O-N 2.99Å; Q238-K241 PolarHBondContact O-N 3Å; Q238-F242 WeakPolarHBondContact O-CB 3.33Å; Q238-F242 PolarHBondContact O-N 3.39Å
239	L	97.6	Very high	94.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-39.6	176.7	-177.5	59.2	0	0	0	112.2	I184 V187 I191 A235 L236 F242 M243 A256 L260 I263	I184-L239 HydrophobicContact CG1-CD1 4.36Å; I184-L239 HydrophobicContact CG2-CD1 4.03Å; V187-L239 HydrophobicContact CG1-CB 4.18Å; V187-L239 HydrophobicContact CG1-CD2 4.46Å; I191-L239 HydrophobicContact CD1-CD2 4.2Å; A235-L239 PolarHBondContact O-N 3.39Å; A235-L239 VanDerWaalsContact O-N 3.11Å; L236-L239 PolarHBondContact O-N 3.5Å; L236-L239 VanDerWaalsContact O-N 3.14Å; L239-F242 WeakPolarHBondContact O-CB 3.37Å; L239-F242 PolarHBondContact O-N 3.41Å; L239-M243 PolarHBondContact O-N 3.29Å; L239-A256 HydrophobicContact CD1-CB 4.16Å; L239-L260 HydrophobicContact CD2-CD2 3.69Å; L239-L260 HydrophobicContact CD2-CG 4.49Å; L239-L260 HydrophobicContact CG-CD2 4.18Å; L239-I263 HydrophobicContact CD2-CD1 4.02Å
240	L	95.6	Very high	94.4	Very high	42 Å²	42	48.6 Å²	48.6	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-45.1	176.2	-67.8	174.7	0	0	0	111.7	L236 E237 Q238 F242 M243 L260 E273 A277	L236-L240 HydrophobicContact CD1-CD1 4.47Å; L236-L240 HydrophobicContact CD1-CG 4.29Å; L236-L240 HydrophobicContact CG-CD1 4.11Å; L236-L240 HydrophobicContact CG-CG 4.38Å; L236-L240 VanDerWaalsContact O-CG 3.31Å; L236-L240 WeakPolarHBondContact O-CG 3.49Å; L236-L240 PolarHBondContact O-N 3.12Å; E237-L240 PolarHBondContact O-N 3.41Å; Q238-L240 PolarHBondContact O-N 2.99Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 2.83Å; L240-M243 PolarHBondContact O-N 2.92Å; L240-L260 HydrophobicContact CD2-CD1 3.96Å; L240-L260 HydrophobicContact CD2-CD2 4.3Å; L240-E273 HydrophobicContact CD1-CB 4.26Å; L240-A277 HydrophobicContact CD2-CB 3.56Å
241	K	93.8	Very high	94.3	Very high	105 Å²	105	47.4 Å²	47.4	46%	0.457	26%	0.259	S	S	.	.	H	α-helix	trans	-60.9	-39.8	174.2	-75.5	173	-176.6	166.4	0	112	E237 Q238 M243 V244	E237-K241 HydrophobicContact CG-CD 4.42Å; E237-K241 WeakPolarHBondContact O-CB 3.48Å; E237-K241 WeakPolarHBondContact O-CG 3.25Å; E237-K241 PolarHBondContact O-N 3.41Å; E237-K241 WeakPolarHBondContact OE1-CE 3.37Å; E237-K241 IonicContact OE1-NZ 2.72Å; E237-K241 PolarHBondContact OE1-NZ 3.36Å; Q238-K241 PolarHBondContact O-N 3Å; K241-M243 VanDerWaalsContact C-N 3.31Å; K241-M243 PolarHBondContact O-N 2.84Å; K241-V244 WeakPolarHBondContact O-CG2 3.41Å; K241-V244 PolarHBondContact O-N 3.35Å
242	F	94.9	Very high	94.4	Very high	17 Å²	17	45.4 Å²	45.4	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-39.5	177.9	179	-100.7	0	0	0	112.2	L172 R180 I184 Q238 L239 L240 V244 H245 I248 N252	L172-F242 HydrophobicContact CB-CD2 4.2Å; L172-F242 WeakPolarHBondContact O-CE2 3.32Å; R180-F242 HydrophobicContact CB-CZ 4.38Å; I184-F242 HydrophobicContact CD1-CD1 4.29Å; I184-F242 HydrophobicContact CD1-CE1 3.55Å; I184-F242 HydrophobicContact CD1-CZ 4.22Å; I184-F242 HydrophobicContact CG1-CD1 4.4Å; I184-F242 HydrophobicContact CG1-CE1 4.05Å; Q238-F242 WeakPolarHBondContact O-CB 3.33Å; Q238-F242 PolarHBondContact O-N 3.39Å; L239-F242 WeakPolarHBondContact O-CB 3.37Å; L239-F242 PolarHBondContact O-N 3.41Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 2.83Å; F242-V244 VanDerWaalsContact C-N 3.31Å; F242-V244 PolarHBondContact O-N 2.91Å; F242-H245 VanDerWaalsContact O-CB 3.27Å; F242-H245 WeakPolarHBondContact O-CB 3.43Å; F242-H245 PolarHBondContact O-N 3.47Å; F242-I248 HydrophobicContact CD1-CD1 3.79Å; F242-I248 HydrophobicContact CE1-CD1 3.41Å; F242-I248 VanDerWaalsContact CE1-CD1 3.41Å; F242-I248 HydrophobicContact CE1-CG1 4Å; F242-I248 HydrophobicContact CZ-CD1 4Å; F242-I248 HydrophobicContact CZ-CG1 4.09Å; F242-N252 HydrophobicContact CE1-CB 4.02Å; F242-N252 HydrophobicContact CZ-CB 4Å
243	M	93.4	Very high	94.5	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-28.6	-178.9	-76.1	-176.4	60.6	0	0	114.8	L239 L240 K241 H245 L253 A256 L257 L260 L281	L239-M243 PolarHBondContact O-N 3.29Å; L240-M243 PolarHBondContact O-N 2.92Å; K241-M243 VanDerWaalsContact C-N 3.31Å; K241-M243 PolarHBondContact O-N 2.84Å; M243-H245 VanDerWaalsContact C-N 3.32Å; M243-L253 HydrophobicContact CE-CD1 4.34Å; M243-A256 HydrophobicContact CG-CB 3.63Å; M243-A256 HydrophobicContact SD-CB 3.86Å; M243-L257 HydrophobicContact CE-CD2 3.67Å; M243-L257 HydrophobicContact CE-CG 4.25Å; M243-L260 HydrophobicContact CE-CD1 3.96Å; M243-L260 HydrophobicContact SD-CD1 3.26Å; M243-L260 WeakPolarHBondContact SD-CD1 3.14Å; M243-L260 HydrophobicContact SD-CG 3.85Å; M243-L281 HydrophobicContact CE-CD2 4.23Å
244	V	91.1	Very high	94.5	Very high	90 Å²	90	42.5 Å²	42.5	55%	0.545	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	1.6	179.1	-63.1	0	0	0	0	112.8	K241 F242 T280	K241-V244 WeakPolarHBondContact O-CG2 3.41Å; K241-V244 PolarHBondContact O-N 3.35Å; F242-V244 VanDerWaalsContact C-N 3.31Å; F242-V244 PolarHBondContact O-N 2.91Å; V244-T280 HydrophobicContact CG1-CG2 4Å
245	H	90.4	Very high	94.6	Very high	95 Å²	95	41.7 Å²	41.7	44%	0.44	23%	0.229	S	C	.	.			trans	-65.5	128.2	179.4	-170	-90.6	0	0	0	111.1	F242 M243 A247 I248	F242-H245 VanDerWaalsContact O-CB 3.27Å; F242-H245 WeakPolarHBondContact O-CB 3.43Å; F242-H245 PolarHBondContact O-N 3.47Å; M243-H245 VanDerWaalsContact C-N 3.32Å; H245-A247 PolarHBondContact ND1-N 3.33Å; H245-A247 PolarHBondContact O-N 3.3Å; H245-A247 VanDerWaalsContact O-N 3.13Å; H245-I248 WeakPolarHBondContact O-CB 3.43Å; H245-I248 VanDerWaalsContact O-CG2 3.23Å; H245-I248 WeakPolarHBondContact O-CG2 3.48Å; H245-I248 PolarHBondContact O-N 3.4Å; H245-I248 VanDerWaalsContact O-N 3.1Å
246	P	86.8	Confident	94.6	Very high	81 Å²	81	41.6 Å²	41.6	53%	0.526	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.9	-170.9	25.6	-35.3	0	0	0	114.1	T288	P246-T288 WeakPolarHBondContact O-CG2 3.22Å; P246-T288 PolarHBondContact O-OG1 2.91Å
247	A	89.1	Confident	94.6	Very high	65 Å²	65	41.3 Å²	41.3	54%	0.537	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	18.2	178.6	0	0	0	0	0	113.6	H245 S249	H245-A247 PolarHBondContact ND1-N 3.33Å; H245-A247 PolarHBondContact O-N 3.3Å; H245-A247 VanDerWaalsContact O-N 3.13Å; A247-S249 PolarHBondContact O-N 3.08Å
248	I	93.4	Very high	94.6	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	21%	0.211	C	C	.	.			trans	-62.6	135.4	175.1	-169.1	170.5	0	0	0	110.8	F242 H245 N252 L253 P286	F242-I248 HydrophobicContact CD1-CD1 3.79Å; F242-I248 HydrophobicContact CE1-CD1 3.41Å; F242-I248 VanDerWaalsContact CE1-CD1 3.41Å; F242-I248 HydrophobicContact CE1-CG1 4Å; F242-I248 HydrophobicContact CZ-CD1 4Å; F242-I248 HydrophobicContact CZ-CG1 4.09Å; H245-I248 WeakPolarHBondContact O-CB 3.43Å; H245-I248 VanDerWaalsContact O-CG2 3.23Å; H245-I248 WeakPolarHBondContact O-CG2 3.48Å; H245-I248 PolarHBondContact O-N 3.4Å; H245-I248 VanDerWaalsContact O-N 3.1Å; I248-N252 HydrophobicContact CD1-CB 4.37Å; I248-N252 HydrophobicContact CG1-CB 4Å; I248-L253 HydrophobicContact CD1-CB 3.97Å; I248-L253 HydrophobicContact CD1-CD1 4.08Å; I248-L253 HydrophobicContact CG1-CB 4.21Å; I248-L253 HydrophobicContact CG2-CB 4.4Å; I248-P286 HydrophobicContact CG2-CB 4.35Å; I248-P286 HydrophobicContact CG2-CG 3.67Å
249	S	94.6	Very high	94.7	Very high	27 Å²	27	33.4 Å²	33.4	19%	0.189	19%	0.194	C	C	.	.			trans	-75.4	155.9	177.8	78.5	0	0	0	0	111.9	D177 A247 I251 N252 L253	D177-S249 WeakPolarHBondContact OD1-CB 3.23Å; D177-S249 PolarHBondContact OD1-OG 2.84Å; A247-S249 PolarHBondContact O-N 3.08Å; S249-I251 VanDerWaalsContact C-N 3.29Å; S249-I251 PolarHBondContact O-N 3.29Å; S249-I251 WeakPolarHBondContact OG-CG2 3.19Å; S249-N252 PolarHBondContact O-N 3.14Å; S249-N252 WeakPolarHBondContact OG-CB 3.37Å; S249-N252 PolarHBondContact OG-N 3.06Å; S249-N252 PolarHBondContact OG-OD1 3.36Å; S249-L253 WeakPolarHBondContact O-CB 3.38Å; S249-L253 PolarHBondContact O-N 3.05Å
250	S	94.3	Very high	94.7	Very high	18 Å²	18	33.4 Å²	33.4	13%	0.126	19%	0.194	C	C	.	.	H	α-helix	trans	-56.4	-41	178	-178	0	0	0	0	113	T254	S250-T254 WeakPolarHBondContact O-CG2 3.31Å; S250-T254 PolarHBondContact O-N 3.13Å; S250-T254 PolarHBondContact O-OG1 3.41Å; S250-T254 VanDerWaalsContact O-OG1 3.12Å
251	I	94.3	Very high	94.8	Very high	88 Å²	88	31.4 Å²	31.4	45%	0.451	18%	0.183	S	C	.	.	H	α-helix	trans	-73.4	-40.8	-176.9	-170.6	170.8	0	0	0	111.5	D177 S249 L253 T254 T255	D177-I251 WeakPolarHBondContact OD2-CG2 3.48Å; S249-I251 VanDerWaalsContact C-N 3.29Å; S249-I251 PolarHBondContact O-N 3.29Å; S249-I251 WeakPolarHBondContact OG-CG2 3.19Å; I251-L253 VanDerWaalsContact C-N 3.34Å; I251-T254 WeakPolarHBondContact CA-OG1 3.3Å; I251-T254 PolarHBondContact O-N 2.96Å; I251-T254 PolarHBondContact O-OG1 3.45Å; I251-T255 WeakPolarHBondContact O-CB 3.45Å; I251-T255 PolarHBondContact O-N 2.89Å; I251-T255 PolarHBondContact O-OG1 3.45Å
252	N	97.4	Very high	95	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-43.3	175.1	-65.9	168.2	0	0	0	110.5	D177 R180 T181 I184 F242 I248 S249 T255 A256	D177-N252 PolarHBondContact O-ND2 2.93Å; D177-N252 PolarHBondContact OD1-ND2 2.78Å; D177-N252 PolarHBondContact OD1-OD1 2.88Å; R180-N252 WeakPolarHBondContact CB-OD1 3.47Å; R180-N252 PolarHBondContact NE-OD1 2.97Å; R180-N252 PolarHBondContact NH2-OD1 3.43Å; T181-N252 PolarHBondContact OG1-ND2 2.81Å; I184-N252 HydrophobicContact CD1-CB 3.99Å; F242-N252 HydrophobicContact CE1-CB 4.02Å; F242-N252 HydrophobicContact CZ-CB 4Å; I248-N252 HydrophobicContact CD1-CB 4.37Å; I248-N252 HydrophobicContact CG1-CB 4Å; S249-N252 PolarHBondContact O-N 3.14Å; S249-N252 WeakPolarHBondContact OG-CB 3.37Å; S249-N252 PolarHBondContact OG-N 3.06Å; S249-N252 PolarHBondContact OG-OD1 3.36Å; N252-T255 PolarHBondContact O-N 3.1Å; N252-A256 WeakPolarHBondContact O-CB 3.48Å; N252-A256 PolarHBondContact O-N 2.92Å
253	L	96.9	Very high	95.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-47.2	177.8	-177.2	60.7	0	0	0	112	M243 I248 S249 I251 T255 A256 L257 L281 P286 L289 V297	M243-L253 HydrophobicContact CE-CD1 4.34Å; I248-L253 HydrophobicContact CD1-CB 3.97Å; I248-L253 HydrophobicContact CD1-CD1 4.08Å; I248-L253 HydrophobicContact CG1-CB 4.21Å; I248-L253 HydrophobicContact CG2-CB 4.4Å; S249-L253 WeakPolarHBondContact O-CB 3.38Å; S249-L253 PolarHBondContact O-N 3.05Å; I251-L253 VanDerWaalsContact C-N 3.34Å; L253-T255 VanDerWaalsContact C-N 3.28Å; L253-T255 PolarHBondContact O-N 3.18Å; L253-A256 PolarHBondContact O-N 3.45Å; L253-L257 WeakPolarHBondContact O-CG 3.4Å; L253-L257 PolarHBondContact O-N 3Å; L253-L281 HydrophobicContact CD1-CD1 3.8Å; L253-L281 HydrophobicContact CD1-CD2 3.8Å; L253-L281 HydrophobicContact CD1-CG 4.46Å; L253-L281 HydrophobicContact CD2-CD1 4Å; L253-L281 HydrophobicContact CD2-CD2 4.35Å; L253-L281 HydrophobicContact CG-CD1 4.48Å; L253-L281 HydrophobicContact CG-CD2 4.28Å; L253-P286 HydrophobicContact CD2-CG 4.43Å; L253-L289 HydrophobicContact CD2-CD1 3.98Å; L253-V297 HydrophobicContact CD2-CB 4.49Å; L253-V297 HydrophobicContact CD2-CG1 3.71Å; L253-V297 HydrophobicContact CD2-CG2 3.91Å; L253-V297 HydrophobicContact CG-CG1 4.31Å
254	T	96	Very high	95.4	Very high	25 Å²	25	27.3 Å²	27.3	15%	0.153	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-32.6	175.8	53.1	0	0	0	0	112.8	S250 I251 G258 V297 N300	S250-T254 WeakPolarHBondContact O-CG2 3.31Å; S250-T254 PolarHBondContact O-N 3.13Å; S250-T254 PolarHBondContact O-OG1 3.41Å; S250-T254 VanDerWaalsContact O-OG1 3.12Å; I251-T254 WeakPolarHBondContact CA-OG1 3.3Å; I251-T254 PolarHBondContact O-N 2.96Å; I251-T254 PolarHBondContact O-OG1 3.45Å; T254-G258 PolarHBondContact O-N 3.01Å; T254-G258 VanDerWaalsContact O-N 3.11Å; T254-V297 HydrophobicContact CG2-CG2 4.07Å; T254-N300 HydrophobicContact CG2-CB 4.06Å
255	T	98.1	Very high	95.6	Very high	28 Å²	28	25.4 Å²	25.4	17%	0.172	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-45.5	175.9	-56.4	0	0	0	0	110.4	T181 I184 K185 I251 N252 L253 L257 G258 S259	T181-T255 HydrophobicContact CG2-CG2 4.09Å; I184-T255 HydrophobicContact CB-CG2 4.3Å; I184-T255 HydrophobicContact CG2-CG2 3.91Å; K185-T255 HydrophobicContact CD-CG2 3.88Å; K185-T255 HydrophobicContact CG-CG2 4.16Å; I251-T255 WeakPolarHBondContact O-CB 3.45Å; I251-T255 PolarHBondContact O-N 2.89Å; I251-T255 PolarHBondContact O-OG1 3.45Å; N252-T255 PolarHBondContact O-N 3.1Å; L253-T255 VanDerWaalsContact C-N 3.28Å; L253-T255 PolarHBondContact O-N 3.18Å; T255-L257 PolarHBondContact O-N 3.14Å; T255-G258 PolarHBondContact O-N 3.42Å; T255-S259 PolarHBondContact O-N 3.39Å; T255-S259 PolarHBondContact O-OG 2.91Å
256	A	98.1	Very high	95.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.5	-40.7	177	0	0	0	0	0	112.1	I184 L239 M243 N252 L253 G258 S259 L260	I184-A256 HydrophobicContact CD1-CB 4.47Å; I184-A256 HydrophobicContact CG2-CB 4.3Å; L239-A256 HydrophobicContact CD1-CB 4.16Å; M243-A256 HydrophobicContact CG-CB 3.63Å; M243-A256 HydrophobicContact SD-CB 3.86Å; N252-A256 WeakPolarHBondContact O-CB 3.48Å; N252-A256 PolarHBondContact O-N 2.92Å; L253-A256 PolarHBondContact O-N 3.45Å; A256-G258 PolarHBondContact O-N 2.83Å; A256-S259 WeakPolarHBondContact O-CB 3.3Å; A256-S259 PolarHBondContact O-N 3Å; A256-S259 VanDerWaalsContact O-N 3.17Å; A256-L260 PolarHBondContact O-N 3.17Å
257	L	97.4	Very high	96.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-56.8	-47.6	171.4	-73.2	175.2	0	0	0	111.8	M243 L253 T255 S259 L260 A261 Y278 L281 V297 L301	M243-L257 HydrophobicContact CE-CD2 3.67Å; M243-L257 HydrophobicContact CE-CG 4.25Å; L253-L257 WeakPolarHBondContact O-CG 3.4Å; L253-L257 PolarHBondContact O-N 3Å; T255-L257 PolarHBondContact O-N 3.14Å; L257-S259 VanDerWaalsContact C-N 3.31Å; L257-S259 PolarHBondContact O-N 3.22Å; L257-L260 PolarHBondContact O-N 3.02Å; L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.43Å; L257-Y278 HydrophobicContact CD2-CD1 3.56Å; L257-Y278 HydrophobicContact CD2-CE1 3.32Å; L257-Y278 PolarHBondContact O-OH 3.18Å; L257-L281 HydrophobicContact CD1-CD2 4.08Å; L257-L281 HydrophobicContact CD2-CD2 3.69Å; L257-L281 HydrophobicContact CG-CD2 4.17Å; L257-V297 HydrophobicContact CD1-CG1 4.24Å; L257-L301 HydrophobicContact CD1-CB 4.23Å; L257-L301 HydrophobicContact CD2-CD1 3.87Å
258	G	97.7	Very high	96.8	Very high	13 Å²	13	15.3 Å²	15.3	13%	0.134	9%	0.085	C	C	.	.	H	α-helix	trans	-62.4	-38.8	175.6	0	0	0	0	0	113	T254 T255 A256 A261 N262 H304	T254-G258 PolarHBondContact O-N 3.01Å; T254-G258 VanDerWaalsContact O-N 3.11Å; T255-G258 PolarHBondContact O-N 3.42Å; A256-G258 PolarHBondContact O-N 2.83Å; G258-A261 PolarHBondContact O-N 3.43Å; G258-N262 VanDerWaalsContact O-CG 3.26Å; G258-N262 PolarHBondContact O-N 3.35Å; G258-N262 VanDerWaalsContact O-N 3.07Å; G258-N262 PolarHBondContact O-ND2 2.89Å; G258-H304 WeakPolarHBondContact CA-CE1 3.36Å; G258-H304 WeakPolarHBondContact CA-NE2 3.43Å; G258-H304 PolarHBondContact N-NE2 3.33Å
259	S	98.4	Very high	96.8	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-47	177	-69	0	0	0	0	112.7	I184 E188 T255 A256 L257 A261 N262 I263	I184-S259 WeakPolarHBondContact CG2-OG 3.49Å; E188-S259 WeakPolarHBondContact OE2-CA 3.39Å; E188-S259 WeakPolarHBondContact OE2-CB 3.3Å; E188-S259 PolarHBondContact OE2-OG 3Å; T255-S259 PolarHBondContact O-N 3.39Å; T255-S259 PolarHBondContact O-OG 2.91Å; A256-S259 WeakPolarHBondContact O-CB 3.3Å; A256-S259 PolarHBondContact O-N 3Å; A256-S259 VanDerWaalsContact O-N 3.17Å; L257-S259 VanDerWaalsContact C-N 3.31Å; L257-S259 PolarHBondContact O-N 3.22Å; S259-A261 VanDerWaalsContact C-N 3.34Å; S259-A261 PolarHBondContact O-N 3.16Å; S259-N262 WeakPolarHBondContact O-CB 3.47Å; S259-N262 PolarHBondContact O-N 3.3Å; S259-N262 VanDerWaalsContact O-N 3.16Å; S259-I263 WeakPolarHBondContact O-CG1 3.2Å; S259-I263 PolarHBondContact O-N 2.93Å
260	L	98.2	Very high	96.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-39.9	175.1	-71	-165.9	0	0	0	112.1	L236 L239 L240 M243 A256 L257 N262 I263 A264 V274 A277 Y278	L236-L260 HydrophobicContact CD1-CD2 3.96Å; L239-L260 HydrophobicContact CD2-CD2 3.69Å; L239-L260 HydrophobicContact CD2-CG 4.49Å; L239-L260 HydrophobicContact CG-CD2 4.18Å; L240-L260 HydrophobicContact CD2-CD1 3.96Å; L240-L260 HydrophobicContact CD2-CD2 4.3Å; M243-L260 HydrophobicContact CE-CD1 3.96Å; M243-L260 HydrophobicContact SD-CD1 3.26Å; M243-L260 WeakPolarHBondContact SD-CD1 3.14Å; M243-L260 HydrophobicContact SD-CG 3.85Å; A256-L260 PolarHBondContact O-N 3.17Å; L257-L260 PolarHBondContact O-N 3.02Å; L260-N262 VanDerWaalsContact C-N 3.26Å; L260-N262 PolarHBondContact O-N 3.27Å; L260-I263 HydrophobicContact CD2-CD1 4.2Å; L260-I263 PolarHBondContact O-N 3.3Å; L260-A264 WeakPolarHBondContact O-CB 3.49Å; L260-A264 PolarHBondContact O-N 2.92Å; L260-V274 HydrophobicContact CB-CG1 3.89Å; L260-V274 HydrophobicContact CB-CG2 3.99Å; L260-V274 HydrophobicContact CD1-CG2 4.48Å; L260-V274 HydrophobicContact CD2-CG2 4.18Å; L260-V274 HydrophobicContact CG-CG2 4.45Å; L260-A277 HydrophobicContact CD1-CB 3.8Å; L260-Y278 HydrophobicContact CB-CE1 4.09Å; L260-Y278 HydrophobicContact CD1-CE1 4.11Å
261	A	97.7	Very high	97	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63	-33	175.3	0	0	0	0	0	112.8	L257 G258 S259 R265 Y278 H304 V308	L257-A261 WeakPolarHBondContact O-CB 3.32Å; L257-A261 PolarHBondContact O-N 3.43Å; G258-A261 PolarHBondContact O-N 3.43Å; S259-A261 VanDerWaalsContact C-N 3.34Å; S259-A261 PolarHBondContact O-N 3.16Å; A261-R265 WeakPolarHBondContact O-CG 3.49Å; A261-R265 PolarHBondContact O-N 2.79Å; A261-R265 PolarHBondContact O-NE 3.19Å; A261-R265 VanDerWaalsContact O-NE 3.11Å; A261-Y278 WeakPolarHBondContact CA-OH 3.44Å; A261-Y278 WeakPolarHBondContact CB-OH 3.26Å; A261-Y278 PolarHBondContact N-OH 3.2Å; A261-Y278 VanDerWaalsContact N-OH 3.08Å; A261-H304 HydrophobicContact CB-CB 3.92Å; A261-V308 HydrophobicContact CB-CG2 4.2Å
262	N	97.7	Very high	97	Very high	39 Å²	39	14.2 Å²	14.2	21%	0.209	8%	0.08	C	C	.	.	H	α-helix	trans	-73	-43.2	174.2	-70.1	-15.7	0	0	0	111.3	E188 G258 S259 L260 R265 Q266	E188-N262 HydrophobicContact CG-CB 4.5Å; E188-N262 WeakPolarHBondContact OE1-CB 3.45Å; E188-N262 PolarHBondContact OE1-ND2 3.28Å; G258-N262 VanDerWaalsContact O-CG 3.26Å; G258-N262 PolarHBondContact O-N 3.35Å; G258-N262 VanDerWaalsContact O-N 3.07Å; G258-N262 PolarHBondContact O-ND2 2.89Å; S259-N262 WeakPolarHBondContact O-CB 3.47Å; S259-N262 PolarHBondContact O-N 3.3Å; S259-N262 VanDerWaalsContact O-N 3.16Å; L260-N262 VanDerWaalsContact C-N 3.26Å; L260-N262 PolarHBondContact O-N 3.27Å; N262-R265 PolarHBondContact O-N 2.95Å; N262-R265 PolarHBondContact OD1-NH2 3.15Å; N262-Q266 VanDerWaalsContact O-CB 3.3Å; N262-Q266 WeakPolarHBondContact O-CB 3.49Å; N262-Q266 VanDerWaalsContact O-CG 3.31Å; N262-Q266 WeakPolarHBondContact O-CG 3.4Å; N262-Q266 PolarHBondContact O-N 3.01Å
263	I	98.1	Very high	96.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.4	-48.3	176.1	-67.1	159.3	0	0	0	110.1	E188 I191 V192 L236 L239 S259 L260 R265 Q266 R267 F270	E188-I263 HydrophobicContact CG-CD1 4.45Å; E188-I263 HydrophobicContact CG-CG1 4.19Å; I191-I263 HydrophobicContact CB-CD1 4.3Å; I191-I263 HydrophobicContact CD1-CD1 3.66Å; I191-I263 HydrophobicContact CG2-CD1 4.2Å; I191-I263 HydrophobicContact CG2-CG1 4.23Å; I191-I263 HydrophobicContact CG2-CG2 3.9Å; V192-I263 HydrophobicContact CG2-CG1 4.31Å; L236-I263 HydrophobicContact CD1-CD1 4.48Å; L239-I263 HydrophobicContact CD2-CD1 4.02Å; S259-I263 WeakPolarHBondContact O-CG1 3.2Å; S259-I263 PolarHBondContact O-N 2.93Å; L260-I263 HydrophobicContact CD2-CD1 4.2Å; L260-I263 PolarHBondContact O-N 3.3Å; I263-R265 VanDerWaalsContact C-N 3.34Å; I263-R265 PolarHBondContact O-N 3.12Å; I263-Q266 PolarHBondContact O-N 3.06Å; I263-R267 CarbonylContact O-C 3.4Å; I263-R267 VanDerWaalsContact O-CA 3.29Å; I263-R267 WeakPolarHBondContact O-CA 3.31Å; I263-R267 WeakPolarHBondContact O-CB 3.14Å; I263-R267 PolarHBondContact O-N 3.44Å; I263-F270 HydrophobicContact CG2-CB 4.19Å; I263-F270 HydrophobicContact CG2-CD2 3.89Å; I263-F270 HydrophobicContact CG2-CG 4.45Å
264	A	97.1	Very high	96.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.3	-41.5	179.8	0	0	0	0	0	113.4	L260 R267 P268 M271 V274 V308	L260-A264 WeakPolarHBondContact O-CB 3.49Å; L260-A264 PolarHBondContact O-N 2.92Å; A264-R267 CarbonylContact O-C 3.32Å; A264-P268 VanDerWaalsContact O-CA 3.27Å; A264-P268 WeakPolarHBondContact O-CA 3.23Å; A264-M271 HydrophobicContact CB-CE 4.2Å; A264-M271 HydrophobicContact CB-SD 3.8Å; A264-M271 WeakPolarHBondContact O-CE 3.3Å; A264-V274 HydrophobicContact CB-CB 4.11Å; A264-V274 HydrophobicContact CB-CG1 3.98Å; A264-V274 HydrophobicContact CB-CG2 4.08Å; A264-V308 HydrophobicContact CB-CG2 4.35Å
265	R	96.7	Very high	96.7	Very high	50 Å²	50	15.8 Å²	15.8	19%	0.189	9%	0.086	C	C	.	.	H	α-helix	trans	-76.5	-38.8	179.4	-67.9	-177.7	-65.5	146.6	-3	112.7	E202 A261 N262 I263 H311	E202-R265 HydrophobicContact CB-CB 4.48Å; E202-R265 PolarHBondContact N-O 3.1Å; E202-R265 IonicContact OE1-NH1 2.81Å; E202-R265 IonicContact OE2-NH1 3.39Å; A261-R265 WeakPolarHBondContact O-CG 3.49Å; A261-R265 PolarHBondContact O-N 2.79Å; A261-R265 PolarHBondContact O-NE 3.19Å; A261-R265 VanDerWaalsContact O-NE 3.11Å; N262-R265 PolarHBondContact O-N 2.95Å; N262-R265 PolarHBondContact OD1-NH2 3.15Å; I263-R265 VanDerWaalsContact C-N 3.34Å; I263-R265 PolarHBondContact O-N 3.12Å; R265-H311 HydrophobicContact CG-CB 4.36Å; R265-H311 PolarHBondContact O-NE2 3.39Å
266	Q	97.1	Very high	96.5	Very high	12 Å²	12	18.8 Å²	18.8	6%	0.056	10%	0.098	C	C	.	.	H	α-helix	trans	-79	-28.3	179.2	-68.2	-172.2	52.6	0	0	112.3	V192 S201 E202 I203 N262 I263	V192-Q266 HydrophobicContact CG2-CB 4.39Å; S201-Q266 WeakPolarHBondContact CB-O 3.3Å; S201-Q266 PolarHBondContact OG-O 3.08Å; E202-Q266 WeakPolarHBondContact O-CG 3.46Å; I203-Q266 HydrophobicContact CD1-CB 3.76Å; I203-Q266 HydrophobicContact CD1-CG 3.9Å; N262-Q266 VanDerWaalsContact O-CB 3.3Å; N262-Q266 WeakPolarHBondContact O-CB 3.49Å; N262-Q266 VanDerWaalsContact O-CG 3.31Å; N262-Q266 WeakPolarHBondContact O-CG 3.4Å; N262-Q266 PolarHBondContact O-N 3.01Å; I263-Q266 PolarHBondContact O-N 3.06Å
267	R	97.5	Very high	96.3	Very high	6 Å²	6	19.6 Å²	19.6	2%	0.023	10%	0.104	C	C	.	.			trans	-135.8	77.4	-176.3	-59.8	-67.6	-178.6	-79.7	-0.1	109.7	V192 S195 P196 I203 I263 A264 M269 F270	V192-R267 PolarHBondContact O-NE 3.34Å; V192-R267 VanDerWaalsContact O-NE 3.16Å; V192-R267 PolarHBondContact O-NH2 3.34Å; S195-R267 PolarHBondContact O-NE 3.32Å; S195-R267 WeakPolarHBondContact OG-CD 3.5Å; S195-R267 WeakPolarHBondContact OG-CG 3.36Å; S195-R267 PolarHBondContact OG-NE 2.96Å; P196-R267 WeakPolarHBondContact O-CD 3.32Å; P196-R267 PolarHBondContact O-NE 3.04Å; I203-R267 VanDerWaalsContact CD1-NH1 3.33Å; I263-R267 CarbonylContact O-C 3.4Å; I263-R267 VanDerWaalsContact O-CA 3.29Å; I263-R267 WeakPolarHBondContact O-CA 3.31Å; I263-R267 WeakPolarHBondContact O-CB 3.14Å; I263-R267 PolarHBondContact O-N 3.44Å; A264-R267 CarbonylContact O-C 3.32Å; R267-M269 HydrophobicContact CB-CE 3.98Å; R267-M269 HydrophobicContact CB-SD 4.32Å; R267-M269 PolarHBondContact O-N 3.31Å; R267-F270 HydrophobicContact CB-CD2 3.81Å; R267-F270 HydrophobicContact CB-CE2 4.28Å; R267-F270 PolarHBondContact O-N 2.9Å
268	P	95.6	Very high	96.2	Very high	11 Å²	11	19.6 Å²	19.6	7%	0.071	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-62.5	-14.5	-174.5	-22.6	33.5	0	0	0	115.3	M198 D200 A264 F270 M271 H311 A313	M198-P268 HydrophobicContact CE-CB 3.57Å; M198-P268 HydrophobicContact CE-CG 4.02Å; D200-P268 WeakPolarHBondContact OD2-CB 3.46Å; A264-P268 VanDerWaalsContact O-CA 3.27Å; A264-P268 WeakPolarHBondContact O-CA 3.23Å; P268-F270 PolarHBondContact O-N 3.38Å; P268-M271 HydrophobicContact CB-CE 4.39Å; P268-M271 WeakPolarHBondContact O-CB 3.1Å; P268-M271 PolarHBondContact O-N 3.18Å; P268-H311 WeakPolarHBondContact CG-CE1 3.43Å; P268-A313 HydrophobicContact CB-CB 3.58Å; P268-A313 HydrophobicContact CG-CB 4.29Å
269	M	94.8	Very high	95.9	Very high	49 Å²	49	20.1 Å²	20.1	24%	0.241	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-59.6	-24.9	171.1	64	-131.6	63.1	0	0	113.5	P196 M198 R267	P196-M269 HydrophobicContact CG-SD 4.17Å; P196-M269 WeakPolarHBondContact O-CE 3.32Å; M198-M269 HydrophobicContact CB-CE 4.35Å; M198-M269 HydrophobicContact CE-CB 4.15Å; M198-M269 HydrophobicContact CE-CE 3.54Å; M198-M269 VanDerWaalsContact CE-N 3.25Å; M198-M269 HydrophobicContact CG-CE 3.45Å; M198-M269 VanDerWaalsContact CG-CE 3.45Å; M198-M269 HydrophobicContact SD-CB 4.24Å; M198-M269 HydrophobicContact SD-CE 3.58Å; M198-M269 VanDerWaalsContact SD-CE 3.58Å; R267-M269 HydrophobicContact CB-CE 3.98Å; R267-M269 HydrophobicContact CB-SD 4.32Å; R267-M269 PolarHBondContact O-N 3.31Å
270	F	96.9	Very high	95.5	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.026	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-96.6	10.5	177.8	-59.5	-53.5	0	0	0	112.8	I191 W229 K233 L236 I263 R267 P268 S272 E273 V274	I191-F270 HydrophobicContact CG2-CD2 4.36Å; I191-F270 HydrophobicContact CG2-CE2 4.06Å; W229-F270 HydrophobicContact CH2-CZ 4.23Å; W229-F270 HydrophobicContact CZ3-CZ 4.26Å; K233-F270 HydrophobicContact CG-CE1 4.38Å; K233-F270 HydrophobicContact CG-CZ 4.45Å; L236-F270 HydrophobicContact CD2-CB 4.04Å; L236-F270 HydrophobicContact CD2-CD1 3.46Å; L236-F270 VanDerWaalsContact CD2-CD1 3.46Å; L236-F270 HydrophobicContact CD2-CD2 4.27Å; L236-F270 HydrophobicContact CD2-CE1 3.9Å; L236-F270 HydrophobicContact CD2-CG 3.68Å; L236-F270 HydrophobicContact CD2-CZ 4.47Å; I263-F270 HydrophobicContact CG2-CB 4.19Å; I263-F270 HydrophobicContact CG2-CD2 3.89Å; I263-F270 HydrophobicContact CG2-CG 4.45Å; R267-F270 HydrophobicContact CB-CD2 3.81Å; R267-F270 HydrophobicContact CB-CE2 4.28Å; R267-F270 PolarHBondContact O-N 2.9Å; P268-F270 PolarHBondContact O-N 3.38Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.47Å; F270-E273 VanDerWaalsContact CA-OE2 3.3Å; F270-E273 WeakPolarHBondContact CA-OE2 3.47Å; F270-E273 PolarHBondContact O-N 3.48Å; F270-V274 WeakPolarHBondContact O-CG2 3.5Å; F270-V274 PolarHBondContact O-N 3.24Å; F270-V274 VanDerWaalsContact O-N 3.1Å
271	M	95.1	Very high	95.1	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-59.1	-43.1	-178.1	-170.9	72.1	68.8	0	0	111	A264 P268 E273 V274 I275 V308 H311 A313 F317	A264-M271 HydrophobicContact CB-CE 4.2Å; A264-M271 HydrophobicContact CB-SD 3.8Å; A264-M271 WeakPolarHBondContact O-CE 3.3Å; P268-M271 HydrophobicContact CB-CE 4.39Å; P268-M271 WeakPolarHBondContact O-CB 3.1Å; P268-M271 PolarHBondContact O-N 3.18Å; M271-E273 PolarHBondContact O-N 3.34Å; M271-V274 PolarHBondContact O-N 3.47Å; M271-I275 HydrophobicContact CG-CG1 4.41Å; M271-I275 WeakPolarHBondContact O-CG1 3.25Å; M271-I275 PolarHBondContact O-N 3.44Å; M271-V308 HydrophobicContact CE-CG1 4.24Å; M271-V308 HydrophobicContact SD-CG1 3.36Å; M271-V308 WeakPolarHBondContact SD-CG1 3.22Å; M271-H311 HydrophobicContact CE-CB 4.49Å; M271-A313 HydrophobicContact CE-CB 4.1Å; M271-F317 HydrophobicContact CB-CD2 4.23Å; M271-F317 HydrophobicContact CB-CE2 3.83Å; M271-F317 HydrophobicContact CG-CD2 3.49Å; M271-F317 VanDerWaalsContact CG-CD2 3.49Å; M271-F317 HydrophobicContact CG-CE2 3.62Å; M271-F317 HydrophobicContact CG-CG 4.43Å
272	S	93.8	Very high	94.7	Very high	58 Å²	58	23.5 Å²	23.5	41%	0.406	12%	0.122	S	C	.	.	H	α-helix	trans	-59	-50.2	-179.4	-176.5	0	0	0	0	111.7	F270 V274 I275 Q276	F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.47Å; S272-V274 VanDerWaalsContact C-N 3.32Å; S272-V274 PolarHBondContact O-N 3.47Å; S272-I275 PolarHBondContact O-N 3.25Å; S272-Q276 WeakPolarHBondContact O-CB 3.43Å; S272-Q276 PolarHBondContact O-N 3.1Å
273	E	95.1	Very high	94.2	Very high	59 Å²	59	23.4 Å²	23.4	28%	0.276	13%	0.127	S	C	.	.	H	α-helix	trans	-63.6	-37.5	179.9	-63.8	92.1	145.9	0	0	111.8	L240 F270 M271 A277	L240-E273 HydrophobicContact CD1-CB 4.26Å; F270-E273 VanDerWaalsContact CA-OE2 3.3Å; F270-E273 WeakPolarHBondContact CA-OE2 3.47Å; F270-E273 PolarHBondContact O-N 3.48Å; M271-E273 PolarHBondContact O-N 3.34Å; E273-A277 WeakPolarHBondContact O-CB 3.3Å; E273-A277 PolarHBondContact O-N 3.11Å
274	V	96.4	Very high	93.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.9	-44.7	177	169.8	0	0	0	0	111.9	L260 A264 F270 M271 S272 Q276 A277 Y278	L260-V274 HydrophobicContact CB-CG1 3.89Å; L260-V274 HydrophobicContact CB-CG2 3.99Å; L260-V274 HydrophobicContact CD1-CG2 4.48Å; L260-V274 HydrophobicContact CD2-CG2 4.18Å; L260-V274 HydrophobicContact CG-CG2 4.45Å; A264-V274 HydrophobicContact CB-CB 4.11Å; A264-V274 HydrophobicContact CB-CG1 3.98Å; A264-V274 HydrophobicContact CB-CG2 4.08Å; F270-V274 WeakPolarHBondContact O-CG2 3.5Å; F270-V274 PolarHBondContact O-N 3.24Å; F270-V274 VanDerWaalsContact O-N 3.1Å; M271-V274 PolarHBondContact O-N 3.47Å; S272-V274 VanDerWaalsContact C-N 3.32Å; S272-V274 PolarHBondContact O-N 3.47Å; V274-Q276 VanDerWaalsContact C-N 3.34Å; V274-A277 WeakPolarHBondContact O-CB 3.49Å; V274-A277 PolarHBondContact O-N 3.29Å; V274-Y278 HydrophobicContact CG1-CD2 4.32Å; V274-Y278 HydrophobicContact CG1-CE1 4.17Å; V274-Y278 HydrophobicContact CG1-CE2 3.81Å; V274-Y278 PolarHBondContact O-N 3.12Å
275	I	94.2	Very high	93.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-42.2	177.4	-63.5	-47.6	0	0	0	110.6	M271 S272 A277 Y278 E279 L305 V308 F317 Q320 I321	M271-I275 HydrophobicContact CG-CG1 4.41Å; M271-I275 WeakPolarHBondContact O-CG1 3.25Å; M271-I275 PolarHBondContact O-N 3.44Å; S272-I275 PolarHBondContact O-N 3.25Å; I275-A277 VanDerWaalsContact C-N 3.3Å; I275-A277 PolarHBondContact O-N 3.29Å; I275-Y278 HydrophobicContact CD1-CD2 4.37Å; I275-Y278 WeakPolarHBondContact O-CB 3.36Å; I275-Y278 PolarHBondContact O-N 2.62Å; I275-Y278 VanDerWaalsContact O-N 3.12Å; I275-E279 PolarHBondContact O-N 3.05Å; I275-L305 HydrophobicContact CD1-CD2 4.41Å; I275-V308 HydrophobicContact CD1-CG1 4.05Å; I275-F317 HydrophobicContact CG1-CB 4.25Å; I275-F317 HydrophobicContact CG1-CG 4.41Å; I275-Q320 HydrophobicContact CG2-CB 4.17Å; I275-I321 HydrophobicContact CD1-CD1 3.76Å; I275-I321 HydrophobicContact CD1-CG1 3.66Å; I275-I321 HydrophobicContact CG1-CD1 4.21Å; I275-I321 HydrophobicContact CG1-CG1 4.17Å; I275-I321 HydrophobicContact CG2-CG1 4.43Å
276	Q	92.7	Very high	92.6	Very high	91 Å²	91	27.6 Å²	27.6	43%	0.425	15%	0.153	S	C	.	.	H	α-helix	trans	-60.1	-39.2	175	-172.4	177.3	21.5	0	0	112.3	S272 V274 Y278 E279 T280	S272-Q276 WeakPolarHBondContact O-CB 3.43Å; S272-Q276 PolarHBondContact O-N 3.1Å; V274-Q276 VanDerWaalsContact C-N 3.34Å; Q276-Y278 VanDerWaalsContact C-N 3.34Å; Q276-E279 PolarHBondContact O-N 3.14Å; Q276-T280 WeakPolarHBondContact O-CB 3.4Å; Q276-T280 PolarHBondContact O-N 3.22Å; Q276-T280 PolarHBondContact O-OG1 3.49Å
277	A	93.7	Very high	91.9	Very high	16 Å²	16	32.7 Å²	32.7	13%	0.132	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.1	0	0	0	0	0	112	L240 L260 E273 V274 I275 T280 L281	L240-A277 HydrophobicContact CD2-CB 3.56Å; L260-A277 HydrophobicContact CD1-CB 3.8Å; E273-A277 WeakPolarHBondContact O-CB 3.3Å; E273-A277 PolarHBondContact O-N 3.11Å; V274-A277 WeakPolarHBondContact O-CB 3.49Å; V274-A277 PolarHBondContact O-N 3.29Å; I275-A277 VanDerWaalsContact C-N 3.3Å; I275-A277 PolarHBondContact O-N 3.29Å; A277-T280 PolarHBondContact O-N 3.33Å; A277-L281 WeakPolarHBondContact O-CB 3.47Å; A277-L281 PolarHBondContact O-N 2.87Å
278	Y	95.8	Very high	91.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68	-40.6	176.8	-70	-6.4	0	0	0	112.6	L257 L260 A261 V274 I275 Q276 L281 H282 L301 L305	L257-Y278 HydrophobicContact CD2-CD1 3.56Å; L257-Y278 HydrophobicContact CD2-CE1 3.32Å; L257-Y278 PolarHBondContact O-OH 3.18Å; L260-Y278 HydrophobicContact CB-CE1 4.09Å; L260-Y278 HydrophobicContact CD1-CE1 4.11Å; A261-Y278 WeakPolarHBondContact CA-OH 3.44Å; A261-Y278 WeakPolarHBondContact CB-OH 3.26Å; A261-Y278 PolarHBondContact N-OH 3.2Å; A261-Y278 VanDerWaalsContact N-OH 3.08Å; V274-Y278 HydrophobicContact CG1-CD2 4.32Å; V274-Y278 HydrophobicContact CG1-CE1 4.17Å; V274-Y278 HydrophobicContact CG1-CE2 3.81Å; V274-Y278 PolarHBondContact O-N 3.12Å; I275-Y278 HydrophobicContact CD1-CD2 4.37Å; I275-Y278 WeakPolarHBondContact O-CB 3.36Å; I275-Y278 PolarHBondContact O-N 2.62Å; I275-Y278 VanDerWaalsContact O-N 3.12Å; Q276-Y278 VanDerWaalsContact C-N 3.34Å; Y278-L281 PolarHBondContact O-N 3.44Å; Y278-H282 WeakPolarHBondContact O-CB 3.27Å; Y278-H282 PolarHBondContact O-N 3.08Å; Y278-L301 HydrophobicContact CD1-CD1 3.89Å; Y278-L301 HydrophobicContact CD2-CD1 4.12Å; Y278-L301 HydrophobicContact CE1-CD1 4.48Å; Y278-L301 HydrophobicContact CG-CD1 3.69Å; Y278-L305 HydrophobicContact CD2-CD2 3.65Å; Y278-L305 HydrophobicContact CD2-CG 4.01Å; Y278-L305 HydrophobicContact CE2-CD2 4.39Å
279	E	91.8	Very high	90.8	Very high	25 Å²	25	36.8 Å²	36.8	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-47.9	172.3	-72	-177.3	155.9	0	0	110.9	I275 Q276 L281 H282 A283 Q320 L324	I275-E279 PolarHBondContact O-N 3.05Å; Q276-E279 PolarHBondContact O-N 3.14Å; E279-L281 PolarHBondContact O-N 2.8Å; E279-H282 PolarHBondContact O-N 2.91Å; E279-A283 PolarHBondContact O-N 3.45Å; E279-Q320 WeakPolarHBondContact OE1-CG 3.42Å; E279-L324 HydrophobicContact CG-CD1 3.67Å; E279-L324 HydrophobicContact CG-CD2 4.18Å; E279-L324 HydrophobicContact CG-CG 4.17Å
280	T	89.6	Confident	90.3	Very high	34 Å²	34	36.7 Å²	36.7	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-44.8	179.8	-56.9	0	0	0	0	111.4	V244 Q276 A277 A283 N284	V244-T280 HydrophobicContact CG1-CG2 4Å; Q276-T280 WeakPolarHBondContact O-CB 3.4Å; Q276-T280 PolarHBondContact O-N 3.22Å; Q276-T280 PolarHBondContact O-OG1 3.49Å; A277-T280 PolarHBondContact O-N 3.33Å; T280-A283 PolarHBondContact O-N 2.89Å; T280-N284 WeakPolarHBondContact O-CB 3.36Å; T280-N284 PolarHBondContact O-N 3.1Å
281	L	90.6	Very high	89.6	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.037	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-40.2	177.5	-178.8	67.1	0	0	0	112	M243 L253 L257 A277 Y278 E279 A283 N284 L285 V297	M243-L281 HydrophobicContact CE-CD2 4.23Å; L253-L281 HydrophobicContact CD1-CD1 3.8Å; L253-L281 HydrophobicContact CD1-CD2 3.8Å; L253-L281 HydrophobicContact CD1-CG 4.46Å; L253-L281 HydrophobicContact CD2-CD1 4Å; L253-L281 HydrophobicContact CD2-CD2 4.35Å; L253-L281 HydrophobicContact CG-CD1 4.48Å; L253-L281 HydrophobicContact CG-CD2 4.28Å; L257-L281 HydrophobicContact CD1-CD2 4.08Å; L257-L281 HydrophobicContact CD2-CD2 3.69Å; L257-L281 HydrophobicContact CG-CD2 4.17Å; A277-L281 WeakPolarHBondContact O-CB 3.47Å; A277-L281 PolarHBondContact O-N 2.87Å; Y278-L281 PolarHBondContact O-N 3.44Å; E279-L281 PolarHBondContact O-N 2.8Å; L281-A283 VanDerWaalsContact C-N 3.33Å; L281-N284 CarbonylContact O-C 3.4Å; L281-N284 VanDerWaalsContact O-C 3.32Å; L281-N284 PolarHBondContact O-N 3.32Å; L281-L285 WeakPolarHBondContact O-CD1 3.47Å; L281-L285 PolarHBondContact O-N 2.66Å; L281-V297 HydrophobicContact CD2-CG1 4.47Å
282	H	88.8	Confident	89.1	Confident	30 Å²	30	48.1 Å²	48.1	14%	0.139	28%	0.28	C	S	.	.	H	α-helix	trans	-64.8	-38.4	178.7	-178.1	-110.4	0	0	0	112	Y278 E279 L285 R298 L301 L324 D327	Y278-H282 WeakPolarHBondContact O-CB 3.27Å; Y278-H282 PolarHBondContact O-N 3.08Å; E279-H282 PolarHBondContact O-N 2.91Å; H282-L285 WeakPolarHBondContact O-CD1 3.25Å; H282-R298 PolarHBondContact NE2-NH2 3.21Å; H282-L301 HydrophobicContact CB-CD2 4.19Å; H282-L324 HydrophobicContact CB-CD2 4.17Å; H282-D327 IonicContact CE1-OD2 3.34Å
283	A	87	Confident	88.9	Confident	37 Å²	37	48.8 Å²	48.8	31%	0.306	28%	0.277	S	S	.	.	H	α-helix	trans	-73.4	-34.2	176	0	0	0	0	0	112.7	E279 T280 L281 L452	E279-A283 PolarHBondContact O-N 3.45Å; T280-A283 PolarHBondContact O-N 2.89Å; L281-A283 VanDerWaalsContact C-N 3.33Å; A283-L452 HydrophobicContact CB-CD2 4.42Å
284	N	86.3	Confident	88.7	Confident	75 Å²	75	47.9 Å²	47.9	40%	0.401	28%	0.275	S	S	.	.	S	Bend	trans	-127.8	67.3	-171.8	-55.7	-47.2	0	0	0	111.4	T280 L281 Q456	T280-N284 WeakPolarHBondContact O-CB 3.36Å; T280-N284 PolarHBondContact O-N 3.1Å; L281-N284 CarbonylContact O-C 3.4Å; L281-N284 VanDerWaalsContact O-C 3.32Å; L281-N284 PolarHBondContact O-N 3.32Å; N284-Q456 PolarHBondContact ND2-NE2 3.14Å; N284-Q456 VanDerWaalsContact ND2-NE2 3.15Å; N284-Q456 PolarHBondContact OD1-NE2 3.02Å
285	L	87.2	Confident	88.3	Confident	52 Å²	52	51.7 Å²	51.7	27%	0.272	30%	0.302	S	S	.	.			trans	-66.2	136.9	174.4	-83.1	85.8	0	0	0	110.4	L281 H282 V294	L281-L285 WeakPolarHBondContact O-CD1 3.47Å; L281-L285 PolarHBondContact O-N 2.66Å; H282-L285 WeakPolarHBondContact O-CD1 3.25Å; L285-V294 HydrophobicContact CD2-CG1 3.76Å
286	P	85.7	Confident	88.2	Confident	10 Å²	10	54.2 Å²	54.2	7%	0.065	32%	0.319	C	S	.	.			trans	-57.9	127.8	178.9	-24.4	32	0	0	0	112	I248 L253 T288 L289	I248-P286 HydrophobicContact CG2-CB 4.35Å; I248-P286 HydrophobicContact CG2-CG 3.67Å; L253-P286 HydrophobicContact CD2-CG 4.43Å; P286-T288 PolarHBondContact O-N 3.35Å; P286-L289 HydrophobicContact CB-CD1 4.24Å; P286-L289 HydrophobicContact CB-CG 4.2Å; P286-L289 HydrophobicContact CG-CD1 4.24Å; P286-L289 PolarHBondContact O-N 3.4Å
287	P	82.3	Confident	88.3	Confident	119 Å²	119	50 Å²	50	77%	0.773	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-12.9	-175.5	29.7	-36.1	0	0	0	113	L289	P287-L289 VanDerWaalsContact C-N 3.26Å; P287-L289 PolarHBondContact O-N 3.34Å
288	T	84.9	Confident	88.2	Confident	88 Å²	88	52.7 Å²	52.7	54%	0.54	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.8	178.6	52.7	0	0	0	0	113.2	P246 P286	P246-T288 WeakPolarHBondContact O-CG2 3.22Å; P246-T288 PolarHBondContact O-OG1 2.91Å; P286-T288 PolarHBondContact O-N 3.35Å
289	L	85.1	Confident	88.2	Confident	16 Å²	16	60.1 Å²	60.1	8%	0.084	34%	0.339	C	S	.	.	S	Bend	trans	-78.9	131.3	-179.4	-62.7	175.8	0	0	0	111.7	L253 P286 P287 Q293 V294 V297	L253-L289 HydrophobicContact CD2-CD1 3.98Å; P286-L289 HydrophobicContact CB-CD1 4.24Å; P286-L289 HydrophobicContact CB-CG 4.2Å; P286-L289 HydrophobicContact CG-CD1 4.24Å; P286-L289 PolarHBondContact O-N 3.4Å; P287-L289 VanDerWaalsContact C-N 3.26Å; P287-L289 PolarHBondContact O-N 3.34Å; L289-Q293 HydrophobicContact CB-CB 4.24Å; L289-Q293 HydrophobicContact CD2-CB 4.37Å; L289-V294 HydrophobicContact CB-CG2 3.87Å; L289-V297 HydrophobicContact CD1-CG2 4.23Å
290	A	83.2	Confident	88.3	Confident	47 Å²	47	61.2 Å²	61.2	39%	0.388	35%	0.345	S	S	.	.			trans	-65.8	156.9	172.6	0	0	0	0	0	111.5	S292 Q293 V294	A290-S292 VanDerWaalsContact C-N 3.26Å; A290-S292 PolarHBondContact O-N 2.89Å; A290-S292 VanDerWaalsContact O-N 3.15Å; A290-Q293 HydrophobicContact CB-CG 4.27Å; A290-Q293 WeakPolarHBondContact O-CA 3.46Å; A290-Q293 WeakPolarHBondContact O-CB 3.46Å; A290-Q293 PolarHBondContact O-N 2.58Å; A290-V294 PolarHBondContact O-N 2.93Å
291	K	81.7	Confident	88.6	Confident	156 Å²	156	59.8 Å²	59.8	68%	0.678	34%	0.336	S	S	*	.	H	α-helix	trans	-51.4	-42.8	-179.9	-67.1	-174.7	177.7	-175.7	0	113.4	Q293 V294 S295	K291-Q293 VanDerWaalsContact C-N 3.32Å; K291-Q293 PolarHBondContact O-N 2.87Å; K291-V294 PolarHBondContact O-N 3.22Å; K291-S295 PolarHBondContact O-N 3.39Å; K291-S295 PolarHBondContact O-OG 2.93Å
292	S	86	Confident	88.8	Confident	91 Å²	91	61.6 Å²	61.6	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-65	-35.2	177	54.6	0	0	0	0	112.7	A290 S296	A290-S292 VanDerWaalsContact C-N 3.26Å; A290-S292 PolarHBondContact O-N 2.89Å; A290-S292 VanDerWaalsContact O-N 3.15Å; S292-S296 PolarHBondContact O-N 3.21Å; S292-S296 VanDerWaalsContact O-N 3.16Å
293	Q	89	Confident	89.2	Confident	72 Å²	72	64.8 Å²	64.8	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-72	-41.1	177.1	-66	173.3	-26.6	0	0	111.3	L289 A290 K291 S295 S296 V297	L289-Q293 HydrophobicContact CB-CB 4.24Å; L289-Q293 HydrophobicContact CD2-CB 4.37Å; A290-Q293 HydrophobicContact CB-CG 4.27Å; A290-Q293 WeakPolarHBondContact O-CA 3.46Å; A290-Q293 WeakPolarHBondContact O-CB 3.46Å; A290-Q293 PolarHBondContact O-N 2.58Å; K291-Q293 VanDerWaalsContact C-N 3.32Å; K291-Q293 PolarHBondContact O-N 2.87Å; Q293-S295 VanDerWaalsContact C-N 3.34Å; Q293-S295 PolarHBondContact O-N 3.43Å; Q293-S296 WeakPolarHBondContact O-CB 3.43Å; Q293-S296 PolarHBondContact O-N 2.96Å; Q293-S296 VanDerWaalsContact O-N 3.1Å; Q293-V297 WeakPolarHBondContact O-CG2 3.38Å; Q293-V297 PolarHBondContact O-N 3.39Å
294	V	90.2	Very high	89.7	Confident	39 Å²	39	64.2 Å²	64.2	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-56	-49.1	174.1	170.6	0	0	0	0	110.8	L285 L289 A290 K291 S296 V297 R298	L285-V294 HydrophobicContact CD2-CG1 3.76Å; L289-V294 HydrophobicContact CB-CG2 3.87Å; A290-V294 PolarHBondContact O-N 2.93Å; K291-V294 PolarHBondContact O-N 3.22Å; V294-S296 VanDerWaalsContact C-N 3.3Å; V294-S296 PolarHBondContact O-N 2.81Å; V294-V297 PolarHBondContact O-N 2.76Å; V294-R298 WeakPolarHBondContact O-CB 3.44Å; V294-R298 PolarHBondContact O-N 3.15Å
295	S	89.1	Confident	90.1	Very high	81 Å²	81	60.7 Å²	60.7	57%	0.566	33%	0.334	S	S	*	.	H	α-helix	trans	-60.1	-39	176	-61.9	0	0	0	0	112.7	K291 Q293 K299	K291-S295 PolarHBondContact O-N 3.39Å; K291-S295 PolarHBondContact O-OG 2.93Å; Q293-S295 VanDerWaalsContact C-N 3.34Å; Q293-S295 PolarHBondContact O-N 3.43Å; S295-K299 WeakPolarHBondContact O-CB 3.37Å; S295-K299 PolarHBondContact O-N 2.99Å
296	S	92.6	Very high	90.5	Very high	52 Å²	52	58.8 Å²	58.8	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-46	176	-173.9	0	0	0	0	112.2	S292 Q293 V294 K299 N300	S292-S296 PolarHBondContact O-N 3.21Å; S292-S296 VanDerWaalsContact O-N 3.16Å; Q293-S296 WeakPolarHBondContact O-CB 3.43Å; Q293-S296 PolarHBondContact O-N 2.96Å; Q293-S296 VanDerWaalsContact O-N 3.1Å; V294-S296 VanDerWaalsContact C-N 3.3Å; V294-S296 PolarHBondContact O-N 2.81Å; S296-K299 PolarHBondContact O-N 3.37Å; S296-N300 PolarHBondContact O-N 3.47Å; S296-N300 PolarHBondContact O-ND2 3.16Å
297	V	93.6	Very high	91	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-46.2	177.5	170.8	0	0	0	0	110.3	L253 T254 L257 L281 L289 Q293 V294 K299 N300 L301	L253-V297 HydrophobicContact CD2-CB 4.49Å; L253-V297 HydrophobicContact CD2-CG1 3.71Å; L253-V297 HydrophobicContact CD2-CG2 3.91Å; L253-V297 HydrophobicContact CG-CG1 4.31Å; T254-V297 HydrophobicContact CG2-CG2 4.07Å; L257-V297 HydrophobicContact CD1-CG1 4.24Å; L281-V297 HydrophobicContact CD2-CG1 4.47Å; L289-V297 HydrophobicContact CD1-CG2 4.23Å; Q293-V297 WeakPolarHBondContact O-CG2 3.38Å; Q293-V297 PolarHBondContact O-N 3.39Å; V294-V297 PolarHBondContact O-N 2.76Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.36Å; V297-N300 PolarHBondContact O-N 2.88Å; V297-N300 VanDerWaalsContact O-N 3.16Å; V297-L301 WeakPolarHBondContact O-CB 3.21Å; V297-L301 PolarHBondContact O-N 3.11Å
298	R	92.8	Very high	91.6	Very high	74 Å²	74	54 Å²	54	28%	0.279	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-42	178.3	-155.6	172.7	-136.7	-140.7	-3.1	112	H282 V294 L301 K302 L328	H282-R298 PolarHBondContact NE2-NH2 3.21Å; V294-R298 WeakPolarHBondContact O-CB 3.44Å; V294-R298 PolarHBondContact O-N 3.15Å; R298-L301 PolarHBondContact O-N 3.44Å; R298-K302 WeakPolarHBondContact O-CB 3.36Å; R298-K302 PolarHBondContact O-N 3.27Å; R298-L328 HydrophobicContact CB-CD2 4.46Å; R298-L328 HydrophobicContact CG-CD2 3.19Å
299	K	93.8	Very high	92.1	Very high	155 Å²	155	49.8 Å²	49.8	67%	0.674	27%	0.268	S	S	*	.	H	α-helix	trans	-63.5	-42.6	174.7	-176.6	178.2	176.9	178.6	0	112.4	S295 S296 V297 L303	S295-K299 WeakPolarHBondContact O-CB 3.37Å; S295-K299 PolarHBondContact O-N 2.99Å; S296-K299 PolarHBondContact O-N 3.37Å; V297-K299 VanDerWaalsContact C-N 3.33Å; V297-K299 PolarHBondContact O-N 3.36Å; K299-L303 PolarHBondContact O-N 3.26Å; K299-L303 VanDerWaalsContact O-N 3.08Å
300	N	94.8	Very high	92.6	Very high	48 Å²	48	55 Å²	55	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-68.5	-41.9	176.7	-80.4	-82.2	0	0	0	111.6	T254 S296 V297 K302 L303 H304	T254-N300 HydrophobicContact CG2-CB 4.06Å; S296-N300 PolarHBondContact O-N 3.47Å; S296-N300 PolarHBondContact O-ND2 3.16Å; V297-N300 PolarHBondContact O-N 2.88Å; V297-N300 VanDerWaalsContact O-N 3.16Å; N300-K302 PolarHBondContact O-N 2.93Å; N300-L303 WeakPolarHBondContact O-CB 3.11Å; N300-L303 PolarHBondContact O-N 3.2Å; N300-L303 VanDerWaalsContact O-N 3.14Å; N300-H304 PolarHBondContact O-CD2 3.13Å; N300-H304 PolarHBondContact O-N 3.2Å
301	L	95.8	Very high	93.1	Very high	4 Å²	4	53 Å²	53	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-47.3	175	-180	60.4	0	0	0	111.2	L257 Y278 H282 V297 R298 L303 H304 L305 L328	L257-L301 HydrophobicContact CD1-CB 4.23Å; L257-L301 HydrophobicContact CD2-CD1 3.87Å; Y278-L301 HydrophobicContact CD1-CD1 3.89Å; Y278-L301 HydrophobicContact CD2-CD1 4.12Å; Y278-L301 HydrophobicContact CE1-CD1 4.48Å; Y278-L301 HydrophobicContact CG-CD1 3.69Å; H282-L301 HydrophobicContact CB-CD2 4.19Å; V297-L301 WeakPolarHBondContact O-CB 3.21Å; V297-L301 PolarHBondContact O-N 3.11Å; R298-L301 PolarHBondContact O-N 3.44Å; L301-L303 VanDerWaalsContact C-N 3.35Å; L301-L303 PolarHBondContact O-N 3.49Å; L301-H304 PolarHBondContact O-N 3.5Å; L301-L305 HydrophobicContact CD1-CD1 4.17Å; L301-L305 HydrophobicContact CD1-CG 4.34Å; L301-L305 HydrophobicContact CG-CD1 4.03Å; L301-L305 WeakPolarHBondContact O-CB 3.15Å; L301-L305 WeakPolarHBondContact O-CG 3.41Å; L301-L305 PolarHBondContact O-N 3.23Å; L301-L328 HydrophobicContact CD2-CD1 4.19Å; L301-L328 HydrophobicContact CD2-CD2 4.21Å; L301-L328 HydrophobicContact CG-CD1 4.06Å
302	K	95.6	Very high	93.6	Very high	46 Å²	46	49.1 Å²	49.1	20%	0.2	26%	0.263	C	S	.	.	H	α-helix	trans	-55.2	-48.4	172.9	174.3	179	172.4	172.9	0	111.7	R298 N300 H304 L305 L306 L325 L328 T330 E334	R298-K302 WeakPolarHBondContact O-CB 3.36Å; R298-K302 PolarHBondContact O-N 3.27Å; N300-K302 PolarHBondContact O-N 2.93Å; K302-H304 VanDerWaalsContact C-N 3.35Å; K302-H304 PolarHBondContact O-N 2.97Å; K302-L305 PolarHBondContact O-N 3.26Å; K302-L306 HydrophobicContact CG-CD1 4.08Å; K302-L306 WeakPolarHBondContact O-CG 3.33Å; K302-L306 PolarHBondContact O-N 3.16Å; K302-L325 HydrophobicContact CG-CD2 4.18Å; K302-L328 HydrophobicContact CB-CD1 4.27Å; K302-T330 WeakPolarHBondContact CD-OG1 3.39Å; K302-T330 WeakPolarHBondContact CE-OG1 3.47Å; K302-E334 WeakPolarHBondContact CE-OE2 3.18Å; K302-E334 IonicContact NZ-OE1 3.46Å; K302-E334 IonicContact NZ-OE2 2.77Å; K302-E334 PolarHBondContact NZ-OE2 3.4Å
303	L	95.8	Very high	93.9	Very high	96 Å²	96	45.7 Å²	45.7	50%	0.503	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-44.3	-179.5	-174.6	156	0	0	0	111.5	K299 N300 L301 L306 S307	K299-L303 PolarHBondContact O-N 3.26Å; K299-L303 VanDerWaalsContact O-N 3.08Å; N300-L303 WeakPolarHBondContact O-CB 3.11Å; N300-L303 PolarHBondContact O-N 3.2Å; N300-L303 VanDerWaalsContact O-N 3.14Å; L301-L303 VanDerWaalsContact C-N 3.35Å; L301-L303 PolarHBondContact O-N 3.49Å; L303-L306 PolarHBondContact O-N 3.34Å; L303-S307 WeakPolarHBondContact O-CB 3.27Å; L303-S307 PolarHBondContact O-N 3.43Å
304	H	97.2	Very high	94.1	Very high	26 Å²	26	42.3 Å²	42.3	12%	0.12	23%	0.225	C	C	.	.	H	α-helix	trans	-69.9	-40.3	179.7	-69.1	-48.3	0	0	0	112.5	G258 A261 N300 L301 K302 L306 S307 V308	G258-H304 WeakPolarHBondContact CA-CE1 3.36Å; G258-H304 WeakPolarHBondContact CA-NE2 3.43Å; G258-H304 PolarHBondContact N-NE2 3.33Å; A261-H304 HydrophobicContact CB-CB 3.92Å; N300-H304 PolarHBondContact O-CD2 3.13Å; N300-H304 PolarHBondContact O-N 3.2Å; L301-H304 PolarHBondContact O-N 3.5Å; K302-H304 VanDerWaalsContact C-N 3.35Å; K302-H304 PolarHBondContact O-N 2.97Å; H304-L306 PolarHBondContact O-N 3.11Å; H304-S307 WeakPolarHBondContact O-CB 3.24Å; H304-S307 PolarHBondContact O-N 2.62Å; H304-V308 WeakPolarHBondContact O-CG2 3.27Å; H304-V308 PolarHBondContact O-N 3.22Å
305	L	96.4	Very high	94.1	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-43.9	172.5	-79.7	166.2	0	0	0	111.9	I275 Y278 L301 K302 S307 V308 L309 I321 L324 L325 L328	I275-L305 HydrophobicContact CD1-CD2 4.41Å; Y278-L305 HydrophobicContact CD2-CD2 3.65Å; Y278-L305 HydrophobicContact CD2-CG 4.01Å; Y278-L305 HydrophobicContact CE2-CD2 4.39Å; L301-L305 HydrophobicContact CD1-CD1 4.17Å; L301-L305 HydrophobicContact CD1-CG 4.34Å; L301-L305 HydrophobicContact CG-CD1 4.03Å; L301-L305 WeakPolarHBondContact O-CB 3.15Å; L301-L305 WeakPolarHBondContact O-CG 3.41Å; L301-L305 PolarHBondContact O-N 3.23Å; K302-L305 PolarHBondContact O-N 3.26Å; L305-S307 VanDerWaalsContact C-N 3.32Å; L305-S307 PolarHBondContact O-N 3.13Å; L305-V308 PolarHBondContact O-N 3.49Å; L305-L309 WeakPolarHBondContact O-CB 3.34Å; L305-L309 PolarHBondContact O-N 3.07Å; L305-I321 HydrophobicContact CB-CG2 4.47Å; L305-I321 HydrophobicContact CD2-CG1 4.39Å; L305-I321 HydrophobicContact CD2-CG2 4.07Å; L305-L324 HydrophobicContact CD1-CB 3.93Å; L305-L324 HydrophobicContact CD1-CD1 4.22Å; L305-L324 HydrophobicContact CD2-CD1 4.12Å; L305-L325 HydrophobicContact CB-CD1 4.49Å; L305-L325 HydrophobicContact CB-CD2 3.63Å; L305-L325 HydrophobicContact CB-CG 4.02Å; L305-L325 HydrophobicContact CD1-CD2 4.27Å; L305-L325 HydrophobicContact CD1-CG 4.45Å; L305-L328 HydrophobicContact CD1-CD1 3.53Å
306	L	95.3	Very high	94.2	Very high	13 Å²	13	49.2 Å²	49.2	7%	0.068	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-37.6	174.5	-73.1	171.4	0	0	0	112.2	K302 L303 H304 K310 L325 T330 E334 N338	K302-L306 HydrophobicContact CG-CD1 4.08Å; K302-L306 WeakPolarHBondContact O-CG 3.33Å; K302-L306 PolarHBondContact O-N 3.16Å; L303-L306 PolarHBondContact O-N 3.34Å; H304-L306 PolarHBondContact O-N 3.11Å; L306-K310 PolarHBondContact O-N 3.09Å; L306-L325 HydrophobicContact CD2-CD1 3.84Å; L306-L325 HydrophobicContact CD2-CD2 4.08Å; L306-L325 HydrophobicContact CG-CD1 4.41Å; L306-L325 HydrophobicContact CG-CD2 3.86Å; L306-T330 HydrophobicContact CD2-CG2 4.33Å; L306-E334 HydrophobicContact CD1-CG 4.23Å; L306-E334 WeakPolarHBondContact CD1-OE1 3.49Å; L306-E334 HydrophobicContact CD2-CG 4.49Å; L306-N338 HydrophobicContact CD2-CB 4.12Å
307	S	95.3	Very high	94.1	Very high	28 Å²	28	48.3 Å²	48.3	20%	0.196	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-38.4	175.7	-173.2	0	0	0	0	112.2	L303 H304 L305	L303-S307 WeakPolarHBondContact O-CB 3.27Å; L303-S307 PolarHBondContact O-N 3.43Å; H304-S307 WeakPolarHBondContact O-CB 3.24Å; H304-S307 PolarHBondContact O-N 2.62Å; L305-S307 VanDerWaalsContact C-N 3.32Å; L305-S307 PolarHBondContact O-N 3.13Å
308	V	95.9	Very high	93.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-71.9	-38.5	177.2	171	0	0	0	0	110.8	A261 A264 M271 I275 H304 L305 K310 H311 S314 I321	A261-V308 HydrophobicContact CB-CG2 4.2Å; A264-V308 HydrophobicContact CB-CG2 4.35Å; M271-V308 HydrophobicContact CE-CG1 4.24Å; M271-V308 HydrophobicContact SD-CG1 3.36Å; M271-V308 WeakPolarHBondContact SD-CG1 3.22Å; I275-V308 HydrophobicContact CD1-CG1 4.05Å; H304-V308 WeakPolarHBondContact O-CG2 3.27Å; H304-V308 PolarHBondContact O-N 3.22Å; L305-V308 PolarHBondContact O-N 3.49Å; V308-K310 PolarHBondContact O-N 3.47Å; V308-H311 WeakPolarHBondContact O-CB 3.45Å; V308-H311 PolarHBondContact O-N 2.89Å; V308-S314 WeakPolarHBondContact O-CB 3.36Å; V308-I321 HydrophobicContact CG1-CD1 4.24Å
309	L	95.5	Very high	93.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-30.5	177.5	-171.7	62.3	0	0	0	113.1	L305 H311 S314 Q318 I321 L325 I335 N338 M339 P340	L305-L309 WeakPolarHBondContact O-CB 3.34Å; L305-L309 PolarHBondContact O-N 3.07Å; L309-H311 PolarHBondContact O-N 3.4Å; L309-S314 PolarHBondContact O-OG 3.46Å; L309-Q318 HydrophobicContact CD1-CG 4.35Å; L309-I321 HydrophobicContact CB-CG2 4.07Å; L309-I321 HydrophobicContact CD1-CB 4.38Å; L309-I321 HydrophobicContact CD1-CG2 3.92Å; L309-I321 HydrophobicContact CG-CG2 4.39Å; L309-L325 HydrophobicContact CD2-CD1 3.92Å; L309-I335 HydrophobicContact CD2-CG2 3.75Å; L309-N338 CarbonylContact C-O 3.45Å; L309-M339 HydrophobicContact CD1-SD 3.71Å; L309-M339 HydrophobicContact CD2-SD 4Å; L309-M339 HydrophobicContact CG-SD 3.97Å; L309-P340 WeakPolarHBondContact O-CD 3.39Å; L309-P340 WeakPolarHBondContact O-CG 3.27Å
310	K	94.5	Very high	93.2	Very high	126 Å²	126	45.9 Å²	45.9	55%	0.548	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.4	174.4	-72.6	-177.4	-174.1	-179.2	0	113.6	L306 V308 N338	L306-K310 PolarHBondContact O-N 3.09Å; V308-K310 PolarHBondContact O-N 3.47Å; K310-N338 VanDerWaalsContact CA-O 3.31Å; K310-N338 WeakPolarHBondContact CA-O 3.23Å; K310-N338 WeakPolarHBondContact CE-OD1 3.25Å; K310-N338 HydrophobicContact CG-CB 4.09Å; K310-N338 PolarHBondContact N-O 3.4Å; K310-N338 PolarHBondContact NZ-OD1 3.17Å
311	H	94.6	Very high	93.1	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.014	23%	0.231	C	C	.	.	S	Bend	trans	-75.2	135.8	-174.7	-165.5	-85.5	0	0	0	110.4	D200 E202 R265 P268 M271 V308 L309 A313 S314	D200-H311 PolarHBondContact O-CE1 3.2Å; D200-H311 PolarHBondContact O-NE2 3.06Å; E202-H311 IonicContact OE2-CD2 2.76Å; R265-H311 HydrophobicContact CG-CB 4.36Å; R265-H311 PolarHBondContact O-NE2 3.39Å; P268-H311 WeakPolarHBondContact CG-CE1 3.43Å; M271-H311 HydrophobicContact CE-CB 4.49Å; V308-H311 WeakPolarHBondContact O-CB 3.45Å; V308-H311 PolarHBondContact O-N 2.89Å; L309-H311 PolarHBondContact O-N 3.4Å; H311-A313 VanDerWaalsContact C-N 3.28Å; H311-A313 VanDerWaalsContact ND1-CB 3.31Å; H311-A313 WeakPolarHBondContact ND1-CB 2.97Å; H311-A313 PolarHBondContact ND1-N 2.85Å; H311-A313 VanDerWaalsContact ND1-N 3.19Å; H311-A313 PolarHBondContact O-N 3.02Å; H311-S314 VanDerWaalsContact O-CB 3.29Å; H311-S314 WeakPolarHBondContact O-CB 3.18Å; H311-S314 PolarHBondContact O-N 3.44Å; H311-S314 PolarHBondContact O-OG 3.27Å
312	P	91.8	Very high	92.9	Very high	75 Å²	75	44.6 Å²	44.6	49%	0.487	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-60	-35.4	-177.3	22.7	-33.9	0	0	0	113.4	S314 L315	P312-S314 PolarHBondContact O-N 2.84Å; P312-S314 VanDerWaalsContact O-N 3.15Å; P312-L315 VanDerWaalsContact O-CG 3.28Å; P312-L315 WeakPolarHBondContact O-CG 3.23Å; P312-L315 PolarHBondContact O-N 3.04Å
313	A	92.3	Very high	92.5	Very high	20 Å²	20	44.7 Å²	44.7	17%	0.165	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-66.7	-10.5	176.6	0	0	0	0	0	114.6	D200 P268 M271 H311 L315	D200-A313 VanDerWaalsContact OD2-CB 3.3Å; D200-A313 WeakPolarHBondContact OD2-CB 3.38Å; P268-A313 HydrophobicContact CB-CB 3.58Å; P268-A313 HydrophobicContact CG-CB 4.29Å; M271-A313 HydrophobicContact CE-CB 4.1Å; H311-A313 VanDerWaalsContact C-N 3.28Å; H311-A313 VanDerWaalsContact ND1-CB 3.31Å; H311-A313 WeakPolarHBondContact ND1-CB 2.97Å; H311-A313 PolarHBondContact ND1-N 2.85Å; H311-A313 VanDerWaalsContact ND1-N 3.19Å; H311-A313 PolarHBondContact O-N 3.02Å; A313-L315 PolarHBondContact O-N 3.35Å
314	S	93.3	Very high	92.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-76	-9.4	177.9	72.5	0	0	0	0	113.5	V308 L309 H311 P312 E316 F317 Q318	V308-S314 WeakPolarHBondContact O-CB 3.36Å; L309-S314 PolarHBondContact O-OG 3.46Å; H311-S314 VanDerWaalsContact O-CB 3.29Å; H311-S314 WeakPolarHBondContact O-CB 3.18Å; H311-S314 PolarHBondContact O-N 3.44Å; H311-S314 PolarHBondContact O-OG 3.27Å; P312-S314 PolarHBondContact O-N 2.84Å; P312-S314 VanDerWaalsContact O-N 3.15Å; S314-E316 PolarHBondContact O-N 3.09Å; S314-F317 CarbonylContact O-C 3.53Å; S314-F317 PolarHBondContact O-N 2.9Å; S314-Q318 PolarHBondContact O-N 2.67Å
315	L	90.4	Very high	91.9	Very high	94 Å²	94	39.1 Å²	39.1	49%	0.492	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-56.7	-35.9	-178.5	-72.6	171.9	0	0	0	112.7	P312 A313 F317 Q318 P340	P312-L315 VanDerWaalsContact O-CG 3.28Å; P312-L315 WeakPolarHBondContact O-CG 3.23Å; P312-L315 PolarHBondContact O-N 3.04Å; A313-L315 PolarHBondContact O-N 3.35Å; L315-F317 VanDerWaalsContact C-N 3.28Å; L315-F317 PolarHBondContact O-N 3.28Å; L315-Q318 WeakPolarHBondContact O-CB 3.36Å; L315-Q318 PolarHBondContact O-N 3.04Å; L315-P340 HydrophobicContact CD2-CG 4.41Å
316	E	90.1	Very high	91.6	Very high	170 Å²	170	42.6 Å²	42.6	79%	0.794	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-66.5	-31.2	177.1	-64.5	-178.3	179.1	0	0	112.4	S314	S314-E316 PolarHBondContact O-N 3.09Å
317	F	91.9	Very high	91.2	Very high	33 Å²	33	44.6 Å²	44.6	15%	0.145	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-104.4	9.3	-177	-51.8	-77.4	0	0	0	112.7	M271 I275 S314 L315 A319 Q320 I321	M271-F317 HydrophobicContact CB-CD2 4.23Å; M271-F317 HydrophobicContact CB-CE2 3.83Å; M271-F317 HydrophobicContact CG-CD2 3.49Å; M271-F317 VanDerWaalsContact CG-CD2 3.49Å; M271-F317 HydrophobicContact CG-CE2 3.62Å; M271-F317 HydrophobicContact CG-CG 4.43Å; I275-F317 HydrophobicContact CG1-CB 4.25Å; I275-F317 HydrophobicContact CG1-CG 4.41Å; S314-F317 CarbonylContact O-C 3.53Å; S314-F317 PolarHBondContact O-N 2.9Å; L315-F317 VanDerWaalsContact C-N 3.28Å; L315-F317 PolarHBondContact O-N 3.28Å; F317-A319 VanDerWaalsContact C-N 3.28Å; F317-A319 PolarHBondContact O-N 3.39Å; F317-Q320 PolarHBondContact O-N 3.37Å; F317-Q320 VanDerWaalsContact O-N 3.09Å; F317-I321 HydrophobicContact CB-CD1 4Å; F317-I321 HydrophobicContact CB-CG1 4.36Å; F317-I321 WeakPolarHBondContact O-CG1 3.37Å; F317-I321 PolarHBondContact O-N 3.47Å
318	Q	89	Confident	90.9	Very high	75 Å²	75	44 Å²	44	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-56.2	-42.1	-172.2	-173.5	-162.4	-23.8	0	0	112.1	L309 S314 L315 T322 M339	L309-Q318 HydrophobicContact CD1-CG 4.35Å; S314-Q318 PolarHBondContact O-N 2.67Å; L315-Q318 WeakPolarHBondContact O-CB 3.36Å; L315-Q318 PolarHBondContact O-N 3.04Å; Q318-T322 WeakPolarHBondContact O-CB 3.28Å; Q318-T322 PolarHBondContact O-N 3.17Å; Q318-T322 PolarHBondContact O-OG1 3.29Å; Q318-M339 HydrophobicContact CG-CE 3.68Å; Q318-M339 HydrophobicContact CG-SD 3.81Å
319	A	85.8	Confident	90.5	Very high	71 Å²	71	46.8 Å²	46.8	59%	0.587	27%	0.269	S	S	*	.	H	α-helix	trans	-62.9	-43.6	179.8	0	0	0	0	0	111.9	F317 T323	F317-A319 VanDerWaalsContact C-N 3.28Å; F317-A319 PolarHBondContact O-N 3.39Å; A319-T323 WeakPolarHBondContact O-CB 3.44Å; A319-T323 PolarHBondContact O-N 2.89Å; A319-T323 VanDerWaalsContact O-N 3.08Å; A319-T323 PolarHBondContact O-OG1 2.9Å
320	Q	86.8	Confident	90.3	Very high	35 Å²	35	47.1 Å²	47.1	16%	0.164	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-51.2	177.6	-72.3	169.8	-14.3	0	0	111.1	I275 E279 F317 T322 T323 L324	I275-Q320 HydrophobicContact CG2-CB 4.17Å; E279-Q320 WeakPolarHBondContact OE1-CG 3.42Å; F317-Q320 PolarHBondContact O-N 3.37Å; F317-Q320 VanDerWaalsContact O-N 3.09Å; Q320-T322 VanDerWaalsContact C-N 3.34Å; Q320-T322 PolarHBondContact O-N 3.25Å; Q320-T323 PolarHBondContact O-N 3.45Å; Q320-L324 PolarHBondContact O-N 3.27Å
321	I	92.3	Very high	90.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-43.1	-179.6	-64.2	166.8	0	0	0	111.2	I275 L305 V308 L309 F317 T323 L324 L325	I275-I321 HydrophobicContact CD1-CD1 3.76Å; I275-I321 HydrophobicContact CD1-CG1 3.66Å; I275-I321 HydrophobicContact CG1-CD1 4.21Å; I275-I321 HydrophobicContact CG1-CG1 4.17Å; I275-I321 HydrophobicContact CG2-CG1 4.43Å; L305-I321 HydrophobicContact CB-CG2 4.47Å; L305-I321 HydrophobicContact CD2-CG1 4.39Å; L305-I321 HydrophobicContact CD2-CG2 4.07Å; V308-I321 HydrophobicContact CG1-CD1 4.24Å; L309-I321 HydrophobicContact CB-CG2 4.07Å; L309-I321 HydrophobicContact CD1-CB 4.38Å; L309-I321 HydrophobicContact CD1-CG2 3.92Å; L309-I321 HydrophobicContact CG-CG2 4.39Å; F317-I321 HydrophobicContact CB-CD1 4Å; F317-I321 HydrophobicContact CB-CG1 4.36Å; F317-I321 WeakPolarHBondContact O-CG1 3.37Å; F317-I321 PolarHBondContact O-N 3.47Å; I321-T323 VanDerWaalsContact C-N 3.35Å; I321-L324 PolarHBondContact O-N 3.32Å; I321-L325 HydrophobicContact CG2-CD1 3.83Å; I321-L325 HydrophobicContact CG2-CG 4.38Å; I321-L325 WeakPolarHBondContact O-CB 3.47Å; I321-L325 VanDerWaalsContact O-CG 3.27Å; I321-L325 WeakPolarHBondContact O-CG 3.23Å; I321-L325 PolarHBondContact O-N 3.01Å
322	T	90.6	Very high	89.8	Confident	25 Å²	25	50.4 Å²	50.4	15%	0.153	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-43.4	178.4	-59.8	0	0	0	0	111	Q318 Q320 L325 V326 I335	Q318-T322 WeakPolarHBondContact O-CB 3.28Å; Q318-T322 PolarHBondContact O-N 3.17Å; Q318-T322 PolarHBondContact O-OG1 3.29Å; Q320-T322 VanDerWaalsContact C-N 3.34Å; Q320-T322 PolarHBondContact O-N 3.25Å; T322-L325 PolarHBondContact O-N 3.12Å; T322-V326 WeakPolarHBondContact O-CG2 3.42Å; T322-V326 PolarHBondContact O-N 3Å; T322-I335 HydrophobicContact CG2-CD1 4.19Å; T322-I335 HydrophobicContact CG2-CG2 4.21Å
323	T	88.8	Confident	89.6	Confident	48 Å²	48	50.1 Å²	50.1	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-49.4	178.9	-53.1	0	0	0	0	111	A319 Q320 I321 L325 V326 D327 H448	A319-T323 WeakPolarHBondContact O-CB 3.44Å; A319-T323 PolarHBondContact O-N 2.89Å; A319-T323 VanDerWaalsContact O-N 3.08Å; A319-T323 PolarHBondContact O-OG1 2.9Å; Q320-T323 PolarHBondContact O-N 3.45Å; I321-T323 VanDerWaalsContact C-N 3.35Å; T323-L325 VanDerWaalsContact C-N 3.3Å; T323-L325 PolarHBondContact O-N 3.44Å; T323-V326 WeakPolarHBondContact O-CB 3.28Å; T323-V326 PolarHBondContact O-N 3.39Å; T323-V326 VanDerWaalsContact O-N 3.15Å; T323-D327 PolarHBondContact O-N 3.4Å; T323-H448 HydrophobicContact CG2-CB 4.2Å; T323-H448 VanDerWaalsContact CG2-ND1 3.26Å; T323-H448 WeakPolarHBondContact CG2-ND1 3.08Å
324	L	88.4	Confident	89.6	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-41.1	175.4	-72	-177.6	0	0	0	112.7	E279 H282 L305 Q320 I321 V326 D327 L328	E279-L324 HydrophobicContact CG-CD1 3.67Å; E279-L324 HydrophobicContact CG-CD2 4.18Å; E279-L324 HydrophobicContact CG-CG 4.17Å; H282-L324 HydrophobicContact CB-CD2 4.17Å; L305-L324 HydrophobicContact CD1-CB 3.93Å; L305-L324 HydrophobicContact CD1-CD1 4.22Å; L305-L324 HydrophobicContact CD2-CD1 4.12Å; Q320-L324 PolarHBondContact O-N 3.27Å; I321-L324 PolarHBondContact O-N 3.32Å; L324-V326 VanDerWaalsContact C-N 3.32Å; L324-V326 PolarHBondContact O-N 3.39Å; L324-D327 PolarHBondContact O-N 3.25Å; L324-L328 WeakPolarHBondContact O-CB 3.39Å; L324-L328 WeakPolarHBondContact O-CD1 3.5Å; L324-L328 WeakPolarHBondContact O-CG 3.21Å; L324-L328 PolarHBondContact O-N 2.9Å
325	L	91	Very high	89.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-38.3	178.7	-77.3	170.6	0	0	0	112.1	K302 L305 L306 L309 I321 T322 T323 L328 G329 T330 I335	K302-L325 HydrophobicContact CG-CD2 4.18Å; L305-L325 HydrophobicContact CB-CD1 4.49Å; L305-L325 HydrophobicContact CB-CD2 3.63Å; L305-L325 HydrophobicContact CB-CG 4.02Å; L305-L325 HydrophobicContact CD1-CD2 4.27Å; L305-L325 HydrophobicContact CD1-CG 4.45Å; L306-L325 HydrophobicContact CD2-CD1 3.84Å; L306-L325 HydrophobicContact CD2-CD2 4.08Å; L306-L325 HydrophobicContact CG-CD1 4.41Å; L306-L325 HydrophobicContact CG-CD2 3.86Å; L309-L325 HydrophobicContact CD2-CD1 3.92Å; I321-L325 HydrophobicContact CG2-CD1 3.83Å; I321-L325 HydrophobicContact CG2-CG 4.38Å; I321-L325 WeakPolarHBondContact O-CB 3.47Å; I321-L325 VanDerWaalsContact O-CG 3.27Å; I321-L325 WeakPolarHBondContact O-CG 3.23Å; I321-L325 PolarHBondContact O-N 3.01Å; T322-L325 PolarHBondContact O-N 3.12Å; T323-L325 VanDerWaalsContact C-N 3.3Å; T323-L325 PolarHBondContact O-N 3.44Å; L325-L328 PolarHBondContact O-N 3.17Å; L325-G329 PolarHBondContact O-N 3.48Å; L325-T330 HydrophobicContact CD2-CG2 4.5Å; L325-T330 WeakPolarHBondContact O-CA 3.42Å; L325-T330 WeakPolarHBondContact O-CB 3.24Å; L325-T330 PolarHBondContact O-N 3.05Å; L325-T330 PolarHBondContact O-OG1 3.31Å; L325-I335 HydrophobicContact CB-CD1 3.72Å; L325-I335 HydrophobicContact CB-CG1 4.15Å; L325-I335 HydrophobicContact CD1-CG1 4.25Å; L325-I335 HydrophobicContact CD1-CG2 4.44Å
326	V	90.9	Very high	89.5	Confident	74 Å²	74	50.1 Å²	50.1	45%	0.448	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-45.9	174.3	171.2	0	0	0	0	110.5	T322 T323 L324 L328 G329 I335	T322-V326 WeakPolarHBondContact O-CG2 3.42Å; T322-V326 PolarHBondContact O-N 3Å; T323-V326 WeakPolarHBondContact O-CB 3.28Å; T323-V326 PolarHBondContact O-N 3.39Å; T323-V326 VanDerWaalsContact O-N 3.15Å; L324-V326 VanDerWaalsContact C-N 3.32Å; L324-V326 PolarHBondContact O-N 3.39Å; V326-L328 PolarHBondContact O-N 3.14Å; V326-G329 WeakPolarHBondContact O-CA 3.31Å; V326-G329 PolarHBondContact O-N 2.88Å; V326-I335 HydrophobicContact CG2-CD1 3.87Å
327	D	85.7	Confident	89.5	Confident	54 Å²	54	51.1 Å²	51.1	29%	0.289	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-28.6	177.8	-61.4	-25.8	0	0	0	113.2	H282 T323 L324 G329 H448	H282-D327 IonicContact CE1-OD2 3.34Å; T323-D327 PolarHBondContact O-N 3.4Å; L324-D327 PolarHBondContact O-N 3.25Å; D327-G329 PolarHBondContact O-N 3.39Å; D327-H448 IonicContact OD2-CE1 2.76Å; D327-H448 IonicContact OD2-NE2 3.59Å; D327-H448 PolarHBondContact OD2-NE2 3.05Å
328	L	89.6	Confident	89.4	Confident	17 Å²	17	50.8 Å²	50.8	9%	0.089	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	3	173.8	-65.2	167.7	0	0	0	113.1	R298 L301 K302 L305 L324 L325 V326	R298-L328 HydrophobicContact CB-CD2 4.46Å; R298-L328 HydrophobicContact CG-CD2 3.19Å; L301-L328 HydrophobicContact CD2-CD1 4.19Å; L301-L328 HydrophobicContact CD2-CD2 4.21Å; L301-L328 HydrophobicContact CG-CD1 4.06Å; K302-L328 HydrophobicContact CB-CD1 4.27Å; L305-L328 HydrophobicContact CD1-CD1 3.53Å; L324-L328 WeakPolarHBondContact O-CB 3.39Å; L324-L328 WeakPolarHBondContact O-CD1 3.5Å; L324-L328 WeakPolarHBondContact O-CG 3.21Å; L324-L328 PolarHBondContact O-N 2.9Å; L325-L328 PolarHBondContact O-N 3.17Å; V326-L328 PolarHBondContact O-N 3.14Å
329	G	88.3	Confident	89.3	Confident	58 Å²	58	49.6 Å²	49.6	60%	0.598	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	30.6	-179.9	0	0	0	0	0	113.6	L325 V326 D327	L325-G329 PolarHBondContact O-N 3.48Å; V326-G329 WeakPolarHBondContact O-CA 3.31Å; V326-G329 PolarHBondContact O-N 2.88Å; D327-G329 PolarHBondContact O-N 3.39Å
330	T	90.9	Very high	89.1	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.043	28%	0.275	C	S	.	.			trans	-83.7	123.2	177.2	-51.1	0	0	0	0	110.6	K302 L306 L325 E334 I335	K302-T330 WeakPolarHBondContact CD-OG1 3.39Å; K302-T330 WeakPolarHBondContact CE-OG1 3.47Å; L306-T330 HydrophobicContact CD2-CG2 4.33Å; L325-T330 HydrophobicContact CD2-CG2 4.5Å; L325-T330 WeakPolarHBondContact O-CA 3.42Å; L325-T330 WeakPolarHBondContact O-CB 3.24Å; L325-T330 PolarHBondContact O-N 3.05Å; L325-T330 PolarHBondContact O-OG1 3.31Å; T330-E334 HydrophobicContact CG2-CB 3.93Å; T330-E334 HydrophobicContact CG2-CG 4.05Å; T330-I335 HydrophobicContact CG2-CD1 4.36Å; T330-I335 HydrophobicContact CG2-CG1 3.69Å
331	P	89.6	Confident	88.1	Confident	74 Å²	74	50 Å²	50	48%	0.481	30%	0.297	S	S	.	.			trans	-62.3	143.4	177.4	-21.4	32.1	0	0	0	112.1	A333 E334 I335	P331-A333 PolarHBondContact O-N 3.13Å; P331-A333 VanDerWaalsContact O-N 3.13Å; P331-E334 WeakPolarHBondContact CD-OE2 3.4Å; P331-E334 WeakPolarHBondContact O-CA 3.46Å; P331-E334 WeakPolarHBondContact O-CB 3.41Å; P331-E334 PolarHBondContact O-N 3.42Å; P331-I335 PolarHBondContact O-N 2.99Å; P331-I335 VanDerWaalsContact O-N 3.15Å
332	Q	88.2	Confident	86.1	Confident	123 Å²	123	55.2 Å²	55.2	58%	0.575	33%	0.333	S	S	*	.	H	α-helix	trans	-57	-33.6	-179.9	-165.2	65.4	2.2	0	0	113.1	E334 I335 A336	Q332-E334 VanDerWaalsContact C-N 3.32Å; Q332-E334 PolarHBondContact O-N 3.15Å; Q332-I335 PolarHBondContact O-N 3.5Å; Q332-A336 WeakPolarHBondContact O-CB 3.49Å; Q332-A336 PolarHBondContact O-N 2.96Å
333	A	88.1	Confident	83.9	Confident	70 Å²	70	62.4 Å²	62.4	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-66	-30.6	174.3	0	0	0	0	0	113.2	P331 R337	P331-A333 PolarHBondContact O-N 3.13Å; P331-A333 VanDerWaalsContact O-N 3.13Å; A333-R337 VanDerWaalsContact O-CG 3.26Å; A333-R337 WeakPolarHBondContact O-CG 3.49Å; A333-R337 PolarHBondContact O-N 3.03Å; A333-R337 PolarHBondContact O-NE 3.39Å
334	E	92.1	Very high	81.8	Confident	48 Å²	48	66.7 Å²	66.7	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-74.1	-40.5	173.7	-172.1	175.2	-170.1	0	0	111	K302 L306 T330 P331 Q332 R337 N338	K302-E334 WeakPolarHBondContact CE-OE2 3.18Å; K302-E334 IonicContact NZ-OE1 3.46Å; K302-E334 IonicContact NZ-OE2 2.77Å; K302-E334 PolarHBondContact NZ-OE2 3.4Å; L306-E334 HydrophobicContact CD1-CG 4.23Å; L306-E334 WeakPolarHBondContact CD1-OE1 3.49Å; L306-E334 HydrophobicContact CD2-CG 4.49Å; T330-E334 HydrophobicContact CG2-CB 3.93Å; T330-E334 HydrophobicContact CG2-CG 4.05Å; P331-E334 WeakPolarHBondContact CD-OE2 3.4Å; P331-E334 WeakPolarHBondContact O-CA 3.46Å; P331-E334 WeakPolarHBondContact O-CB 3.41Å; P331-E334 PolarHBondContact O-N 3.42Å; Q332-E334 VanDerWaalsContact C-N 3.32Å; Q332-E334 PolarHBondContact O-N 3.15Å; E334-R337 PolarHBondContact O-N 3.1Å; E334-N338 PolarHBondContact O-N 3.17Å; E334-N338 PolarHBondContact O-ND2 3.35Å
335	I	91.1	Very high	79.5	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-61.5	-51.3	175.2	-56.3	-179.2	0	0	0	110.1	L309 T322 L325 V326 T330 P331 Q332 R337 N338 M339	L309-I335 HydrophobicContact CD2-CG2 3.75Å; T322-I335 HydrophobicContact CG2-CD1 4.19Å; T322-I335 HydrophobicContact CG2-CG2 4.21Å; L325-I335 HydrophobicContact CB-CD1 3.72Å; L325-I335 HydrophobicContact CB-CG1 4.15Å; L325-I335 HydrophobicContact CD1-CG1 4.25Å; L325-I335 HydrophobicContact CD1-CG2 4.44Å; V326-I335 HydrophobicContact CG2-CD1 3.87Å; T330-I335 HydrophobicContact CG2-CD1 4.36Å; T330-I335 HydrophobicContact CG2-CG1 3.69Å; P331-I335 PolarHBondContact O-N 2.99Å; P331-I335 VanDerWaalsContact O-N 3.15Å; Q332-I335 PolarHBondContact O-N 3.5Å; I335-R337 VanDerWaalsContact C-N 3.27Å; I335-R337 PolarHBondContact O-N 3.26Å; I335-N338 PolarHBondContact O-N 3.35Å; I335-M339 PolarHBondContact O-N 2.83Å
336	A	89.4	Confident	77	Confident	63 Å²	63	84.3 Å²	84.3	52%	0.521	46%	0.464	S	S	.	.	H	α-helix	trans	-59.2	-33.8	-179.7	0	0	0	0	0	113.5	Q332 N338 M339	Q332-A336 WeakPolarHBondContact O-CB 3.49Å; Q332-A336 PolarHBondContact O-N 2.96Å; A336-N338 VanDerWaalsContact C-N 3.28Å; A336-N338 PolarHBondContact O-N 3.16Å; A336-M339 WeakPolarHBondContact O-CB 3.46Å; A336-M339 PolarHBondContact O-N 3.27Å
337	R	91.2	Very high	74.2	Confident	190 Å²	190	89.9 Å²	89.9	72%	0.717	48%	0.483	S	S	*	.	H	α-helix	trans	-68.5	-24.4	176	-80.1	-174.8	-60.6	156.8	2.3	113.8	A333 E334 I335	A333-R337 VanDerWaalsContact O-CG 3.26Å; A333-R337 WeakPolarHBondContact O-CG 3.49Å; A333-R337 PolarHBondContact O-N 3.03Å; A333-R337 PolarHBondContact O-NE 3.39Å; E334-R337 PolarHBondContact O-N 3.1Å; I335-R337 VanDerWaalsContact C-N 3.27Å; I335-R337 PolarHBondContact O-N 3.26Å
338	N	90	Very high	71.7	Confident	26 Å²	26	98.2 Å²	98.2	14%	0.139	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	5.4	-178.5	-66.7	-82.1	0	0	0	112.5	L306 L309 K310 E334 I335 A336	L306-N338 HydrophobicContact CD2-CB 4.12Å; L309-N338 CarbonylContact C-O 3.45Å; K310-N338 VanDerWaalsContact CA-O 3.31Å; K310-N338 WeakPolarHBondContact CA-O 3.23Å; K310-N338 WeakPolarHBondContact CE-OD1 3.25Å; K310-N338 HydrophobicContact CG-CB 4.09Å; K310-N338 PolarHBondContact N-O 3.4Å; K310-N338 PolarHBondContact NZ-OD1 3.17Å; E334-N338 PolarHBondContact O-N 3.17Å; E334-N338 PolarHBondContact O-ND2 3.35Å; I335-N338 PolarHBondContact O-N 3.35Å; A336-N338 VanDerWaalsContact C-N 3.28Å; A336-N338 PolarHBondContact O-N 3.16Å
339	M	86.7	Confident	69.3	Low	50 Å²	50	103.7 Å²	103.7	25%	0.246	55%	0.547	C	S	.	.	S	Bend	trans	-72.9	138	173.5	-77.8	-63.7	-58.4	0	0	111.3	L309 Q318 I335 A336 S341	L309-M339 HydrophobicContact CD1-SD 3.71Å; L309-M339 HydrophobicContact CD2-SD 4Å; L309-M339 HydrophobicContact CG-SD 3.97Å; Q318-M339 HydrophobicContact CG-CE 3.68Å; Q318-M339 HydrophobicContact CG-SD 3.81Å; I335-M339 PolarHBondContact O-N 2.83Å; A336-M339 WeakPolarHBondContact O-CB 3.46Å; A336-M339 PolarHBondContact O-N 3.27Å; M339-S341 PolarHBondContact O-N 3.22Å
340	P	82.4	Confident	66.5	Low	28 Å²	28	112.1 Å²	112.1	18%	0.182	56%	0.56	C	S	.	*	P	Polyproline II helix	trans	-62.1	132.6	170.9	-15.7	30.4	0	0	0	109.1	L309 L315 S342	L309-P340 WeakPolarHBondContact O-CD 3.39Å; L309-P340 WeakPolarHBondContact O-CG 3.27Å; L315-P340 HydrophobicContact CD2-CG 4.41Å; P340-S342 PolarHBondContact O-N 3.3Å
341	S	64.9	Low	63.6	Low	87 Å²	87	118.9 Å²	118.9	61%	0.608	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-66.9	124.9	-179.9	-168.2	0	0	0	0	110.1	M339 K343	M339-S341 PolarHBondContact O-N 3.22Å; S341-K343 PolarHBondContact O-N 2.65Å
342	S	51.2	Low	60.9	Low	109 Å²	109	122.8 Å²	122.8	76%	0.762	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	13.8	176.2	50.2	0	0	0	0	114.9	P340	P340-S342 PolarHBondContact O-N 3.3Å
343	K	44.2	Very low	58.1	Low	176 Å²	176	122.3 Å²	122.3	77%	0.765	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-13.6	-176.4	-90.2	-176.4	173.5	178.3	0	115	S341	S341-K343 PolarHBondContact O-N 2.65Å
344	D	43.1	Very low	55.3	Low	139 Å²	139	126.2 Å²	126.2	74%	0.743	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-8	-174.6	-74.7	-39.2	0	0	0	115.4	R346	D344-R346 VanDerWaalsContact C-N 3.28Å; D344-R346 PolarHBondContact O-N 3.13Å
345	T	41.4	Very low	52.3	Low	134 Å²	134	128 Å²	128	82%	0.822	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	5.4	178.7	9.3	0	0	0	0	114.7
346	R	37.1	Very low	49.4	Very low	239 Å²	239	133.4 Å²	133.4	90%	0.902	69%	0.686	S	S	*	*			trans	-120.4	48.3	179.5	-122.5	-177.7	-166.7	178.2	4.7	113.2	D344	D344-R346 VanDerWaalsContact C-N 3.28Å; D344-R346 PolarHBondContact O-N 3.13Å
347	K	33.4	Very low	46.6	Very low	191 Å²	191	137 Å²	137	83%	0.83	70%	0.695	S	S	*	*			trans	-101.3	94.7	158.5	-83.4	-176.6	177.1	175.8	0	110.2
348	R	33	Very low	43.7	Very low	230 Å²	230	135.6 Å²	135.6	87%	0.868	70%	0.695	S	S	*	*			trans	-60.8	144.2	152.2	-74.6	179.2	178.9	173.7	-1.2	107.8	R350	R348-R350 PolarHBondContact O-N 3.19Å
349	P	38.4	Very low	40.8	Very low	132 Å²	132	142.8 Å²	142.8	86%	0.857	72%	0.724	S	S	*	*			trans	-72.6	116.2	172.5	29.9	-29	0	0	0	107.7
350	R	30.5	Very low	38	Very low	234 Å²	234	147.8 Å²	147.8	88%	0.883	75%	0.749	S	S	*	*			trans	-154.5	121.8	163.1	-152.6	166.1	-177	166.2	0.2	112.1	R348	R348-R350 PolarHBondContact O-N 3.19Å
351	D	29.5	Very low	35.3	Very low	150 Å²	150	154.9 Å²	154.9	80%	0.802	78%	0.777	S	S	*	*			trans	7.3	140	153.6	-96.7	-30.9	0	0	0	120
352	D	32.7	Very low	33.6	Very low	155 Å²	155	157.7 Å²	157.7	83%	0.829	79%	0.785	S	S	*	*			trans	-40.9	129.4	162.6	-79.5	-45	0	0	0	113.5
353	S	30.1	Very low	32.3	Very low	113 Å²	113	160.4 Å²	160.4	79%	0.79	79%	0.785	S	S	*	*				175.7	118.5	126.7	60.8	0	0	0	0	112.1
354	D	29.2	Very low	32.2	Very low	152 Å²	152	156.4 Å²	156.4	81%	0.813	78%	0.777	S	S	*	*			trans	71.1	125.7	132	-125.4	-16.9	0	0	0	124.2
355	S	28.3	Very low	31.3	Very low	85 Å²	85	156.4 Å²	156.4	59%	0.594	78%	0.777	S	S	*	*			trans	14.5	151	151.3	64	0	0	0	0	126.1
356	T	29.9	Very low	30.7	Very low	118 Å²	118	158.1 Å²	158.1	72%	0.724	78%	0.781	S	S	*	*			trans	112	99.4	144	65.7	0	0	0	0	120.7
357	L	31.6	Very low	30.2	Very low	138 Å²	138	150.3 Å²	150.3	72%	0.723	78%	0.775	S	S	*	*				59.8	121	120.3	-63.8	168.3	0	0	0	122.5
358	K	30.5	Very low	30	Very low	162 Å²	162	150 Å²	150	70%	0.704	78%	0.776	S	S	*	*				84.9	110.2	123.6	-80.3	177	177.8	171.8	0	121.4
359	K	29.7	Very low	29.9	Very low	176 Å²	176	145.7 Å²	145.7	77%	0.765	77%	0.77	S	S	*	*				75.5	141.5	112.3	-82.9	-171.7	174.7	-173.7	0	122.3
360	M	27.1	Very low	29.6	Very low	155 Å²	155	146.5 Å²	146.5	76%	0.764	77%	0.767	S	S	*	*			trans	87.2	111.4	143.9	-84.6	161	55.7	0	0	116.8
361	K	26.6	Very low	29.8	Very low	177 Å²	177	144 Å²	144	77%	0.77	77%	0.765	S	S	*	*				81.3	109.3	65.2	-168.6	-165.5	178	-179.6	0	110.7
362	L	27.3	Very low	29.9	Very low	146 Å²	146	144.3 Å²	144.3	76%	0.764	77%	0.767	S	S	*	*				166.8	123.1	114.1	-110.8	110.5	0	0	0	109.6
363	E	23.9	Very low	29.9	Very low	166 Å²	166	146.9 Å²	146.9	78%	0.776	77%	0.771	S	S	*	*			trans	-63	-178.9	147.1	-108.7	-172.8	-163.8	0	0	110.9
364	P	42.4	Very low	30	Very low	92 Å²	92	148.8 Å²	148.8	60%	0.597	77%	0.773	S	S	*	*			cis	-143.7	-174.6	-4	27.1	-1.3	0	0	0	115.2
365	N	23.8	Very low	30	Very low	139 Å²	139	150 Å²	150	74%	0.743	78%	0.778	S	S	*	*			trans	83.1	113.6	131.3	-95.2	12.5	0	0	0	122.3
366	L	29.1	Very low	29.9	Very low	171 Å²	171	154.3 Å²	154.3	90%	0.895	79%	0.789	S	S	*	*				144.2	141.9	111.6	-83.4	158.3	0	0	0	112.5
367	G	27.9	Very low	30.4	Very low	75 Å²	75	153.9 Å²	153.9	77%	0.773	79%	0.788	S	S	*	*			trans	140.4	109.7	154.9	0	0	0	0	0	114
368	E	29	Very low	30	Very low	183 Å²	183	150.9 Å²	150.9	86%	0.855	79%	0.79	S	S	*	*			trans	-76.2	-179.9	-178.9	-68.3	158.9	138	0	0	113.9
369	D	30.3	Very low	30.3	Very low	141 Å²	141	148.7 Å²	148.7	75%	0.754	79%	0.793	S	S	*	*			trans	96.5	96.9	154.2	-66.8	-5.6	0	0	0	120.2
370	D	32.6	Very low	30	Very low	148 Å²	148	146.1 Å²	146.1	79%	0.791	80%	0.797	S	S	*	*				89.1	137.7	107.4	-101.5	-7.9	0	0	0	123.7
371	E	33.3	Very low	29.8	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	79%	0.789	S	S	*	*			trans	84.3	118.3	156.4	-60.4	-157.9	164.2	0	0	123.1
372	D	33.2	Very low	29.8	Very low	157 Å²	157	139.8 Å²	139.8	84%	0.84	79%	0.794	S	S	*	*			trans	-56	147	163	-74.3	-46.7	0	0	0	114.3
373	K	33	Very low	29.7	Very low	209 Å²	209	138.4 Å²	138.4	91%	0.909	80%	0.796	S	S	*	*			trans	-164	124.3	139	-110.7	170.6	-169.3	171.7	0	112
374	D	30.6	Very low	29.8	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	80%	0.803	S	S	*	*			trans	-52.1	150.6	172.1	-65.8	-60.6	0	0	0	114.7
375	L	30.2	Very low	29	Very low	177 Å²	177	140.5 Å²	140.5	93%	0.927	81%	0.811	S	S	*	*				174.3	111.9	126	-88.9	160.8	0	0	0	111.1
376	E	25.6	Very low	29.1	Very low	175 Å²	175	139.3 Å²	139.3	82%	0.818	81%	0.813	S	S	*	*			trans	-55.6	-178.1	158.1	-78.5	-114.5	142.8	0	0	113
377	P	39.9	Very low	29.2	Very low	109 Å²	109	135.2 Å²	135.2	71%	0.708	80%	0.804	S	S	*	*			cis	-139.1	164.6	-35.1	32.3	-12.8	0	0	0	116
378	G	24.4	Very low	29.2	Very low	75 Å²	75	140.7 Å²	140.7	77%	0.773	81%	0.81	S	S	*	*			trans	76.1	169.9	147.9	0	0	0	0	0	120
379	P	35.4	Very low	29.6	Very low	117 Å²	117	139.9 Å²	139.9	76%	0.76	81%	0.81	S	S	*	*			cis	-138.7	172.4	-2.8	40.9	-22.8	0	0	0	116.5
380	S	24.4	Very low	29.8	Very low	121 Å²	121	138.4 Å²	138.4	85%	0.846	81%	0.81	S	S	*	*			trans	67.6	140	149.8	75.3	0	0	0	0	119.2
381	G	23.7	Very low	30.1	Very low	59 Å²	59	135 Å²	135	61%	0.608	81%	0.81	S	S	*	*			cis	172.2	161.9	3.7	0	0	0	0	0	110.3
382	T	25.6	Very low	31.2	Very low	140 Å²	140	132 Å²	132	86%	0.859	80%	0.796	S	S	*	*			trans	67.4	118.7	162.5	64.8	0	0	0	0	116.8
383	S	25.2	Very low	33	Very low	117 Å²	117	126.8 Å²	126.8	82%	0.818	77%	0.772	S	S	*	*				-159.3	138.4	75.7	-61.3	0	0	0	0	113.4
384	K	26.1	Very low	34.9	Very low	209 Å²	209	119.5 Å²	119.5	91%	0.909	74%	0.742	S	S	*	*			trans	-56	161.2	160.8	-60.1	170.9	173.9	177.8	0	109.7
385	A	25.8	Very low	37.1	Very low	93 Å²	93	112.9 Å²	112.9	77%	0.769	71%	0.708	S	S	*	*			cis	-155.8	167.9	21.7	0	0	0	0	0	106.1
386	S	25.5	Very low	39.5	Very low	114 Å²	114	105.9 Å²	105.9	80%	0.797	67%	0.671	S	S	*	*				-171.7	148.2	54.4	47.6	0	0	0	0	110.8
387	A	32.1	Very low	42.2	Very low	86 Å²	86	99 Å²	99	71%	0.711	64%	0.64	S	S	*	*			trans	-63.2	139	178.9	0	0	0	0	0	114.5
388	Q	26.8	Very low	44.2	Very low	190 Å²	190	93.8 Å²	93.8	89%	0.888	61%	0.606	S	S	*	*			trans	-127.3	106.6	144.1	-89.1	-175.5	-61.5	0	0	106.8
389	I	37.9	Very low	47.1	Very low	166 Å²	166	90.7 Å²	90.7	85%	0.851	57%	0.573	S	S	*	*			trans	-98.8	107	169.6	-62.8	171.8	0	0	0	105.9
390	S	34.6	Very low	49.4	Very low	110 Å²	110	90.3 Å²	90.3	77%	0.769	56%	0.561	S	S	*	*			trans	-156.6	111.1	160.5	58.9	0	0	0	0	108.5
391	G	39.6	Very low	52.2	Low	75 Å²	75	89.6 Å²	89.6	77%	0.773	54%	0.543	S	S	*	.			trans	125.6	22.3	161.4	0	0	0	0	0	119.3
392	Q	54.8	Low	55.1	Low	120 Å²	120	87.5 Å²	87.5	56%	0.561	52%	0.518	S	S	*	.			trans	-77	124.4	168.8	-90.2	-177.3	-27.1	0	0	110.2	D396 I397 E400	Q392-D396 HydrophobicContact CB-CB 4.41Å; Q392-D396 HydrophobicContact CG-CB 4.32Å; Q392-I397 HydrophobicContact CB-CG1 4.3Å; Q392-E400 PolarHBondContact NE2-OE2 3.4Å
393	S	72.8	Confident	57.7	Low	47 Å²	47	83.8 Å²	83.8	33%	0.329	49%	0.491	S	S	.	.			trans	-78.3	160.2	176.9	65.7	0	0	0	0	112.2	T395 D396 I397	S393-T395 PolarHBondContact O-N 3.23Å; S393-T395 VanDerWaalsContact O-N 3.14Å; S393-T395 PolarHBondContact OG-OG1 3.42Å; S393-D396 WeakPolarHBondContact CB-OD2 3.09Å; S393-D396 PolarHBondContact N-OD2 2.85Å; S393-D396 WeakPolarHBondContact O-CA 3.45Å; S393-D396 WeakPolarHBondContact O-CB 3.42Å; S393-D396 PolarHBondContact O-N 3.25Å; S393-D396 PolarHBondContact OG-N 2.84Å; S393-D396 PolarHBondContact OG-OD2 3.32Å; S393-I397 PolarHBondContact O-N 3.15Å; S393-I397 VanDerWaalsContact O-N 3.07Å
394	D	72.6	Confident	60.5	Low	55 Å²	55	82.9 Å²	82.9	29%	0.294	48%	0.482	S	S	.	.	H	α-helix	trans	-54.2	-33.5	177.2	-60.4	6	0	0	0	112.4	T398 T458 G465 T469	D394-T398 WeakPolarHBondContact O-CB 3.39Å; D394-T398 PolarHBondContact O-N 3.44Å; D394-T398 PolarHBondContact O-OG1 3.46Å; D394-T458 HydrophobicContact CB-CG2 4.02Å; D394-G465 WeakPolarHBondContact O-CA 3.3Å; D394-T469 PolarHBondContact OD1-OG1 3.05Å; D394-T469 WeakPolarHBondContact OD2-CB 3.44Å; D394-T469 PolarHBondContact OD2-OG1 3.02Å
395	T	76.9	Confident	63	Low	16 Å²	16	76.7 Å²	76.7	10%	0.098	46%	0.458	C	S	.	.	H	α-helix	trans	-73	-35	174.9	48.1	0	0	0	0	111.9	S393 T398 A399 A454 T458	S393-T395 PolarHBondContact O-N 3.23Å; S393-T395 VanDerWaalsContact O-N 3.14Å; S393-T395 PolarHBondContact OG-OG1 3.42Å; T395-T398 PolarHBondContact O-N 2.81Å; T395-A399 WeakPolarHBondContact O-CB 3.47Å; T395-A399 PolarHBondContact O-N 3.25Å; T395-A454 WeakPolarHBondContact O-CB 3.43Å; T395-T458 HydrophobicContact CG2-CG2 3.87Å
396	D	79	Confident	65.7	Low	29 Å²	29	73.5 Å²	73.5	16%	0.155	43%	0.428	C	S	.	.	H	α-helix	trans	-67.2	-44.1	176.5	-64.4	-40.7	0	0	0	112.1	Q392 S393 T398 A399 E400 R451	Q392-D396 HydrophobicContact CB-CB 4.41Å; Q392-D396 HydrophobicContact CG-CB 4.32Å; S393-D396 WeakPolarHBondContact CB-OD2 3.09Å; S393-D396 PolarHBondContact N-OD2 2.85Å; S393-D396 WeakPolarHBondContact O-CA 3.45Å; S393-D396 WeakPolarHBondContact O-CB 3.42Å; S393-D396 PolarHBondContact O-N 3.25Å; S393-D396 PolarHBondContact OG-N 2.84Å; S393-D396 PolarHBondContact OG-OD2 3.32Å; D396-T398 VanDerWaalsContact C-N 3.28Å; D396-T398 PolarHBondContact O-N 3.41Å; D396-A399 PolarHBondContact O-N 3.17Å; D396-E400 WeakPolarHBondContact O-CB 3.49Å; D396-E400 PolarHBondContact O-N 2.93Å; D396-R451 IonicContact OD1-CZ 2.7Å; D396-R451 IonicContact OD1-NE 3.26Å; D396-R451 IonicContact OD1-NH2 3.3Å; D396-R451 PolarHBondContact OD1-NH2 3.35Å
397	I	82.8	Confident	68.3	Low	31 Å²	31	70.6 Å²	70.6	16%	0.159	41%	0.405	C	S	.	.	H	α-helix	trans	-61.4	-42.2	177.3	-61.8	163.7	0	0	0	110	Q392 S393 F401 P464	Q392-I397 HydrophobicContact CB-CG1 4.3Å; S393-I397 PolarHBondContact O-N 3.15Å; S393-I397 VanDerWaalsContact O-N 3.07Å; I397-F401 PolarHBondContact O-N 3.08Å; I397-P464 HydrophobicContact CG2-CB 4.48Å
398	T	83.3	Confident	70.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-71	-35.9	178.3	-54.7	0	0	0	0	111.6	D394 T395 D396 F401 L402 A454 M457 G465	D394-T398 WeakPolarHBondContact O-CB 3.39Å; D394-T398 PolarHBondContact O-N 3.44Å; D394-T398 PolarHBondContact O-OG1 3.46Å; T395-T398 PolarHBondContact O-N 2.81Å; D396-T398 VanDerWaalsContact C-N 3.28Å; D396-T398 PolarHBondContact O-N 3.41Å; T398-F401 PolarHBondContact O-N 2.97Å; T398-L402 HydrophobicContact CG2-CD1 4.32Å; T398-L402 VanDerWaalsContact O-CG 3.31Å; T398-L402 WeakPolarHBondContact O-CG 3.47Å; T398-L402 PolarHBondContact O-N 3.04Å; T398-L402 VanDerWaalsContact O-N 3.11Å; T398-A454 HydrophobicContact CG2-CB 3.87Å; T398-M457 HydrophobicContact CG2-CB 4.43Å; T398-G465 PolarHBondContact OG1-N 3.49Å; T398-G465 VanDerWaalsContact OG1-N 3.11Å
399	A	83.4	Confident	72.7	Confident	9 Å²	9	66.9 Å²	66.9	7%	0.074	38%	0.384	C	S	.	.	H	α-helix	trans	-67.9	-41.9	176.1	0	0	0	0	0	112	T395 D396 F401 L402 Q403 R451 A454	T395-A399 WeakPolarHBondContact O-CB 3.47Å; T395-A399 PolarHBondContact O-N 3.25Å; D396-A399 PolarHBondContact O-N 3.17Å; A399-F401 VanDerWaalsContact C-N 3.28Å; A399-F401 PolarHBondContact O-N 3.41Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.17Å; A399-Q403 PolarHBondContact O-N 2.97Å; A399-R451 HydrophobicContact CB-CB 4.22Å; A399-A454 HydrophobicContact CB-CB 3.72Å
400	E	84.6	Confident	74.6	Confident	110 Å²	110	62.7 Å²	62.7	51%	0.514	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-34.9	177	-169	171	-178.1	0	0	111.5	Q392 D396 P404	Q392-E400 PolarHBondContact NE2-OE2 3.4Å; D396-E400 WeakPolarHBondContact O-CB 3.49Å; D396-E400 PolarHBondContact O-N 2.93Å; E400-P404 WeakPolarHBondContact O-CD 3.46Å
401	F	84.3	Confident	76.7	Confident	106 Å²	106	58 Å²	58	47%	0.465	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-40	171.7	172.1	-100.3	0	0	0	113.4	I397 T398 A399 P404 L405 P464	I397-F401 PolarHBondContact O-N 3.08Å; T398-F401 PolarHBondContact O-N 2.97Å; A399-F401 VanDerWaalsContact C-N 3.28Å; A399-F401 PolarHBondContact O-N 3.41Å; F401-P404 WeakPolarHBondContact O-CD 3.29Å; F401-L405 HydrophobicContact CD1-CD1 4.14Å; F401-L405 HydrophobicContact CE1-CD1 3.6Å; F401-L405 HydrophobicContact CE2-CD1 4.3Å; F401-L405 HydrophobicContact CZ-CD1 3.7Å; F401-P464 HydrophobicContact CB-CG 3.93Å; F401-P464 HydrophobicContact CD1-CG 3.79Å; F401-P464 HydrophobicContact CD2-CG 3.96Å; F401-P464 HydrophobicContact CE1-CG 4.28Å; F401-P464 HydrophobicContact CE2-CG 4.43Å; F401-P464 HydrophobicContact CG-CG 3.61Å
402	L	83.1	Confident	78.3	Confident	15 Å²	15	55.8 Å²	55.8	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-75.8	-32.4	-177.6	-71.6	171.9	0	0	0	112.8	T398 A399 L405 L406 A450 M453 A454 M457	T398-L402 HydrophobicContact CG2-CD1 4.32Å; T398-L402 VanDerWaalsContact O-CG 3.31Å; T398-L402 WeakPolarHBondContact O-CG 3.47Å; T398-L402 PolarHBondContact O-N 3.04Å; T398-L402 VanDerWaalsContact O-N 3.11Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.17Å; L402-L405 WeakPolarHBondContact O-CA 3.37Å; L402-L405 WeakPolarHBondContact O-CB 3.3Å; L402-L405 PolarHBondContact O-N 2.8Å; L402-L406 PolarHBondContact O-N 2.88Å; L402-A450 HydrophobicContact CB-CB 4.16Å; L402-M453 HydrophobicContact CD1-CB 3.8Å; L402-A454 HydrophobicContact CD1-CB 4.07Å; L402-M457 HydrophobicContact CD1-SD 3.73Å; L402-M457 HydrophobicContact CD2-SD 4Å; L402-M457 HydrophobicContact CG-SD 4.4Å
403	Q	81.8	Confident	79.3	Confident	62 Å²	62	54.2 Å²	54.2	29%	0.29	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-51.8	-47.6	-175.2	-163.6	-170.4	-20.1	0	0	114.8	A399 L405 I446 K447 A450	A399-Q403 PolarHBondContact O-N 2.97Å; Q403-L405 VanDerWaalsContact C-N 3.26Å; Q403-L405 PolarHBondContact O-N 2.97Å; Q403-I446 HydrophobicContact CG-CG2 4.43Å; Q403-K447 VanDerWaalsContact CD-CG 3.49Å; Q403-K447 HydrophobicContact CG-CG 4.19Å; Q403-A450 HydrophobicContact CB-CB 4.2Å
404	P	82.6	Confident	79.5	Confident	97 Å²	97	55.4 Å²	55.4	63%	0.63	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-73.7	-14.1	177.2	30	-37	0	0	0	114	E400 F401	E400-P404 WeakPolarHBondContact O-CD 3.46Å; F401-P404 WeakPolarHBondContact O-CD 3.29Å
405	L	79.8	Confident	79.5	Confident	79 Å²	79	53.4 Å²	53.4	41%	0.414	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-87.7	-17.6	-179.2	-62.4	174.3	0	0	0	112.7	F401 L402 Q403 T407 N410	F401-L405 HydrophobicContact CD1-CD1 4.14Å; F401-L405 HydrophobicContact CE1-CD1 3.6Å; F401-L405 HydrophobicContact CE2-CD1 4.3Å; F401-L405 HydrophobicContact CZ-CD1 3.7Å; L402-L405 WeakPolarHBondContact O-CA 3.37Å; L402-L405 WeakPolarHBondContact O-CB 3.3Å; L402-L405 PolarHBondContact O-N 2.8Å; Q403-L405 VanDerWaalsContact C-N 3.26Å; Q403-L405 PolarHBondContact O-N 2.97Å; L405-T407 PolarHBondContact O-N 3.07Å; L405-N410 VanDerWaalsContact O-CB 3.25Å; L405-N410 WeakPolarHBondContact O-CB 3.49Å; L405-N410 PolarHBondContact O-ND2 3.24Å
406	L	81.3	Confident	79.4	Confident	26 Å²	26	57.6 Å²	57.6	14%	0.136	31%	0.314	C	S	.	.			trans	-78.6	52.9	177.5	-65	178	0	0	0	112.5	L402 V411 I446 L449 A450 M453	L402-L406 PolarHBondContact O-N 2.88Å; L406-V411 HydrophobicContact CB-CG2 4.47Å; L406-V411 HydrophobicContact CD2-CG2 4.27Å; L406-I446 HydrophobicContact CB-CG2 4.02Å; L406-I446 HydrophobicContact CD1-CG2 4.19Å; L406-L449 HydrophobicContact CD1-CB 4.3Å; L406-L449 HydrophobicContact CD1-CD2 4.26Å; L406-L449 HydrophobicContact CD1-CG 4.17Å; L406-A450 HydrophobicContact CD1-CB 3.72Å; L406-M453 HydrophobicContact CD2-SD 3.8Å
407	T	80.6	Confident	79.3	Confident	53 Å²	53	62 Å²	62	33%	0.325	34%	0.335	S	S	.	.			trans	-79.2	153.5	170	62.5	0	0	0	0	110.8	L405 D409 N410 V411	L405-T407 PolarHBondContact O-N 3.07Å; T407-D409 PolarHBondContact O-N 3.31Å; T407-N410 PolarHBondContact O-N 2.87Å; T407-N410 VanDerWaalsContact O-N 3.1Å; T407-N410 WeakPolarHBondContact OG1-CB 3.32Å; T407-N410 VanDerWaalsContact OG1-CG 3.3Å; T407-N410 PolarHBondContact OG1-N 3.1Å; T407-N410 PolarHBondContact OG1-ND2 3.14Å; T407-V411 WeakPolarHBondContact O-CB 3.31Å; T407-V411 VanDerWaalsContact O-CG2 3.24Å; T407-V411 WeakPolarHBondContact O-CG2 3.36Å; T407-V411 PolarHBondContact O-N 3.09Å
408	P	75.4	Confident	78.5	Confident	82 Å²	82	60.9 Å²	60.9	53%	0.532	33%	0.331	S	S	.	.	H	α-helix	trans	-51.5	-40.1	177.8	-28	35.4	0	0	0	113.5	A412 L1051	P408-A412 VanDerWaalsContact O-CB 3.25Å; P408-A412 WeakPolarHBondContact O-CB 3.48Å; P408-A412 PolarHBondContact O-N 3.24Å; P408-L1051 HydrophobicContact CB-CD2 4.1Å
409	D	75.8	Confident	78	Confident	117 Å²	117	66 Å²	66	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-67.2	-42.6	177.9	-60.7	-79.7	0	0	0	113.3	T407 A412 N413	T407-D409 PolarHBondContact O-N 3.31Å; D409-A412 PolarHBondContact O-N 3.14Å; D409-N413 WeakPolarHBondContact O-CB 3.34Å; D409-N413 PolarHBondContact O-N 3.41Å; D409-N413 PolarHBondContact O-ND2 3.33Å
410	N	78.9	Confident	77.6	Confident	78 Å²	78	71.5 Å²	71.5	42%	0.417	39%	0.388	S	S	.	.	H	α-helix	trans	-70.5	-40.1	179.4	-73.7	-14.3	0	0	0	111	L405 T407 N413 L414	L405-N410 VanDerWaalsContact O-CB 3.25Å; L405-N410 WeakPolarHBondContact O-CB 3.49Å; L405-N410 PolarHBondContact O-ND2 3.24Å; T407-N410 PolarHBondContact O-N 2.87Å; T407-N410 VanDerWaalsContact O-N 3.1Å; T407-N410 WeakPolarHBondContact OG1-CB 3.32Å; T407-N410 VanDerWaalsContact OG1-CG 3.3Å; T407-N410 PolarHBondContact OG1-N 3.1Å; T407-N410 PolarHBondContact OG1-ND2 3.14Å; N410-N413 PolarHBondContact O-N 3.34Å; N410-L414 WeakPolarHBondContact O-CB 3.44Å; N410-L414 PolarHBondContact O-N 3.28Å
411	V	76.6	Confident	76.8	Confident	11 Å²	11	74.5 Å²	74.5	7%	0.067	40%	0.396	C	S	.	.	H	α-helix	trans	-59.4	-48.4	173.1	163.3	0	0	0	0	110	L406 T407 N413 L414 V415 L1047 L1051	L406-V411 HydrophobicContact CB-CG2 4.47Å; L406-V411 HydrophobicContact CD2-CG2 4.27Å; T407-V411 WeakPolarHBondContact O-CB 3.31Å; T407-V411 VanDerWaalsContact O-CG2 3.24Å; T407-V411 WeakPolarHBondContact O-CG2 3.36Å; T407-V411 PolarHBondContact O-N 3.09Å; V411-N413 PolarHBondContact O-N 3.38Å; V411-L414 PolarHBondContact O-N 3.36Å; V411-V415 VanDerWaalsContact O-CG2 3.31Å; V411-V415 WeakPolarHBondContact O-CG2 3.3Å; V411-V415 PolarHBondContact O-N 3.07Å; V411-L1047 HydrophobicContact CB-CD2 3.99Å; V411-L1047 HydrophobicContact CG1-CB 4.04Å; V411-L1047 HydrophobicContact CG1-CD2 3.51Å; V411-L1047 HydrophobicContact CG1-CG 3.73Å; V411-L1047 HydrophobicContact CG2-CD2 4.06Å; V411-L1051 HydrophobicContact CG1-CD1 4.15Å
412	A	73.8	Confident	76	Confident	28 Å²	28	72.3 Å²	72.3	23%	0.231	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-45.4	176.8	0	0	0	0	0	112	P408 D409 L414 V415 L416 L1051	P408-A412 VanDerWaalsContact O-CB 3.25Å; P408-A412 WeakPolarHBondContact O-CB 3.48Å; P408-A412 PolarHBondContact O-N 3.24Å; D409-A412 PolarHBondContact O-N 3.14Å; A412-L414 PolarHBondContact O-N 2.92Å; A412-V415 PolarHBondContact O-N 2.66Å; A412-L416 WeakPolarHBondContact O-CB 3.23Å; A412-L416 VanDerWaalsContact O-CG 3.27Å; A412-L416 WeakPolarHBondContact O-CG 3.3Å; A412-L416 PolarHBondContact O-N 3.24Å; A412-L1051 HydrophobicContact CB-CD1 3.73Å
413	N	76.4	Confident	75.3	Confident	87 Å²	87	74.8 Å²	74.8	47%	0.465	41%	0.406	S	S	.	.	H	α-helix	trans	-63.7	-40.5	176.7	-77.7	-51.1	0	0	0	112.4	D409 N410 V411 V415 L416 I417	D409-N413 WeakPolarHBondContact O-CB 3.34Å; D409-N413 PolarHBondContact O-N 3.41Å; D409-N413 PolarHBondContact O-ND2 3.33Å; N410-N413 PolarHBondContact O-N 3.34Å; V411-N413 PolarHBondContact O-N 3.38Å; N413-V415 VanDerWaalsContact C-N 3.33Å; N413-L416 PolarHBondContact O-N 3.21Å; N413-I417 WeakPolarHBondContact O-CD1 3.35Å; N413-I417 VanDerWaalsContact O-CG1 3.24Å; N413-I417 WeakPolarHBondContact O-CG1 3.24Å; N413-I417 PolarHBondContact O-N 2.99Å
414	L	76.8	Confident	74.9	Confident	72 Å²	72	82 Å²	82	38%	0.377	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175.9	-162.4	102.3	0	0	0	110.9	N410 V411 A412 I417 S418 F1044 L1047	N410-L414 WeakPolarHBondContact O-CB 3.44Å; N410-L414 PolarHBondContact O-N 3.28Å; V411-L414 PolarHBondContact O-N 3.36Å; A412-L414 PolarHBondContact O-N 2.92Å; L414-I417 PolarHBondContact O-N 3.49Å; L414-S418 WeakPolarHBondContact O-CB 3.47Å; L414-S418 PolarHBondContact O-N 3.43Å; L414-S418 PolarHBondContact O-OG 2.61Å; L414-F1044 HydrophobicContact CD2-CE1 3.92Å; L414-F1044 HydrophobicContact CG-CE1 4.37Å; L414-L1047 HydrophobicContact CD2-CD2 3.8Å
415	V	72.5	Confident	74	Confident	13 Å²	13	81 Å²	81	8%	0.079	44%	0.44	C	S	.	.	H	α-helix	trans	-62	-48.6	175.3	170.8	0	0	0	0	110.5	V411 A412 N413 I417 S418 M419 L1047 M1048	V411-V415 VanDerWaalsContact O-CG2 3.31Å; V411-V415 WeakPolarHBondContact O-CG2 3.3Å; V411-V415 PolarHBondContact O-N 3.07Å; A412-V415 PolarHBondContact O-N 2.66Å; N413-V415 VanDerWaalsContact C-N 3.33Å; V415-I417 VanDerWaalsContact C-N 3.34Å; V415-I417 PolarHBondContact O-N 3.06Å; V415-S418 WeakPolarHBondContact CA-OG 3.46Å; V415-S418 CarbonylContact O-C 3.59Å; V415-S418 WeakPolarHBondContact O-CA 3.33Å; V415-S418 PolarHBondContact O-N 3.3Å; V415-S418 PolarHBondContact O-OG 3.26Å; V415-M419 WeakPolarHBondContact O-CG 3.44Å; V415-M419 PolarHBondContact O-N 3.44Å; V415-L1047 HydrophobicContact CG2-CB 3.77Å; V415-L1047 HydrophobicContact CG2-CD2 4.05Å; V415-M1048 HydrophobicContact CG1-CG 3.75Å; V415-M1048 HydrophobicContact CG1-SD 4.21Å; V415-M1048 HydrophobicContact CG2-CG 4.31Å
416	L	74.9	Confident	73.2	Confident	105 Å²	105	83 Å²	83	55%	0.55	45%	0.448	S	S	.	.	H	α-helix	trans	-58.7	-42.7	179.1	-74.4	167.7	0	0	0	112.5	A412 N413 S418 M419	A412-L416 WeakPolarHBondContact O-CB 3.23Å; A412-L416 VanDerWaalsContact O-CG 3.27Å; A412-L416 WeakPolarHBondContact O-CG 3.3Å; A412-L416 PolarHBondContact O-N 3.24Å; N413-L416 PolarHBondContact O-N 3.21Å; L416-S418 VanDerWaalsContact C-N 3.27Å; L416-S418 PolarHBondContact O-N 2.92Å; L416-M419 HydrophobicContact CD2-SD 4.23Å; L416-M419 PolarHBondContact O-N 3.39Å
417	I	76.4	Confident	72.8	Confident	120 Å²	120	84.2 Å²	84.2	62%	0.615	46%	0.457	S	S	*	.	H	α-helix	trans	-64.3	-36.3	175.5	-68	164.7	0	0	0	110.8	N413 L414 V415	N413-I417 WeakPolarHBondContact O-CD1 3.35Å; N413-I417 VanDerWaalsContact O-CG1 3.24Å; N413-I417 WeakPolarHBondContact O-CG1 3.24Å; N413-I417 PolarHBondContact O-N 2.99Å; L414-I417 PolarHBondContact O-N 3.49Å; V415-I417 VanDerWaalsContact C-N 3.34Å; V415-I417 PolarHBondContact O-N 3.06Å
418	S	66.9	Low	71.7	Confident	8 Å²	8	85.2 Å²	85.2	6%	0.056	47%	0.472	C	S	.	.	H	α-helix	trans	-78.2	-18.6	-179.2	74.1	0	0	0	0	114.6	L414 V415 L416 V420 Y421 L422 F1044	L414-S418 WeakPolarHBondContact O-CB 3.47Å; L414-S418 PolarHBondContact O-N 3.43Å; L414-S418 PolarHBondContact O-OG 2.61Å; V415-S418 WeakPolarHBondContact CA-OG 3.46Å; V415-S418 CarbonylContact O-C 3.59Å; V415-S418 WeakPolarHBondContact O-CA 3.33Å; V415-S418 PolarHBondContact O-N 3.3Å; V415-S418 PolarHBondContact O-OG 3.26Å; L416-S418 VanDerWaalsContact C-N 3.27Å; L416-S418 PolarHBondContact O-N 2.92Å; S418-V420 PolarHBondContact O-N 3.02Å; S418-V420 VanDerWaalsContact O-N 3.12Å; S418-Y421 PolarHBondContact O-N 3.48Å; S418-L422 PolarHBondContact O-N 2.88Å; S418-F1044 WeakPolarHBondContact OG-CD1 3.28Å
419	M	72.9	Confident	70.5	Confident	108 Å²	108	84.8 Å²	84.8	53%	0.532	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.8	-179.2	-74.7	-167.5	75.1	0	0	112.8	V415 L416 Y421 L422	V415-M419 WeakPolarHBondContact O-CG 3.44Å; V415-M419 PolarHBondContact O-N 3.44Å; L416-M419 HydrophobicContact CD2-SD 4.23Å; L416-M419 PolarHBondContact O-N 3.39Å; M419-Y421 PolarHBondContact O-N 3.39Å; M419-L422 PolarHBondContact O-N 3.42Å
420	V	74.4	Confident	69.5	Low	125 Å²	125	80.9 Å²	80.9	76%	0.758	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.7	177.8	-170.4	0	0	0	0	112.3	S418	S418-V420 PolarHBondContact O-N 3.02Å; S418-V420 VanDerWaalsContact O-N 3.12Å
421	Y	67.1	Low	68.3	Low	172 Å²	172	83.8 Å²	83.8	68%	0.675	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-101.8	-0.3	-178.8	-59.7	-80.9	0	0	0	113.4	S418 M419	S418-Y421 PolarHBondContact O-N 3.48Å; M419-Y421 PolarHBondContact O-N 3.39Å
422	L	67.6	Low	66.9	Low	60 Å²	60	85.8 Å²	85.8	31%	0.314	48%	0.477	S	S	.	.	S	Bend	trans	-83.5	142.4	177.2	-68.2	175.5	0	0	0	110.6	S418 M419	S418-L422 PolarHBondContact O-N 2.88Å; M419-L422 PolarHBondContact O-N 3.42Å
423	P	69.4	Low	65.5	Low	68 Å²	68	89.5 Å²	89.5	44%	0.442	49%	0.492	S	S	.	.			trans	-65.7	145	173.3	27	-32.4	0	0	0	110.8	A425 P427	P423-A425 PolarHBondContact O-N 3.4Å; P423-A425 VanDerWaalsContact O-N 3.11Å; P423-P427 HydrophobicContact CG-CG 3.83Å
424	E	73.4	Confident	64.1	Low	214 Å²	214	88.9 Å²	88.9	100%	1	48%	0.483	S	S	*	.	S	Bend	trans	-61.4	-19.6	179.7	-68.7	-175.5	166.3	0	0	113.6
425	A	62.6	Low	63	Low	75 Å²	75	89.6 Å²	89.6	62%	0.62	49%	0.491	S	S	*	.	S	Bend	trans	-125.8	139.4	176.3	0	0	0	0	0	111.1	P423 P427	P423-A425 PolarHBondContact O-N 3.4Å; P423-A425 VanDerWaalsContact O-N 3.11Å; A425-P427 WeakPolarHBondContact O-CD 3.35Å
426	M	63.9	Low	61.7	Low	121 Å²	121	93.1 Å²	93.1	60%	0.596	51%	0.514	S	S	*	.			trans	-60.1	122.2	179.2	-173.2	176.4	-63.2	0	0	110.8	A428 F430 Q431	M426-A428 PolarHBondContact O-N 3.02Å; M426-F430 HydrophobicContact CG-CD1 4.25Å; M426-F430 HydrophobicContact SD-CD1 4.34Å; M426-Q431 HydrophobicContact CG-CB 4.45Å; M426-Q431 HydrophobicContact SD-CB 3.98Å; M426-Q431 HydrophobicContact SD-CG 4.08Å
427	P	72.1	Confident	60.8	Low	51 Å²	51	92.5 Å²	92.5	33%	0.331	51%	0.514	S	S	.	.			trans	-63.3	133.1	178.4	-23.8	34.6	0	0	0	111.6	P423 A425 S429 F430 Q431	P423-P427 HydrophobicContact CG-CG 3.83Å; A425-P427 WeakPolarHBondContact O-CD 3.35Å; P427-S429 PolarHBondContact O-N 3.05Å; P427-S429 VanDerWaalsContact O-N 3.12Å; P427-F430 HydrophobicContact CB-CB 4.29Å; P427-F430 WeakPolarHBondContact O-CB 3.21Å; P427-F430 PolarHBondContact O-N 3.32Å; P427-Q431 PolarHBondContact O-N 3.19Å; P427-Q431 VanDerWaalsContact O-N 3.16Å
428	A	57.8	Low	59.3	Low	75 Å²	75	96.2 Å²	96.2	62%	0.62	53%	0.529	S	S	*	.	H	α-helix	trans	-60.3	-24.4	179.6	0	0	0	0	0	113.5	M426 A432	M426-A428 PolarHBondContact O-N 3.02Å; A428-A432 WeakPolarHBondContact O-CB 3.11Å; A428-A432 PolarHBondContact O-N 3.11Å
429	S	50	Low	58.8	Low	73 Å²	73	99.3 Å²	99.3	51%	0.51	55%	0.551	S	S	.	*	H	α-helix	trans	-68.1	-44.5	171.6	50.4	0	0	0	0	111.7	P427 A432 I433	P427-S429 PolarHBondContact O-N 3.05Å; P427-S429 VanDerWaalsContact O-N 3.12Å; S429-A432 PolarHBondContact O-N 3.13Å; S429-I433 WeakPolarHBondContact O-CD1 3.28Å; S429-I433 WeakPolarHBondContact O-CG1 3.47Å; S429-I433 PolarHBondContact O-N 3.42Å
430	F	54.3	Low	58	Low	35 Å²	35	96.4 Å²	96.4	15%	0.154	54%	0.544	C	S	.	.	H	α-helix	trans	-65.8	-48	-179.5	-178.6	-90.8	0	0	0	111.6	M426 P427 A432 I433 Y434 L1045	M426-F430 HydrophobicContact CG-CD1 4.25Å; M426-F430 HydrophobicContact SD-CD1 4.34Å; P427-F430 HydrophobicContact CB-CB 4.29Å; P427-F430 WeakPolarHBondContact O-CB 3.21Å; P427-F430 PolarHBondContact O-N 3.32Å; F430-A432 PolarHBondContact O-N 3.47Å; F430-A432 VanDerWaalsContact O-N 3.14Å; F430-I433 PolarHBondContact O-N 3.26Å; F430-I433 VanDerWaalsContact O-N 3.08Å; F430-Y434 AromaticContact CE1-CD2 3.99Å; F430-Y434 HydrophobicContact CE1-CD2 3.99Å; F430-Y434 HydrophobicContact CE1-CG 4.24Å; F430-Y434 AromaticContact CZ-CD2 3.71Å; F430-Y434 HydrophobicContact CZ-CD2 3.71Å; F430-Y434 HydrophobicContact CZ-CG 4.35Å; F430-Y434 WeakPolarHBondContact O-CB 3.29Å; F430-Y434 PolarHBondContact O-N 3.02Å; F430-L1045 HydrophobicContact CD1-CD1 4.07Å; F430-L1045 HydrophobicContact CD1-CD2 4.21Å; F430-L1045 HydrophobicContact CD2-CD1 3.94Å; F430-L1045 HydrophobicContact CE1-CB 4.12Å; F430-L1045 HydrophobicContact CE1-CD1 3.73Å; F430-L1045 HydrophobicContact CE1-CD2 3.27Å; F430-L1045 HydrophobicContact CE1-CG 3.84Å; F430-L1045 HydrophobicContact CE2-CB 3.59Å; F430-L1045 HydrophobicContact CE2-CD1 3.56Å; F430-L1045 HydrophobicContact CE2-CD2 4.29Å; F430-L1045 HydrophobicContact CE2-CG 3.95Å; F430-L1045 HydrophobicContact CG-CD1 4.2Å; F430-L1045 HydrophobicContact CZ-CB 3.24Å; F430-L1045 HydrophobicContact CZ-CD1 3.48Å; F430-L1045 VanDerWaalsContact CZ-CD1 3.48Å; F430-L1045 HydrophobicContact CZ-CD2 3.34Å; F430-L1045 HydrophobicContact CZ-CG 3.46Å; F430-L1045 VanDerWaalsContact CZ-CG 3.46Å
431	Q	55.2	Low	57.3	Low	138 Å²	138	92.3 Å²	92.3	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-58.3	-29.8	177.8	-165.4	-179.5	20.3	0	0	112.7	M426 P427	M426-Q431 HydrophobicContact CG-CB 4.45Å; M426-Q431 HydrophobicContact SD-CB 3.98Å; M426-Q431 HydrophobicContact SD-CG 4.08Å; P427-Q431 PolarHBondContact O-N 3.19Å; P427-Q431 VanDerWaalsContact O-N 3.16Å
432	A	47.2	Very low	57.5	Low	54 Å²	54	87.2 Å²	87.2	45%	0.446	51%	0.513	S	S	.	.	H	α-helix	trans	-84	-17.3	-179.6	0	0	0	0	0	114.5	A428 S429 F430	A428-A432 WeakPolarHBondContact O-CB 3.11Å; A428-A432 PolarHBondContact O-N 3.11Å; S429-A432 PolarHBondContact O-N 3.13Å; F430-A432 PolarHBondContact O-N 3.47Å; F430-A432 VanDerWaalsContact O-N 3.14Å
433	I	44.1	Very low	57.7	Low	105 Å²	105	90.3 Å²	90.3	54%	0.538	53%	0.526	S	S	.	.	H	α-helix	trans	-104.3	-20.7	-177.8	-57	160.6	0	0	0	110.9	S429 F430 T435	S429-I433 WeakPolarHBondContact O-CD1 3.28Å; S429-I433 WeakPolarHBondContact O-CG1 3.47Å; S429-I433 PolarHBondContact O-N 3.42Å; F430-I433 PolarHBondContact O-N 3.26Å; F430-I433 VanDerWaalsContact O-N 3.08Å; I433-T435 PolarHBondContact O-N 3.27Å; I433-T435 PolarHBondContact O-OG1 3.35Å
434	Y	47.4	Very low	57.5	Low	75 Å²	75	90.5 Å²	90.5	29%	0.294	53%	0.533	S	S	.	.			trans	-60.1	119.5	-177.7	-176.9	-107.6	0	0	0	112.2	F430 P436 Y1049	F430-Y434 AromaticContact CE1-CD2 3.99Å; F430-Y434 HydrophobicContact CE1-CD2 3.99Å; F430-Y434 HydrophobicContact CE1-CG 4.24Å; F430-Y434 AromaticContact CZ-CD2 3.71Å; F430-Y434 HydrophobicContact CZ-CD2 3.71Å; F430-Y434 HydrophobicContact CZ-CG 4.35Å; F430-Y434 WeakPolarHBondContact O-CB 3.29Å; F430-Y434 PolarHBondContact O-N 3.02Å; Y434-P436 HydrophobicContact CE1-CB 4.41Å; Y434-P436 HydrophobicContact CE1-CG 4Å; Y434-Y1049 HydrophobicContact CE1-CE2 4.48Å; Y434-Y1049 HydrophobicContact CE2-CE2 4.46Å; Y434-Y1049 AromaticContact CZ-CE2 3.76Å; Y434-Y1049 WeakPolarHBondContact OH-CD2 3.4Å; Y434-Y1049 WeakPolarHBondContact OH-CE2 3.37Å; Y434-Y1049 VanDerWaalsContact OH-CZ 3.29Å
435	T	52.3	Low	57.3	Low	86 Å²	86	82.7 Å²	82.7	53%	0.528	50%	0.497	S	S	.	.			trans	-115	118.3	171.9	-38.6	0	0	0	0	107.4	I433 V437	I433-T435 PolarHBondContact O-N 3.27Å; I433-T435 PolarHBondContact O-OG1 3.35Å; T435-V437 PolarHBondContact O-N 3.46Å
436	P	46.5	Very low	58	Low	88 Å²	88	81.3 Å²	81.3	57%	0.571	48%	0.479	S	S	*	.			trans	-61.1	132	179.5	-19.5	30	0	0	0	110.9	Y434 E438	Y434-P436 HydrophobicContact CE1-CB 4.41Å; Y434-P436 HydrophobicContact CE1-CG 4Å; P436-E438 PolarHBondContact O-N 3.4Å
437	V	54.7	Low	58.6	Low	92 Å²	92	80.1 Å²	80.1	56%	0.558	47%	0.47	S	S	*	.			trans	-83.1	109.4	173.6	-177.6	0	0	0	0	107.9	T435 S439	T435-V437 PolarHBondContact O-N 3.46Å; V437-S439 PolarHBondContact O-N 3.45Å
438	E	46.3	Very low	58.5	Low	198 Å²	198	79.5 Å²	79.5	93%	0.925	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.4	-174.4	-71.3	-178.4	160.2	0	0	114.5	P436	P436-E438 PolarHBondContact O-N 3.4Å
439	S	55.9	Low	59.4	Low	73 Å²	73	77.2 Å²	77.2	51%	0.51	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.2	59.7	-176.4	50.2	0	0	0	0	113.3	V437 Q445	V437-S439 PolarHBondContact O-N 3.45Å; S439-Q445 PolarHBondContact O-NE2 2.91Å; S439-Q445 PolarHBondContact O-OE1 3.21Å
440	A	56.6	Low	60.9	Low	47 Å²	47	73.8 Å²	73.8	39%	0.388	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	139.5	178.9	0	0	0	0	0	112.9	Q445 L1050	A440-Q445 VanDerWaalsContact C-OE1 3.31Å; A440-L1050 HydrophobicContact CB-CD1 4.15Å; A440-L1050 HydrophobicContact CB-CG 4.31Å
441	G	59.3	Low	62.1	Low	38 Å²	38	75.6 Å²	75.6	39%	0.392	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	109	5.1	171.6	0	0	0	0	0	116.6
442	T	71.8	Confident	63	Low	65 Å²	65	71.8 Å²	71.8	40%	0.399	41%	0.406	S	S	.	.			trans	-73.9	150.6	176.2	60.7	0	0	0	0	112	A444 Q445 I446	T442-A444 PolarHBondContact O-N 3.42Å; T442-A444 VanDerWaalsContact O-N 3.15Å; T442-Q445 WeakPolarHBondContact O-CB 3.43Å; T442-Q445 PolarHBondContact O-N 3.37Å; T442-Q445 VanDerWaalsContact OG1-CD 3.25Å; T442-Q445 VanDerWaalsContact OG1-CG 3.28Å; T442-Q445 WeakPolarHBondContact OG1-CG 3.27Å; T442-Q445 PolarHBondContact OG1-N 3.41Å; T442-Q445 PolarHBondContact OG1-OE1 3.49Å; T442-I446 PolarHBondContact O-N 3.37Å
443	E	70.2	Confident	64.4	Low	126 Å²	126	70.3 Å²	70.3	59%	0.589	39%	0.39	S	S	*	.	H	α-helix	trans	-56.8	-32.9	177.6	-163.1	-166.6	147	0	0	112.2	I446 K447	E443-I446 PolarHBondContact O-N 2.92Å; E443-K447 WeakPolarHBondContact O-CG 3.37Å; E443-K447 PolarHBondContact O-N 3.04Å; E443-K447 VanDerWaalsContact OE1-CE 3.26Å; E443-K447 WeakPolarHBondContact OE1-CE 3.27Å; E443-K447 IonicContact OE1-NZ 3.78Å; E443-K447 PolarHBondContact OE1-NZ 3.1Å
444	A	65.7	Low	66.2	Low	71 Å²	71	65.3 Å²	65.3	59%	0.587	36%	0.364	S	S	*	.	H	α-helix	trans	-64.7	-38.5	174.8	0	0	0	0	0	112.7	T442 H448	T442-A444 PolarHBondContact O-N 3.42Å; T442-A444 VanDerWaalsContact O-N 3.15Å; A444-H448 WeakPolarHBondContact O-CB 3.41Å; A444-H448 PolarHBondContact O-N 3.23Å
445	Q	69	Low	67.5	Low	50 Å²	50	62.7 Å²	62.7	23%	0.234	36%	0.356	C	S	.	.	H	α-helix	trans	-73.7	-36.1	176.4	-74.7	165.9	-8.7	0	0	112.5	S439 A440 T442 K447 H448 L449	S439-Q445 PolarHBondContact O-NE2 2.91Å; S439-Q445 PolarHBondContact O-OE1 3.21Å; A440-Q445 VanDerWaalsContact C-OE1 3.31Å; T442-Q445 WeakPolarHBondContact O-CB 3.43Å; T442-Q445 PolarHBondContact O-N 3.37Å; T442-Q445 VanDerWaalsContact OG1-CD 3.25Å; T442-Q445 VanDerWaalsContact OG1-CG 3.28Å; T442-Q445 WeakPolarHBondContact OG1-CG 3.27Å; T442-Q445 PolarHBondContact OG1-N 3.41Å; T442-Q445 PolarHBondContact OG1-OE1 3.49Å; Q445-K447 VanDerWaalsContact C-N 3.3Å; Q445-K447 PolarHBondContact O-N 3.4Å; Q445-H448 PolarHBondContact O-N 2.94Å; Q445-L449 WeakPolarHBondContact O-CB 3.28Å; Q445-L449 PolarHBondContact O-N 3.28Å
446	I	76.8	Confident	68.6	Low	47 Å²	47	60.8 Å²	60.8	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-43.2	173.8	-62.8	171.8	0	0	0	109.7	Q403 L406 T442 E443 H448 L449 A450	Q403-I446 HydrophobicContact CG-CG2 4.43Å; L406-I446 HydrophobicContact CB-CG2 4.02Å; L406-I446 HydrophobicContact CD1-CG2 4.19Å; T442-I446 PolarHBondContact O-N 3.37Å; E443-I446 PolarHBondContact O-N 2.92Å; I446-H448 PolarHBondContact O-N 3.43Å; I446-L449 PolarHBondContact O-N 3.49Å; I446-A450 WeakPolarHBondContact O-CB 3.21Å; I446-A450 PolarHBondContact O-N 3.43Å
447	K	76.8	Confident	70	Confident	95 Å²	95	59.3 Å²	59.3	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-60	-43	172.4	-76.5	172.6	-175.1	165.6	0	112.3	Q403 E443 Q445 R451	Q403-K447 VanDerWaalsContact CD-CG 3.49Å; Q403-K447 HydrophobicContact CG-CG 4.19Å; E443-K447 WeakPolarHBondContact O-CG 3.37Å; E443-K447 PolarHBondContact O-N 3.04Å; E443-K447 VanDerWaalsContact OE1-CE 3.26Å; E443-K447 WeakPolarHBondContact OE1-CE 3.27Å; E443-K447 IonicContact OE1-NZ 3.78Å; E443-K447 PolarHBondContact OE1-NZ 3.1Å; Q445-K447 VanDerWaalsContact C-N 3.3Å; Q445-K447 PolarHBondContact O-N 3.4Å; K447-R451 PolarHBondContact O-N 3.42Å
448	H	69.8	Low	71.2	Confident	39 Å²	39	56.2 Å²	56.2	18%	0.181	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-45.6	178.5	-177.5	62	0	0	0	112.4	T323 D327 A444 Q445 I446 A450 R451 L452	T323-H448 HydrophobicContact CG2-CB 4.2Å; T323-H448 VanDerWaalsContact CG2-ND1 3.26Å; T323-H448 WeakPolarHBondContact CG2-ND1 3.08Å; D327-H448 IonicContact OD2-CE1 2.76Å; D327-H448 IonicContact OD2-NE2 3.59Å; D327-H448 PolarHBondContact OD2-NE2 3.05Å; A444-H448 WeakPolarHBondContact O-CB 3.41Å; A444-H448 PolarHBondContact O-N 3.23Å; Q445-H448 PolarHBondContact O-N 2.94Å; I446-H448 PolarHBondContact O-N 3.43Å; H448-A450 VanDerWaalsContact C-N 3.35Å; H448-A450 PolarHBondContact O-N 3.06Å; H448-R451 PolarHBondContact O-N 3.19Å; H448-R451 VanDerWaalsContact O-N 3.12Å; H448-L452 WeakPolarHBondContact NE2-CD1 3.37Å; H448-L452 PolarHBondContact O-N 3.19Å
449	L	77.8	Confident	72.3	Confident	26 Å²	26	50.8 Å²	50.8	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-43.6	176.2	-178.6	62.2	0	0	0	111.4	L406 Q445 I446 R451 L452 M453 L1047	L406-L449 HydrophobicContact CD1-CB 4.3Å; L406-L449 HydrophobicContact CD1-CD2 4.26Å; L406-L449 HydrophobicContact CD1-CG 4.17Å; Q445-L449 WeakPolarHBondContact O-CB 3.28Å; Q445-L449 PolarHBondContact O-N 3.28Å; I446-L449 PolarHBondContact O-N 3.49Å; L449-R451 VanDerWaalsContact C-N 3.27Å; L449-R451 PolarHBondContact O-N 3.34Å; L449-L452 PolarHBondContact O-N 3.36Å; L449-M453 HydrophobicContact CD1-CG 4.45Å; L449-M453 HydrophobicContact CG-SD 4.38Å; L449-M453 WeakPolarHBondContact O-CG 3.31Å; L449-M453 PolarHBondContact O-N 2.83Å; L449-L1047 HydrophobicContact CD1-CD1 3.97Å; L449-L1047 HydrophobicContact CD2-CD1 3.81Å; L449-L1047 HydrophobicContact CD2-CG 4.3Å; L449-L1047 HydrophobicContact CG-CD1 4.38Å
450	A	82.4	Confident	73.1	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-41.3	173.8	0	0	0	0	0	111.7	L402 Q403 L406 I446 H448 A454	L402-A450 HydrophobicContact CB-CB 4.16Å; Q403-A450 HydrophobicContact CB-CB 4.2Å; L406-A450 HydrophobicContact CD1-CB 3.72Å; I446-A450 WeakPolarHBondContact O-CB 3.21Å; I446-A450 PolarHBondContact O-N 3.43Å; H448-A450 VanDerWaalsContact C-N 3.35Å; H448-A450 PolarHBondContact O-N 3.06Å; A450-A454 WeakPolarHBondContact O-CB 3.2Å; A450-A454 PolarHBondContact O-N 3.06Å
451	R	78.3	Confident	73.9	Confident	74 Å²	74	50 Å²	50	28%	0.279	30%	0.298	S	S	.	.	H	α-helix	trans	-69.1	-41.4	176.9	-174.5	169.3	-86.6	162.7	-6.5	112.7	D396 A399 K447 H448 L449 M453 A454 T455	D396-R451 IonicContact OD1-CZ 2.7Å; D396-R451 IonicContact OD1-NE 3.26Å; D396-R451 IonicContact OD1-NH2 3.3Å; D396-R451 PolarHBondContact OD1-NH2 3.35Å; A399-R451 HydrophobicContact CB-CB 4.22Å; K447-R451 PolarHBondContact O-N 3.42Å; H448-R451 PolarHBondContact O-N 3.19Å; H448-R451 VanDerWaalsContact O-N 3.12Å; L449-R451 VanDerWaalsContact C-N 3.27Å; L449-R451 PolarHBondContact O-N 3.34Å; R451-M453 PolarHBondContact O-N 3.06Å; R451-A454 PolarHBondContact O-N 3.36Å; R451-T455 PolarHBondContact O-N 2.85Å; R451-T455 PolarHBondContact O-OG1 3.06Å; R451-T455 VanDerWaalsContact O-OG1 3.05Å
452	L	73.7	Confident	74.6	Confident	57 Å²	57	53 Å²	53	30%	0.298	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-45	174.5	-72.6	178.2	0	0	0	111.9	A283 H448 L449 T455 Q456	A283-L452 HydrophobicContact CB-CD2 4.42Å; H448-L452 WeakPolarHBondContact NE2-CD1 3.37Å; H448-L452 PolarHBondContact O-N 3.19Å; L449-L452 PolarHBondContact O-N 3.36Å; L452-T455 PolarHBondContact O-N 3.24Å; L452-Q456 VanDerWaalsContact O-CG 3.29Å; L452-Q456 WeakPolarHBondContact O-CG 3.49Å; L452-Q456 PolarHBondContact O-N 3.36Å
453	M	77.4	Confident	74.9	Confident	24 Å²	24	50.5 Å²	50.5	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-42.7	175.4	-68.3	-175.1	72.3	0	0	111.2	L402 L406 L449 R451 Q456 M457 L1043	L402-M453 HydrophobicContact CD1-CB 3.8Å; L406-M453 HydrophobicContact CD2-SD 3.8Å; L449-M453 HydrophobicContact CD1-CG 4.45Å; L449-M453 HydrophobicContact CG-SD 4.38Å; L449-M453 WeakPolarHBondContact O-CG 3.31Å; L449-M453 PolarHBondContact O-N 2.83Å; R451-M453 PolarHBondContact O-N 3.06Å; M453-Q456 PolarHBondContact O-N 3.15Å; M453-M457 WeakPolarHBondContact O-CB 3.23Å; M453-M457 VanDerWaalsContact O-CG 3.28Å; M453-M457 WeakPolarHBondContact O-CG 3.34Å; M453-M457 PolarHBondContact O-N 3.41Å; M453-L1043 HydrophobicContact CE-CD2 4.46Å; M453-L1043 HydrophobicContact CG-CD2 3.81Å
454	A	82	Confident	75.2	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-44.5	176.9	0	0	0	0	0	112.5	T395 T398 A399 L402 A450 R451 Q456 M457 T458	T395-A454 WeakPolarHBondContact O-CB 3.43Å; T398-A454 HydrophobicContact CG2-CB 3.87Å; A399-A454 HydrophobicContact CB-CB 3.72Å; L402-A454 HydrophobicContact CD1-CB 4.07Å; A450-A454 WeakPolarHBondContact O-CB 3.2Å; A450-A454 PolarHBondContact O-N 3.06Å; R451-A454 PolarHBondContact O-N 3.36Å; A454-Q456 VanDerWaalsContact C-N 3.26Å; A454-Q456 PolarHBondContact O-N 3.13Å; A454-M457 PolarHBondContact O-N 3.21Å; A454-T458 VanDerWaalsContact O-CB 3.25Å; A454-T458 WeakPolarHBondContact O-CB 3.29Å; A454-T458 PolarHBondContact O-N 3.14Å; A454-T458 PolarHBondContact O-OG1 3.31Å
455	T	74.6	Confident	75.8	Confident	19 Å²	19	42.7 Å²	42.7	12%	0.117	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-41.7	176.5	-61.9	0	0	0	0	111.4	R451 L452 A459	R451-T455 PolarHBondContact O-N 2.85Å; R451-T455 PolarHBondContact O-OG1 3.06Å; R451-T455 VanDerWaalsContact O-OG1 3.05Å; L452-T455 PolarHBondContact O-N 3.24Å; T455-A459 VanDerWaalsContact O-CB 3.23Å; T455-A459 WeakPolarHBondContact O-CB 3.17Å; T455-A459 PolarHBondContact O-N 3.12Å
456	Q	74.6	Confident	76.1	Confident	46 Å²	46	41.1 Å²	41.1	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-75	-39.1	-179.3	-64	-77.5	-5.7	0	0	112.1	N284 L452 M453 A454 A459 A460 L1043	N284-Q456 PolarHBondContact ND2-NE2 3.14Å; N284-Q456 VanDerWaalsContact ND2-NE2 3.15Å; N284-Q456 PolarHBondContact OD1-NE2 3.02Å; L452-Q456 VanDerWaalsContact O-CG 3.29Å; L452-Q456 WeakPolarHBondContact O-CG 3.49Å; L452-Q456 PolarHBondContact O-N 3.36Å; M453-Q456 PolarHBondContact O-N 3.15Å; A454-Q456 VanDerWaalsContact C-N 3.26Å; A454-Q456 PolarHBondContact O-N 3.13Å; Q456-A459 PolarHBondContact O-N 2.86Å; Q456-A460 WeakPolarHBondContact O-CB 3.28Å; Q456-A460 PolarHBondContact O-N 3.4Å; Q456-L1043 HydrophobicContact CB-CD1 4.26Å; Q456-L1043 HydrophobicContact CG-CD1 3.82Å
457	M	76.1	Confident	76	Confident	57 Å²	57	44.4 Å²	44.4	28%	0.281	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-47.9	173.6	-73.1	179.5	65.8	0	0	111.4	T398 L402 M453 A454 A459 A460 G461 L462	T398-M457 HydrophobicContact CG2-CB 4.43Å; L402-M457 HydrophobicContact CD1-SD 3.73Å; L402-M457 HydrophobicContact CD2-SD 4Å; L402-M457 HydrophobicContact CG-SD 4.4Å; M453-M457 WeakPolarHBondContact O-CB 3.23Å; M453-M457 VanDerWaalsContact O-CG 3.28Å; M453-M457 WeakPolarHBondContact O-CG 3.34Å; M453-M457 PolarHBondContact O-N 3.41Å; A454-M457 PolarHBondContact O-N 3.21Å; M457-A459 VanDerWaalsContact C-N 3.34Å; M457-A459 PolarHBondContact O-N 3Å; M457-A460 CarbonylContact O-C 3.45Å; M457-A460 WeakPolarHBondContact O-CA 3.33Å; M457-A460 WeakPolarHBondContact O-CB 3.37Å; M457-A460 PolarHBondContact O-N 3.35Å; M457-A460 VanDerWaalsContact O-N 3.08Å; M457-G461 PolarHBondContact O-N 3.21Å; M457-G461 VanDerWaalsContact O-N 3.15Å; M457-L462 CarbonylContact C-O 3.55Å; M457-L462 HydrophobicContact CB-CB 4.41Å; M457-L462 WeakPolarHBondContact O-CA 3.47Å; M457-L462 PolarHBondContact O-N 3.35Å
458	T	79.9	Confident	75.6	Confident	27 Å²	27	44.6 Å²	44.6	17%	0.166	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-40.6	177.5	-61.9	0	0	0	0	111.2	D394 T395 A454 A460 G461 L462 V466	D394-T458 HydrophobicContact CB-CG2 4.02Å; T395-T458 HydrophobicContact CG2-CG2 3.87Å; A454-T458 VanDerWaalsContact O-CB 3.25Å; A454-T458 WeakPolarHBondContact O-CB 3.29Å; A454-T458 PolarHBondContact O-N 3.14Å; A454-T458 PolarHBondContact O-OG1 3.31Å; T458-A460 VanDerWaalsContact C-N 3.29Å; T458-A460 PolarHBondContact O-N 3.26Å; T458-G461 WeakPolarHBondContact O-CA 3.44Å; T458-G461 PolarHBondContact O-N 3.46Å; T458-L462 PolarHBondContact N-O 3.1Å; T458-V466 HydrophobicContact CG2-CG2 3.74Å
459	A	70.2	Confident	75.5	Confident	84 Å²	84	44.8 Å²	44.8	69%	0.694	26%	0.26	S	S	*	.	H	α-helix	trans	-62.9	-33.8	173.7	0	0	0	0	0	112.9	T455 Q456 M457 G461	T455-A459 VanDerWaalsContact O-CB 3.23Å; T455-A459 WeakPolarHBondContact O-CB 3.17Å; T455-A459 PolarHBondContact O-N 3.12Å; Q456-A459 PolarHBondContact O-N 2.86Å; M457-A459 VanDerWaalsContact C-N 3.34Å; M457-A459 PolarHBondContact O-N 3Å; A459-G461 PolarHBondContact O-N 2.92Å
460	A	72.9	Confident	74.9	Confident	69 Å²	69	49.6 Å²	49.6	57%	0.57	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	1.1	172.3	0	0	0	0	0	113.6	Q456 M457 T458 L462	Q456-A460 WeakPolarHBondContact O-CB 3.28Å; Q456-A460 PolarHBondContact O-N 3.4Å; M457-A460 CarbonylContact O-C 3.45Å; M457-A460 WeakPolarHBondContact O-CA 3.33Å; M457-A460 WeakPolarHBondContact O-CB 3.37Å; M457-A460 PolarHBondContact O-N 3.35Å; M457-A460 VanDerWaalsContact O-N 3.08Å; T458-A460 VanDerWaalsContact C-N 3.29Å; T458-A460 PolarHBondContact O-N 3.26Å; A460-L462 VanDerWaalsContact C-N 3.34Å; A460-L462 HydrophobicContact CB-CD1 4.2Å; A460-L462 HydrophobicContact CB-CG 4.34Å
461	G	73.8	Confident	73.6	Confident	34 Å²	34	55.9 Å²	55.9	35%	0.351	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	21.2	-178.2	0	0	0	0	0	114.4	M457 T458 A459	M457-G461 PolarHBondContact O-N 3.21Å; M457-G461 VanDerWaalsContact O-N 3.15Å; T458-G461 WeakPolarHBondContact O-CA 3.44Å; T458-G461 PolarHBondContact O-N 3.46Å; A459-G461 PolarHBondContact O-N 2.92Å
462	L	72.1	Confident	72.4	Confident	103 Å²	103	57.7 Å²	57.7	54%	0.539	33%	0.332	S	S	.	.			trans	-112.7	146.1	-177.4	-59.6	172.4	0	0	0	110.7	M457 T458 A460	M457-L462 CarbonylContact C-O 3.55Å; M457-L462 HydrophobicContact CB-CB 4.41Å; M457-L462 WeakPolarHBondContact O-CA 3.47Å; M457-L462 PolarHBondContact O-N 3.35Å; T458-L462 PolarHBondContact N-O 3.1Å; A460-L462 VanDerWaalsContact C-N 3.34Å; A460-L462 HydrophobicContact CB-CD1 4.2Å; A460-L462 HydrophobicContact CB-CG 4.34Å
463	G	79.3	Confident	71.1	Confident	11 Å²	11	63.4 Å²	63.4	11%	0.113	36%	0.355	C	S	.	.	S	Bend	trans	115.1	160	171.2	0	0	0	0	0	114.3	G465 V466 E467	G463-G465 VanDerWaalsContact C-N 3.27Å; G463-G465 PolarHBondContact O-N 3.42Å; G463-V466 PolarHBondContact O-N 3.16Å; G463-V466 VanDerWaalsContact O-N 3.14Å; G463-E467 PolarHBondContact O-N 2.73Å
464	P	76.3	Confident	69.3	Low	33 Å²	33	70.1 Å²	70.1	21%	0.214	39%	0.386	C	S	.	.	H	α-helix	trans	-62.9	-29.5	-170.5	-21.8	33.3	0	0	0	114.2	I397 F401 E467 Q468	I397-P464 HydrophobicContact CG2-CB 4.48Å; F401-P464 HydrophobicContact CB-CG 3.93Å; F401-P464 HydrophobicContact CD1-CG 3.79Å; F401-P464 HydrophobicContact CD2-CG 3.96Å; F401-P464 HydrophobicContact CE1-CG 4.28Å; F401-P464 HydrophobicContact CE2-CG 4.43Å; F401-P464 HydrophobicContact CG-CG 3.61Å; P464-E467 PolarHBondContact O-N 2.93Å; P464-Q468 PolarHBondContact O-N 3.11Å
465	G	77.3	Confident	66.8	Low	0 Å²	0	78.8 Å²	78.8	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-67.7	-38.4	176.4	0	0	0	0	0	113	D394 T398 G463 E467 Q468 T469	D394-G465 WeakPolarHBondContact O-CA 3.3Å; T398-G465 PolarHBondContact OG1-N 3.49Å; T398-G465 VanDerWaalsContact OG1-N 3.11Å; G463-G465 VanDerWaalsContact C-N 3.27Å; G463-G465 PolarHBondContact O-N 3.42Å; G465-E467 VanDerWaalsContact C-N 3.32Å; G465-E467 PolarHBondContact O-N 3.44Å; G465-Q468 PolarHBondContact O-N 2.99Å; G465-T469 PolarHBondContact O-N 2.85Å; G465-T469 VanDerWaalsContact O-N 3.08Å; G465-T469 PolarHBondContact O-OG1 3.28Å; G465-T469 VanDerWaalsContact O-OG1 3.12Å
466	V	77.1	Confident	65.1	Low	17 Å²	17	83.7 Å²	83.7	10%	0.103	46%	0.458	C	S	.	.	H	α-helix	trans	-66.7	-36.2	176.1	-179.7	0	0	0	0	111.2	T458 G463 K470	T458-V466 HydrophobicContact CG2-CG2 3.74Å; G463-V466 PolarHBondContact O-N 3.16Å; G463-V466 VanDerWaalsContact O-N 3.14Å; V466-K470 HydrophobicContact CG1-CD 4.3Å; V466-K470 WeakPolarHBondContact O-CB 3.44Å; V466-K470 VanDerWaalsContact O-CG 3.3Å; V466-K470 WeakPolarHBondContact O-CG 3.35Å; V466-K470 PolarHBondContact O-N 2.69Å; V466-K470 VanDerWaalsContact O-N 3.1Å
467	E	74.3	Confident	63.2	Low	117 Å²	117	91.3 Å²	91.3	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-70.9	-40.5	178.2	-67.3	179.6	-179.4	0	0	112.2	G463 P464 G465 K470 Q471	G463-E467 PolarHBondContact O-N 2.73Å; P464-E467 PolarHBondContact O-N 2.93Å; G465-E467 VanDerWaalsContact C-N 3.32Å; G465-E467 PolarHBondContact O-N 3.44Å; E467-K470 PolarHBondContact O-N 3.26Å; E467-Q471 WeakPolarHBondContact O-CB 3.38Å; E467-Q471 VanDerWaalsContact O-CG 3.32Å; E467-Q471 WeakPolarHBondContact O-CG 3.43Å; E467-Q471 PolarHBondContact O-N 3.28Å
468	Q	69	Low	61.1	Low	99 Å²	99	97.6 Å²	97.6	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-38.7	175	-78	-179.4	12.3	0	0	112.3	P464 G465 K470 Q471 C472	P464-Q468 PolarHBondContact O-N 3.11Å; G465-Q468 PolarHBondContact O-N 2.99Å; Q468-K470 VanDerWaalsContact C-N 3.34Å; Q468-Q471 PolarHBondContact O-N 2.85Å; Q468-C472 WeakPolarHBondContact O-CB 3.42Å; Q468-C472 PolarHBondContact O-N 3.38Å; Q468-C472 PolarHBondContact O-SG 2.89Å
469	T	66.4	Low	58.6	Low	42 Å²	42	103.8 Å²	103.8	26%	0.258	55%	0.547	S	S	.	.	H	α-helix	trans	-72.6	-28.1	178.2	-59.5	0	0	0	0	112.5	D394 G465 K473	D394-T469 PolarHBondContact OD1-OG1 3.05Å; D394-T469 WeakPolarHBondContact OD2-CB 3.44Å; D394-T469 PolarHBondContact OD2-OG1 3.02Å; G465-T469 PolarHBondContact O-N 2.85Å; G465-T469 VanDerWaalsContact O-N 3.08Å; G465-T469 PolarHBondContact O-OG1 3.28Å; G465-T469 VanDerWaalsContact O-OG1 3.12Å; T469-K473 WeakPolarHBondContact O-CG 3.33Å
470	K	64.9	Low	56.6	Low	127 Å²	127	107.9 Å²	107.9	55%	0.552	55%	0.549	S	S	*	.	H	α-helix	trans	-69.8	-42.1	168.1	-76.1	173.5	-179.3	173.5	0	111.9	V466 E467 Q468 K473	V466-K470 HydrophobicContact CG1-CD 4.3Å; V466-K470 WeakPolarHBondContact O-CB 3.44Å; V466-K470 VanDerWaalsContact O-CG 3.3Å; V466-K470 WeakPolarHBondContact O-CG 3.35Å; V466-K470 PolarHBondContact O-N 2.69Å; V466-K470 VanDerWaalsContact O-N 3.1Å; E467-K470 PolarHBondContact O-N 3.26Å; Q468-K470 VanDerWaalsContact C-N 3.34Å; K470-K473 PolarHBondContact O-N 2.76Å
471	Q	55.4	Low	54.7	Low	133 Å²	133	111 Å²	111	62%	0.621	56%	0.56	S	S	*	*	H	α-helix	trans	-68.9	-37.3	178.1	-72.8	173.2	16.8	0	0	112.8	E467 Q468 K473 E474	E467-Q471 WeakPolarHBondContact O-CB 3.38Å; E467-Q471 VanDerWaalsContact O-CG 3.32Å; E467-Q471 WeakPolarHBondContact O-CG 3.43Å; E467-Q471 PolarHBondContact O-N 3.28Å; Q468-Q471 PolarHBondContact O-N 2.85Å; Q471-K473 PolarHBondContact O-N 3.2Å; Q471-E474 PolarHBondContact O-N 3.04Å
472	C	53.4	Low	52.4	Low	112 Å²	112	115.9 Å²	115.9	76%	0.757	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-17.8	175.4	-79.7	0	0	0	0	114.1	Q468	Q468-C472 WeakPolarHBondContact O-CB 3.42Å; Q468-C472 PolarHBondContact O-N 3.38Å; Q468-C472 PolarHBondContact O-SG 2.89Å
473	K	47.2	Very low	50.2	Low	177 Å²	177	119.8 Å²	119.8	77%	0.77	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-7.1	176	-77.9	-179.8	178.2	177	0	113.6	T469 K470 Q471	T469-K473 WeakPolarHBondContact O-CG 3.33Å; K470-K473 PolarHBondContact O-N 2.76Å; Q471-K473 PolarHBondContact O-N 3.2Å
474	E	39.1	Very low	47.6	Very low	166 Å²	166	124.7 Å²	124.7	78%	0.776	62%	0.624	S	S	*	*	S	Bend	trans	-111.9	10.4	-173.1	-78.4	-165.9	160.2	0	0	116.4	Q471 P476	Q471-E474 PolarHBondContact O-N 3.04Å; E474-P476 WeakPolarHBondContact O-CD 3.42Å
475	E	29.2	Very low	45.2	Very low	182 Å²	182	131.1 Å²	131.1	85%	0.85	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-87.3	124.3	172.9	-72.2	-139.2	148.8	0	0	114
476	P	39.6	Very low	42.7	Very low	121 Å²	121	135.9 Å²	135.9	79%	0.786	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-90.5	150.4	166.7	34.3	-27.8	0	0	0	112.1	E474	E474-P476 WeakPolarHBondContact O-CD 3.42Å
477	K	33.6	Very low	40.2	Very low	206 Å²	206	140.6 Å²	140.6	90%	0.896	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.1	-179.2	-69.4	176.7	174.8	178	0	114
478	E	31.9	Very low	37.9	Very low	189 Å²	189	141.7 Å²	141.7	88%	0.883	72%	0.722	S	S	*	*			trans	23.1	129.5	154.6	-65.7	-172.4	152.8	0	0	122.5
479	E	27.9	Very low	35.8	Very low	158 Å²	158	143 Å²	143	74%	0.738	73%	0.73	S	S	*	*				-164.7	129.1	109.1	-110.4	-164.4	144	0	0	114.8
480	K	29.2	Very low	33.8	Very low	169 Å²	169	149.2 Å²	149.2	74%	0.735	75%	0.754	S	S	*	*			trans	62.5	101.1	146.5	-73.1	172.5	179.5	142.9	0	123.1
481	V	31.1	Very low	31.7	Very low	135 Å²	135	153 Å²	153	82%	0.818	77%	0.765	S	S	*	*				28.3	122.4	127.2	-172.5	0	0	0	0	118.9
482	V	27	Very low	30.2	Very low	136 Å²	136	156.9 Å²	156.9	82%	0.824	77%	0.774	S	S	*	*				-166.8	137.5	118.6	152.1	0	0	0	0	111
483	K	25.6	Very low	28.8	Very low	185 Å²	185	158.5 Å²	158.5	80%	0.804	77%	0.774	S	S	*	*			trans	-40.2	162.3	170.3	-62.5	166.2	165.9	174.3	0	114.7
484	T	24.5	Very low	27.7	Very low	114 Å²	114	154.8 Å²	154.8	70%	0.699	77%	0.771	S	S	*	*			cis	-172.8	164.6	28	-17.4	0	0	0	0	109.3
485	E	25.9	Very low	27.1	Very low	168 Å²	168	151.2 Å²	151.2	79%	0.785	77%	0.769	S	S	*	*			trans	72.2	104.5	151.2	-73.6	173.8	173.9	0	0	118.4
486	S	23.6	Very low	27	Very low	101 Å²	101	152.2 Å²	152.2	71%	0.706	77%	0.774	S	S	*	*				85.8	135.2	67.1	80.4	0	0	0	0	114.1
487	V	25.1	Very low	26.3	Very low	116 Å²	116	149.8 Å²	149.8	70%	0.703	77%	0.77	S	S	*	*			trans	100.1	95.2	151.4	-176.7	0	0	0	0	119.5
488	L	25.8	Very low	26.1	Very low	139 Å²	139	149.7 Å²	149.7	73%	0.728	77%	0.773	S	S	*	*				77.4	119.3	121.3	-54.8	179.8	0	0	0	123.5
489	I	25.2	Very low	25.6	Very low	126 Å²	126	145 Å²	145	65%	0.646	77%	0.767	S	S	*	*				67.3	111.5	118.5	-59.7	178.6	0	0	0	118.8
490	K	23.8	Very low	25.6	Very low	174 Å²	174	144.6 Å²	144.6	76%	0.757	77%	0.768	S	S	*	*				156.7	139.5	90.1	-127.1	161	-165.4	172.1	0	114.4
491	R	21.4	Very low	25.4	Very low	206 Å²	206	141.6 Å²	141.6	78%	0.777	77%	0.768	S	S	*	*			trans	52.2	118.2	137.6	-90.7	-175	171.3	160.1	-2.3	122.9
492	R	25.1	Very low	25.1	Very low	214 Å²	214	140.6 Å²	140.6	81%	0.808	76%	0.762	S	S	*	*				48.4	117.8	109.6	-92.9	-168.4	-174.4	-168.6	1.9	119.1
493	L	23.4	Very low	25	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	76%	0.763	S	S	*	*				152.7	138.5	98.4	-95.4	153.1	0	0	0	114.2
494	S	23.8	Very low	25	Very low	99 Å²	99	135.1 Å²	135.1	69%	0.692	76%	0.758	S	S	*	*			trans	57.5	117.9	142.2	71.8	0	0	0	0	124
495	A	26.5	Very low	24.8	Very low	90 Å²	90	135 Å²	135	74%	0.744	76%	0.761	S	S	*	*				62.1	144.8	114.3	0	0	0	0	0	123.6
496	Q	26.6	Very low	24.8	Very low	204 Å²	204	134.1 Å²	134.1	95%	0.953	76%	0.762	S	S	*	*			trans	71	129.9	167.3	-65	174.1	-22.1	0	0	115.1
497	G	24.9	Very low	24.7	Very low	69 Å²	69	133.9 Å²	133.9	71%	0.711	76%	0.76	S	S	*	*			cis	136.6	127.3	15.8	0	0	0	0	0	107
498	Q	29.1	Very low	24.7	Very low	205 Å²	205	133.6 Å²	133.6	96%	0.958	76%	0.763	S	S	*	*			trans	-164.5	117.9	160.3	-111.7	168.5	5.7	0	0	111.1
499	A	23.1	Very low	24.6	Very low	90 Å²	90	136 Å²	136	74%	0.744	77%	0.773	S	S	*	*			trans	-82.5	177.7	165	0	0	0	0	0	108.9
500	I	27.1	Very low	24.4	Very low	149 Å²	149	134.9 Å²	134.9	76%	0.764	78%	0.776	S	S	*	*			cis	-166.5	149.2	31.9	-65.9	171.4	0	0	0	105.7	V502	I500-V502 HydrophobicContact CG2-CG2 3.92Å
501	S	24.8	Very low	25.1	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	77%	0.774	S	S	*	*				157.3	103.6	123.3	-178.6	0	0	0	0	113.9
502	V	24.1	Very low	25.3	Very low	114 Å²	114	129.2 Å²	129.2	69%	0.691	78%	0.775	S	S	*	*				80.4	129.9	84.5	-150.9	0	0	0	0	115.1	I500	I500-V502 HydrophobicContact CG2-CG2 3.92Å
503	V	26.1	Very low	25.2	Very low	140 Å²	140	126.9 Å²	126.9	85%	0.848	77%	0.773	S	S	*	*			trans	78.9	128.5	162.9	-157.2	0	0	0	0	114.6
504	G	24	Very low	25.3	Very low	67 Å²	67	127.9 Å²	127.9	69%	0.691	77%	0.774	S	S	*	*			cis	131.5	134.4	14.2	0	0	0	0	0	109
505	S	22.3	Very low	25.2	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	78%	0.781	S	S	*	*			trans	102.7	116.4	153.6	-147.7	0	0	0	0	121.2
506	L	24.8	Very low	25.4	Very low	151 Å²	151	131.7 Å²	131.7	79%	0.791	78%	0.78	S	S	*	*			trans	61.3	117	131.9	-66	169.8	0	0	0	123.1
507	S	22.2	Very low	25.8	Very low	96 Å²	96	127.8 Å²	127.8	67%	0.671	77%	0.773	S	S	*	*				84.3	117.4	125.9	-55.6	0	0	0	0	122.2
508	S	24.3	Very low	25.8	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	78%	0.78	S	S	*	*			trans	41.6	122.3	136.3	66.9	0	0	0	0	120.8
509	M	23.4	Very low	25.9	Very low	189 Å²	189	128.4 Å²	128.4	93%	0.931	77%	0.774	S	S	*	*			trans	-154.5	139.2	132	-81.1	-143.9	78.1	0	0	111.1
510	S	22.4	Very low	26.2	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	78%	0.782	S	S	*	*			trans	-91.5	-173.4	164.5	62.7	0	0	0	0	109.6
511	P	38.6	Very low	26.3	Very low	112 Å²	112	139 Å²	139	73%	0.727	79%	0.791	S	S	*	*				-100.6	173.4	-120.3	30.2	-9.8	0	0	0	113.7
512	L	24.4	Very low	26.3	Very low	150 Å²	150	145.8 Å²	145.8	79%	0.785	80%	0.8	S	S	*	*			trans	179.7	119.1	136.3	-92.3	163.1	0	0	0	111.5
513	E	24.2	Very low	26.8	Very low	164 Å²	164	146 Å²	146	77%	0.766	80%	0.804	S	S	*	*			trans	54.9	137.4	136.2	-72.1	175.4	171.2	0	0	126
514	E	24.9	Very low	26.9	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	81%	0.805	S	S	*	*			trans	104	123.8	139.8	-88.3	-176.6	168.5	0	0	123.6
515	E	21.6	Very low	27.4	Very low	182 Å²	182	151.1 Å²	151.1	85%	0.85	81%	0.812	S	S	*	*			trans	72.2	131.3	145.7	-68.1	-161.7	139.3	0	0	124.2
516	A	31.2	Very low	28.1	Very low	87 Å²	87	153.2 Å²	153.2	72%	0.719	81%	0.813	S	S	*	*			trans	-80.9	163	164.8	0	0	0	0	0	110.6
517	P	33.6	Very low	28.5	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	82%	0.817	S	S	*	*				-158.2	159.1	75.4	37	-13.8	0	0	0	119.1
518	Q	25.4	Very low	29.2	Very low	187 Å²	187	154.4 Å²	154.4	87%	0.874	82%	0.816	S	S	*	*			trans	18.6	124.9	148.2	-64.7	-177.9	-3.1	0	0	124.5
519	A	31.8	Very low	29.7	Very low	99 Å²	99	155.3 Å²	155.3	82%	0.818	82%	0.816	S	S	*	*				37.3	126.8	123.9	0	0	0	0	0	122.7
520	K	28.2	Very low	30	Very low	212 Å²	212	152.8 Å²	152.8	92%	0.922	81%	0.812	S	S	*	*			trans	-129.8	118.5	157.8	-79.5	178	174.1	169.6	0	111.2
521	R	30.5	Very low	30.4	Very low	251 Å²	251	156.4 Å²	156.4	95%	0.947	82%	0.818	S	S	*	*			trans	-88.2	157	160.9	-85.1	-174.7	175.7	-178.5	-1.1	110.3
522	R	25	Very low	30.6	Very low	247 Å²	247	156.5 Å²	156.5	93%	0.932	82%	0.818	S	S	*	*			trans	-116.5	167.8	172	-95.5	-165.1	-176.8	-174.5	3.6	110.9
523	P	34.7	Very low	31.1	Very low	120 Å²	120	160.8 Å²	160.8	78%	0.779	82%	0.824	S	S	*	*			trans	-109	170.4	-131.3	40.6	-36.9	0	0	0	116.4
524	E	26.5	Very low	31.6	Very low	187 Å²	187	161.2 Å²	161.2	87%	0.874	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-103.9	162.5	167.8	-84.3	-176.7	177.1	0	0	112.8
525	P	35.5	Very low	32.2	Very low	127 Å²	127	157.9 Å²	157.9	83%	0.825	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-98.5	170.2	-172.8	36.7	-27.4	0	0	0	115.5
526	I	37.9	Very low	33	Very low	154 Å²	154	152.9 Å²	152.9	79%	0.79	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-89.6	152.5	-166.1	-63.5	156	0	0	0	112.3
527	I	31.3	Very low	33.6	Very low	172 Å²	172	154 Å²	154	88%	0.882	84%	0.838	S	S	*	*			trans	-170	154.6	139.3	-95.4	154.6	0	0	0	111.1
528	P	37.4	Very low	33.8	Very low	100 Å²	100	152 Å²	152	65%	0.649	84%	0.84	S	S	*	*			trans	-122.5	156.4	-141.4	37.5	-21.5	0	0	0	118.3
529	V	34.8	Very low	35.1	Very low	128 Å²	128	146.9 Å²	146.9	78%	0.776	84%	0.837	S	S	*	*			trans	32.3	124.5	134.4	-166.2	0	0	0	0	121.5
530	T	30.7	Very low	35.7	Very low	136 Å²	136	154.2 Å²	154.2	83%	0.834	84%	0.843	S	S	*	*				176.9	163.1	115	23.3	0	0	0	0	114
531	Q	30.5	Very low	36.9	Very low	179 Å²	179	153.8 Å²	153.8	84%	0.836	84%	0.842	S	S	*	*			trans	-86	-153	-157.5	-59.9	167.5	-28.9	0	0	115.6
532	P	42.4	Very low	38.2	Very low	113 Å²	113	151.8 Å²	151.8	73%	0.734	84%	0.84	S	S	*	*				-121.9	161.7	-77.9	34.5	-17.1	0	0	0	116.2
533	R	35.3	Very low	39.9	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	83%	0.83	S	S	*	*			trans	34.1	122.4	153.1	-65.6	-174.9	178.1	178.7	0.4	122.3
534	L	35.4	Very low	41.2	Very low	173 Å²	173	148.1 Å²	148.1	91%	0.906	82%	0.824	S	S	*	*				-173	144.1	117	-100.5	156.8	0	0	0	112.6
535	A	36	Very low	43.1	Very low	98 Å²	98	147.1 Å²	147.1	81%	0.81	81%	0.812	S	S	*	*			trans	55.4	124.1	158.5	0	0	0	0	0	121.7
536	G	38.7	Very low	44.5	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	80%	0.801	S	S	*	*			trans	94.4	116.5	144.2	0	0	0	0	0	117.7
537	A	43.5	Very low	46	Very low	111 Å²	111	143.3 Å²	143.3	92%	0.917	79%	0.793	S	S	*	*			trans	71.8	133.4	163.1	0	0	0	0	0	119.4
538	G	37.8	Very low	47.7	Very low	80 Å²	80	141 Å²	141	83%	0.825	78%	0.782	S	S	*	*			trans	98.4	110.1	156	0	0	0	0	0	116.4
539	G	53.3	Low	49.3	Very low	79 Å²	79	141.1 Å²	141.1	81%	0.814	78%	0.781	S	S	*	*			trans	-76.9	166.8	177.6	0	0	0	0	0	114.7
540	R	44	Very low	50.9	Low	253 Å²	253	140.3 Å²	140.3	96%	0.955	77%	0.771	S	S	*	*			trans	-143.6	111.3	160	-100.9	175.5	-179	170.8	0.5	110.7
541	K	53.8	Low	53.1	Low	204 Å²	204	143.1 Å²	143.1	89%	0.887	77%	0.772	S	S	*	*			trans	-63.3	139.2	172.5	-65.8	173.3	177.5	177.6	0	109.4	I543	K541-I543 PolarHBondContact O-N 3.08Å
542	K	56.8	Low	55.2	Low	208 Å²	208	140.4 Å²	140.4	90%	0.904	77%	0.77	S	S	*	*			trans	-54.3	127.6	167.7	-77.7	-178.1	176.1	-179.4	0	108.7	F544	K542-F544 PolarHBondContact O-N 2.99Å; K542-F544 VanDerWaalsContact O-N 3.13Å
543	I	61.1	Low	57	Low	143 Å²	143	139.7 Å²	139.7	73%	0.733	76%	0.759	S	S	*	*			trans	-68.5	109.6	174	-67.2	163.7	0	0	0	107	K541 R545	K541-I543 PolarHBondContact O-N 3.08Å; I543-R545 HydrophobicContact CG2-CG 4.23Å; I543-R545 PolarHBondContact O-N 2.93Å
544	F	61.5	Low	59.4	Low	148 Å²	148	131.9 Å²	131.9	65%	0.649	74%	0.739	S	S	*	*			trans	-67	114.5	171.4	-175.9	-105.9	0	0	0	108.4	K542 L546 V549	K542-F544 PolarHBondContact O-N 2.99Å; K542-F544 VanDerWaalsContact O-N 3.13Å; F544-L546 HydrophobicContact CD1-CD1 4.4Å; F544-L546 HydrophobicContact CE1-CD1 3.82Å; F544-V549 HydrophobicContact CE2-CG2 3.72Å; F544-V549 HydrophobicContact CZ-CB 4.45Å; F544-V549 HydrophobicContact CZ-CG2 3.86Å
545	R	66.9	Low	61.6	Low	165 Å²	165	130.1 Å²	130.1	62%	0.623	73%	0.73	S	S	*	*			trans	-100.7	118.6	172.2	-66	-173.5	176.6	-171.4	-1	108.3	I543 S547 D548	I543-R545 HydrophobicContact CG2-CG 4.23Å; I543-R545 PolarHBondContact O-N 2.93Å; R545-S547 PolarHBondContact O-N 3.09Å; R545-S547 VanDerWaalsContact O-N 3.11Å; R545-D548 WeakPolarHBondContact O-CB 3.29Å; R545-D548 PolarHBondContact O-N 2.76Å
546	L	65.9	Low	63.8	Low	114 Å²	114	129.1 Å²	129.1	60%	0.597	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-56	-29.8	-176.6	-143.4	83.6	0	0	0	112.7	F544 D548 V549 L550	F544-L546 HydrophobicContact CD1-CD1 4.4Å; F544-L546 HydrophobicContact CE1-CD1 3.82Å; L546-D548 PolarHBondContact O-N 3.31Å; L546-V549 PolarHBondContact O-N 2.9Å; L546-L550 HydrophobicContact CD2-CD1 3.59Å; L546-L550 HydrophobicContact CG-CD1 3.71Å; L546-L550 WeakPolarHBondContact O-CG 3.38Å; L546-L550 PolarHBondContact O-N 3.31Å
547	S	68.6	Low	65.9	Low	87 Å²	87	130.2 Å²	130.2	61%	0.608	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-60.1	-26	176.2	49.1	0	0	0	0	114.2	R545 V549	R545-S547 PolarHBondContact O-N 3.09Å; R545-S547 VanDerWaalsContact O-N 3.11Å; S547-V549 VanDerWaalsContact C-N 3.3Å; S547-V549 PolarHBondContact O-N 3.3Å
548	D	66.8	Low	67.7	Low	125 Å²	125	127 Å²	127	67%	0.668	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-87	-6.2	-171.7	-55.5	-6.4	0	0	0	111.8	R545 L546	R545-D548 WeakPolarHBondContact O-CB 3.29Å; R545-D548 PolarHBondContact O-N 2.76Å; L546-D548 PolarHBondContact O-N 3.31Å
549	V	71.3	Confident	69.8	Low	101 Å²	101	127.1 Å²	127.1	61%	0.612	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	-21.8	-176.5	-175.4	0	0	0	0	112.7	F544 L546 S547	F544-V549 HydrophobicContact CE2-CG2 3.72Å; F544-V549 HydrophobicContact CZ-CB 4.45Å; F544-V549 HydrophobicContact CZ-CG2 3.86Å; L546-V549 PolarHBondContact O-N 2.9Å; S547-V549 VanDerWaalsContact C-N 3.3Å; S547-V549 PolarHBondContact O-N 3.3Å
550	L	69.4	Low	71.2	Confident	111 Å²	111	126.3 Å²	126.3	58%	0.581	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-99.5	124.4	-175.8	-65.5	173.1	0	0	0	111.9	L546	L546-L550 HydrophobicContact CD2-CD1 3.59Å; L546-L550 HydrophobicContact CG-CD1 3.71Å; L546-L550 WeakPolarHBondContact O-CG 3.38Å; L546-L550 PolarHBondContact O-N 3.31Å
551	K	75.4	Confident	73.1	Confident	195 Å²	195	118.8 Å²	118.8	85%	0.848	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-75.7	131.9	165.2	-77.1	-177.1	176.6	-179.7	0	109.4
552	P	74.8	Confident	74.5	Confident	123 Å²	123	112.7 Å²	112.7	80%	0.799	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-61.8	138.7	172.7	25	-30.8	0	0	0	109.8
553	L	79.9	Confident	75.7	Confident	97 Å²	97	105.3 Å²	105.3	51%	0.508	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-69.4	143.1	179.7	-68.2	152.6	0	0	0	109.7	Q557 V558 M561	L553-Q557 HydrophobicContact CB-CB 4.47Å; L553-Q557 HydrophobicContact CD2-CB 4.27Å; L553-V558 HydrophobicContact CB-CG2 3.65Å; L553-V558 HydrophobicContact CD1-CG2 4.44Å; L553-M561 HydrophobicContact CD1-CE 3.33Å; L553-M561 HydrophobicContact CD2-CE 3.53Å; L553-M561 HydrophobicContact CG-CE 3.94Å
554	T	86.6	Confident	76.8	Confident	77 Å²	77	99.5 Å²	99.5	47%	0.472	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-68.6	150.9	171.4	58.2	0	0	0	0	110.2	A556 Q557 V558	T554-A556 PolarHBondContact O-N 3.34Å; T554-A556 VanDerWaalsContact O-N 3.17Å; T554-Q557 VanDerWaalsContact N-OE1 3.08Å; T554-Q557 WeakPolarHBondContact O-CA 3.47Å; T554-Q557 WeakPolarHBondContact O-CB 3.41Å; T554-Q557 PolarHBondContact O-N 2.85Å; T554-Q557 WeakPolarHBondContact OG1-CB 3.47Å; T554-Q557 WeakPolarHBondContact OG1-CG 3.31Å; T554-Q557 PolarHBondContact OG1-N 3.21Å; T554-Q557 PolarHBondContact OG1-OE1 3.06Å; T554-V558 WeakPolarHBondContact O-CG2 3.46Å; T554-V558 PolarHBondContact O-N 3.42Å
555	D	80.8	Confident	78	Confident	137 Å²	137	94 Å²	94	73%	0.733	52%	0.518	S	S	*	.	H	α-helix	trans	-55.6	-37.1	180	-65.7	-33.1	0	0	0	112.1	Q557 V558 E559	D555-Q557 PolarHBondContact O-N 3.45Å; D555-V558 PolarHBondContact O-N 3.33Å; D555-E559 WeakPolarHBondContact O-CG 3.43Å; D555-E559 PolarHBondContact O-N 3.21Å
556	A	82.4	Confident	79	Confident	77 Å²	77	86.6 Å²	86.6	64%	0.636	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-39.5	173.9	0	0	0	0	0	113.2	T554 A560	T554-A556 PolarHBondContact O-N 3.34Å; T554-A556 VanDerWaalsContact O-N 3.17Å; A556-A560 VanDerWaalsContact O-CB 3.27Å; A556-A560 WeakPolarHBondContact O-CB 3.4Å; A556-A560 PolarHBondContact O-N 3.4Å
557	Q	83	Confident	80	Confident	99 Å²	99	84 Å²	84	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-70.5	-36.3	175.2	-73.8	167.2	-32.5	0	0	111.7	L553 T554 D555 M561	L553-Q557 HydrophobicContact CB-CB 4.47Å; L553-Q557 HydrophobicContact CD2-CB 4.27Å; T554-Q557 VanDerWaalsContact N-OE1 3.08Å; T554-Q557 WeakPolarHBondContact O-CA 3.47Å; T554-Q557 WeakPolarHBondContact O-CB 3.41Å; T554-Q557 PolarHBondContact O-N 2.85Å; T554-Q557 WeakPolarHBondContact OG1-CB 3.47Å; T554-Q557 WeakPolarHBondContact OG1-CG 3.31Å; T554-Q557 PolarHBondContact OG1-N 3.21Å; T554-Q557 PolarHBondContact OG1-OE1 3.06Å; D555-Q557 PolarHBondContact O-N 3.45Å; Q557-M561 WeakPolarHBondContact O-CB 3.4Å; Q557-M561 WeakPolarHBondContact O-CG 3.49Å; Q557-M561 PolarHBondContact O-N 3.2Å
558	V	81.3	Confident	80.9	Confident	43 Å²	43	87.8 Å²	87.8	26%	0.261	48%	0.475	S	S	.	.	H	α-helix	trans	-63.8	-48.1	175.4	173.3	0	0	0	0	110.3	L553 T554 D555 M561 K562	L553-V558 HydrophobicContact CB-CG2 3.65Å; L553-V558 HydrophobicContact CD1-CG2 4.44Å; T554-V558 WeakPolarHBondContact O-CG2 3.46Å; T554-V558 PolarHBondContact O-N 3.42Å; D555-V558 PolarHBondContact O-N 3.33Å; V558-M561 PolarHBondContact O-N 3.03Å; V558-K562 HydrophobicContact CG1-CD 4.23Å; V558-K562 WeakPolarHBondContact O-CG 3.28Å; V558-K562 PolarHBondContact O-N 2.69Å
559	E	81.5	Confident	82	Confident	84 Å²	84	84.3 Å²	84.3	39%	0.393	46%	0.456	S	S	.	.	H	α-helix	trans	-64.7	-41.7	176.9	-71	-50.4	128	0	0	112.5	D555 M561 K562 L563	D555-E559 WeakPolarHBondContact O-CG 3.43Å; D555-E559 PolarHBondContact O-N 3.21Å; E559-M561 VanDerWaalsContact C-N 3.29Å; E559-M561 PolarHBondContact O-N 2.85Å; E559-K562 PolarHBondContact O-N 2.77Å; E559-K562 WeakPolarHBondContact OE1-CD 3.23Å; E559-K562 IonicContact OE1-NZ 3.7Å; E559-K562 PolarHBondContact OE1-NZ 3.09Å; E559-L563 WeakPolarHBondContact O-CB 3.4Å; E559-L563 PolarHBondContact O-N 3.33Å
560	A	83.7	Confident	82.8	Confident	61 Å²	61	79.8 Å²	79.8	50%	0.504	43%	0.429	S	S	.	.	H	α-helix	trans	-60.4	-38.8	174.4	0	0	0	0	0	112.2	A556 G564	A556-A560 VanDerWaalsContact O-CB 3.27Å; A556-A560 WeakPolarHBondContact O-CB 3.4Å; A556-A560 PolarHBondContact O-N 3.4Å; A560-G564 PolarHBondContact O-N 3.21Å
561	M	83.5	Confident	83.7	Confident	96 Å²	96	84.2 Å²	84.2	47%	0.473	44%	0.438	S	S	.	.	H	α-helix	trans	-72.6	-39.2	176.6	-78.2	-166.8	-73.1	0	0	113.2	L553 Q557 V558 E559 G564 A565	L553-M561 HydrophobicContact CD1-CE 3.33Å; L553-M561 HydrophobicContact CD2-CE 3.53Å; L553-M561 HydrophobicContact CG-CE 3.94Å; Q557-M561 WeakPolarHBondContact O-CB 3.4Å; Q557-M561 WeakPolarHBondContact O-CG 3.49Å; Q557-M561 PolarHBondContact O-N 3.2Å; V558-M561 PolarHBondContact O-N 3.03Å; E559-M561 VanDerWaalsContact C-N 3.29Å; E559-M561 PolarHBondContact O-N 2.85Å; M561-G564 PolarHBondContact O-N 3.15Å; M561-A565 WeakPolarHBondContact O-CB 3.47Å; M561-A565 PolarHBondContact O-N 3.46Å
562	K	82.4	Confident	84.3	Confident	76 Å²	76	76.4 Å²	76.4	33%	0.33	41%	0.409	S	S	.	.	H	α-helix	trans	-59.1	-51	172.7	-74.1	172.7	-177.4	170.3	0	110.8	V558 E559 G564 A565 V566	V558-K562 HydrophobicContact CG1-CD 4.23Å; V558-K562 WeakPolarHBondContact O-CG 3.28Å; V558-K562 PolarHBondContact O-N 2.69Å; E559-K562 PolarHBondContact O-N 2.77Å; E559-K562 WeakPolarHBondContact OE1-CD 3.23Å; E559-K562 IonicContact OE1-NZ 3.7Å; E559-K562 PolarHBondContact OE1-NZ 3.09Å; K562-G564 VanDerWaalsContact C-N 3.34Å; K562-G564 PolarHBondContact O-N 2.95Å; K562-A565 WeakPolarHBondContact O-CB 3.36Å; K562-A565 PolarHBondContact O-N 2.83Å; K562-V566 PolarHBondContact O-N 3.04Å
563	L	83.8	Confident	84.9	Confident	53 Å²	53	72.7 Å²	72.7	28%	0.277	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-44	176.9	-177.7	63.4	0	0	0	111.5	E559 A565 V566 K567 L600 E603	E559-L563 WeakPolarHBondContact O-CB 3.4Å; E559-L563 PolarHBondContact O-N 3.33Å; L563-A565 VanDerWaalsContact C-N 3.31Å; L563-A565 PolarHBondContact O-N 2.71Å; L563-V566 PolarHBondContact O-N 3.25Å; L563-K567 HydrophobicContact CG-CD 4.25Å; L563-K567 WeakPolarHBondContact O-CB 3.48Å; L563-K567 WeakPolarHBondContact O-CG 3.29Å; L563-K567 PolarHBondContact O-N 3.4Å; L563-L600 HydrophobicContact CD1-CD2 3.85Å; L563-E603 HydrophobicContact CD1-CG 3.92Å
564	G	83.9	Confident	85.1	Confident	20 Å²	20	76.2 Å²	76.2	21%	0.206	39%	0.393	C	S	.	.	H	α-helix	trans	-60.3	-38	175.7	0	0	0	0	0	113	A560 M561 K562 R568	A560-G564 PolarHBondContact O-N 3.21Å; M561-G564 PolarHBondContact O-N 3.15Å; K562-G564 VanDerWaalsContact C-N 3.34Å; K562-G564 PolarHBondContact O-N 2.95Å; G564-R568 WeakPolarHBondContact O-CG 3.23Å; G564-R568 PolarHBondContact O-N 2.88Å; G564-R568 VanDerWaalsContact O-N 3.1Å; G564-R568 PolarHBondContact O-NH1 2.99Å
565	A	86.6	Confident	84.9	Confident	34 Å²	34	76 Å²	76	28%	0.281	40%	0.399	S	S	.	.	H	α-helix	trans	-66.2	-47.5	175.8	0	0	0	0	0	111.9	M561 K562 L563 K567 R568 I569	M561-A565 WeakPolarHBondContact O-CB 3.47Å; M561-A565 PolarHBondContact O-N 3.46Å; K562-A565 WeakPolarHBondContact O-CB 3.36Å; K562-A565 PolarHBondContact O-N 2.83Å; L563-A565 VanDerWaalsContact C-N 3.31Å; L563-A565 PolarHBondContact O-N 2.71Å; A565-K567 PolarHBondContact O-N 3.2Å; A565-R568 WeakPolarHBondContact O-CB 3.5Å; A565-R568 PolarHBondContact O-N 3.42Å; A565-I569 WeakPolarHBondContact O-CG1 3.41Å; A565-I569 PolarHBondContact O-N 3.1Å
566	V	86.4	Confident	85.1	Confident	8 Å²	8	71.1 Å²	71.1	5%	0.048	37%	0.374	C	S	.	.	H	α-helix	trans	-63.3	-42.8	178	176.3	0	0	0	0	111.2	K562 L563 R568 I569 L570 L589 L592 L600 V604	K562-V566 PolarHBondContact O-N 3.04Å; L563-V566 PolarHBondContact O-N 3.25Å; V566-R568 VanDerWaalsContact C-N 3.3Å; V566-R568 PolarHBondContact O-N 3.46Å; V566-I569 PolarHBondContact O-N 3.11Å; V566-I569 VanDerWaalsContact O-N 3.12Å; V566-L570 HydrophobicContact CG1-CD1 4.02Å; V566-L570 HydrophobicContact CG1-CG 4.27Å; V566-L570 WeakPolarHBondContact O-CG 3.37Å; V566-L570 PolarHBondContact O-N 3.22Å; V566-L589 HydrophobicContact CG1-CD2 4.27Å; V566-L592 HydrophobicContact CG2-CD1 4.45Å; V566-L600 HydrophobicContact CB-CD2 3.84Å; V566-L600 HydrophobicContact CG1-CD2 4.15Å; V566-L600 HydrophobicContact CG2-CD1 4.08Å; V566-L600 HydrophobicContact CG2-CD2 3.7Å; V566-L600 HydrophobicContact CG2-CG 4.5Å; V566-V604 HydrophobicContact CG1-CG2 4.37Å
567	K	87.3	Confident	84.9	Confident	60 Å²	60	70.3 Å²	70.3	26%	0.261	37%	0.367	S	S	.	.	H	α-helix	trans	-58.5	-38.9	174.3	-76.2	-178.4	175.9	-176.7	0	112.9	L563 A565 L570 R571 E603	L563-K567 HydrophobicContact CG-CD 4.25Å; L563-K567 WeakPolarHBondContact O-CB 3.48Å; L563-K567 WeakPolarHBondContact O-CG 3.29Å; L563-K567 PolarHBondContact O-N 3.4Å; A565-K567 PolarHBondContact O-N 3.2Å; K567-L570 PolarHBondContact O-N 3.4Å; K567-R571 WeakPolarHBondContact O-CG 3.15Å; K567-R571 PolarHBondContact O-N 3.35Å; K567-E603 WeakPolarHBondContact CE-OE1 3.41Å; K567-E603 WeakPolarHBondContact CE-OE2 3.29Å; K567-E603 VanDerWaalsContact NZ-CD 3.33Å; K567-E603 IonicContact NZ-OE1 2.8Å; K567-E603 PolarHBondContact NZ-OE1 3.28Å; K567-E603 IonicContact NZ-OE2 2.88Å; K567-E603 PolarHBondContact NZ-OE2 2.86Å
568	R	88.5	Confident	84.8	Confident	166 Å²	166	71.3 Å²	71.3	63%	0.626	38%	0.384	S	S	*	.	H	α-helix	trans	-64.5	-43.5	174.6	-75.3	-172.6	-59.6	-93.4	4.4	111.7	G564 A565 V566 R571 A572	G564-R568 WeakPolarHBondContact O-CG 3.23Å; G564-R568 PolarHBondContact O-N 2.88Å; G564-R568 VanDerWaalsContact O-N 3.1Å; G564-R568 PolarHBondContact O-NH1 2.99Å; A565-R568 WeakPolarHBondContact O-CB 3.5Å; A565-R568 PolarHBondContact O-N 3.42Å; V566-R568 VanDerWaalsContact C-N 3.3Å; V566-R568 PolarHBondContact O-N 3.46Å; R568-R571 PolarHBondContact O-N 3.47Å; R568-A572 WeakPolarHBondContact O-CB 3.45Å; R568-A572 PolarHBondContact O-N 3.08Å; R568-A572 VanDerWaalsContact O-N 3.15Å
569	I	89.4	Confident	84.8	Confident	52 Å²	52	73.2 Å²	73.2	27%	0.267	40%	0.399	S	S	.	.	H	α-helix	trans	-65.4	-41.1	177.5	-60.6	167.2	0	0	0	110.6	A565 V566 R571 A572 R585 I588 L589 L592	A565-I569 WeakPolarHBondContact O-CG1 3.41Å; A565-I569 PolarHBondContact O-N 3.1Å; V566-I569 PolarHBondContact O-N 3.11Å; V566-I569 VanDerWaalsContact O-N 3.12Å; I569-R571 PolarHBondContact O-N 2.9Å; I569-A572 PolarHBondContact O-N 3.42Å; I569-R585 HydrophobicContact CG2-CG 4.07Å; I569-R585 PolarHBondContact O-NE 3Å; I569-I588 HydrophobicContact CD1-CG2 4.46Å; I569-L589 HydrophobicContact CB-CD2 4.1Å; I569-L589 HydrophobicContact CG2-CD1 4.23Å; I569-L589 HydrophobicContact CG2-CD2 3.64Å; I569-L589 HydrophobicContact CG2-CG 3.81Å; I569-L592 HydrophobicContact CD1-CD1 3.95Å
570	L	88.4	Confident	84.7	Confident	7 Å²	7	72.5 Å²	72.5	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-59.8	-46.9	175.5	-71.6	169.6	0	0	0	111.5	V566 K567 A572 R585 L589 V604 F607	V566-L570 HydrophobicContact CG1-CD1 4.02Å; V566-L570 HydrophobicContact CG1-CG 4.27Å; V566-L570 WeakPolarHBondContact O-CG 3.37Å; V566-L570 PolarHBondContact O-N 3.22Å; K567-L570 PolarHBondContact O-N 3.4Å; L570-A572 VanDerWaalsContact C-N 3.26Å; L570-A572 PolarHBondContact O-N 2.79Å; L570-R585 PolarHBondContact O-NH2 3.1Å; L570-L589 HydrophobicContact CD2-CD1 3.82Å; L570-L589 HydrophobicContact CD2-CD2 3.85Å; L570-L589 HydrophobicContact CD2-CG 4.47Å; L570-L589 HydrophobicContact CG-CD2 4.07Å; L570-V604 HydrophobicContact CD1-CG2 4.12Å; L570-V604 HydrophobicContact CD2-CG2 4.17Å; L570-F607 HydrophobicContact CB-CD2 4.2Å; L570-F607 HydrophobicContact CB-CE2 4.23Å; L570-F607 HydrophobicContact CB-CG 4.43Å; L570-F607 HydrophobicContact CB-CZ 4.5Å; L570-F607 HydrophobicContact CD1-CB 4.41Å; L570-F607 HydrophobicContact CD2-CB 4.32Å; L570-F607 HydrophobicContact CD2-CD1 3.6Å; L570-F607 HydrophobicContact CD2-CD2 4.46Å; L570-F607 HydrophobicContact CD2-CE1 3.96Å; L570-F607 HydrophobicContact CD2-CG 3.87Å; L570-F607 WeakPolarHBondContact O-CZ 3.46Å
571	R	88.4	Confident	84.8	Confident	203 Å²	203	71.3 Å²	71.3	77%	0.766	40%	0.404	S	S	*	.	H	α-helix	trans	-71.5	-16.1	-179.6	-69.2	175.7	-176.8	171.4	0.5	114.5	K567 R568 I569 E573	K567-R571 WeakPolarHBondContact O-CG 3.15Å; K567-R571 PolarHBondContact O-N 3.35Å; R568-R571 PolarHBondContact O-N 3.47Å; I569-R571 PolarHBondContact O-N 2.9Å; R571-E573 PolarHBondContact O-N 3.18Å
572	A	88.3	Confident	84.9	Confident	31 Å²	31	68.4 Å²	68.4	26%	0.256	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	6.1	-179.7	0	0	0	0	0	114.5	R568 I569 L570 K574 A575 V576	R568-A572 WeakPolarHBondContact O-CB 3.45Å; R568-A572 PolarHBondContact O-N 3.08Å; R568-A572 VanDerWaalsContact O-N 3.15Å; I569-A572 PolarHBondContact O-N 3.42Å; L570-A572 VanDerWaalsContact C-N 3.26Å; L570-A572 PolarHBondContact O-N 2.79Å; A572-K574 PolarHBondContact O-N 3.16Å; A572-A575 PolarHBondContact O-N 3.19Å; A572-V576 HydrophobicContact CB-CG2 4.02Å; A572-V576 WeakPolarHBondContact O-CB 3.49Å; A572-V576 WeakPolarHBondContact O-CG2 3.29Å; A572-V576 PolarHBondContact O-N 3.42Å
573	E	85.9	Confident	85.1	Confident	46 Å²	46	70 Å²	70	22%	0.215	40%	0.404	C	S	.	.	H	α-helix	trans	-44.9	-58.1	-177.1	-179.3	170.7	-133.6	0	0	113.8	R571 A575 V576 A577 R615	R571-E573 PolarHBondContact O-N 3.18Å; E573-A575 PolarHBondContact O-N 2.82Å; E573-V576 PolarHBondContact O-N 3.07Å; E573-A577 WeakPolarHBondContact O-CB 3.49Å; E573-A577 PolarHBondContact O-N 3.31Å; E573-R615 IonicContact OE1-NE 3.25Å; E573-R615 PolarHBondContact OE1-NE 3.41Å; E573-R615 IonicContact OE2-CZ 2.68Å; E573-R615 IonicContact OE2-NE 2.8Å; E573-R615 PolarHBondContact OE2-NE 3.38Å; E573-R615 IonicContact OE2-NH2 3.36Å; E573-R615 PolarHBondContact OE2-NH2 2.91Å
574	K	83.9	Confident	85.3	Confident	171 Å²	171	71.6 Å²	71.6	74%	0.743	42%	0.416	S	S	*	.	H	α-helix	trans	-65.9	-41.2	-177.5	-65.1	-174.6	178.6	-177.2	0	112.6	A572 A577 C578	A572-K574 PolarHBondContact O-N 3.16Å; K574-A577 PolarHBondContact O-N 3.48Å; K574-C578 PolarHBondContact O-N 2.8Å; K574-C578 PolarHBondContact O-SG 2.8Å; K574-C578 VanDerWaalsContact O-SG 3.34Å
575	A	83.6	Confident	85.7	Confident	72 Å²	72	71.7 Å²	71.7	60%	0.595	41%	0.41	S	S	*	.	H	α-helix	trans	-66.2	-39.5	-178.6	0	0	0	0	0	112.1	A572 E573	A572-A575 PolarHBondContact O-N 3.19Å; E573-A575 PolarHBondContact O-N 2.82Å
576	V	83.9	Confident	85.9	Confident	35 Å²	35	71 Å²	71	21%	0.212	40%	0.401	C	S	.	.	H	α-helix	trans	-79	-29	179.6	177.6	0	0	0	0	111.9	A572 E573 C578 S579 G580 A581 R585	A572-V576 HydrophobicContact CB-CG2 4.02Å; A572-V576 WeakPolarHBondContact O-CB 3.49Å; A572-V576 WeakPolarHBondContact O-CG2 3.29Å; A572-V576 PolarHBondContact O-N 3.42Å; E573-V576 PolarHBondContact O-N 3.07Å; V576-C578 VanDerWaalsContact C-N 3.33Å; V576-S579 PolarHBondContact O-N 3.49Å; V576-S579 PolarHBondContact O-OG 3.36Å; V576-G580 PolarHBondContact O-N 3.39Å; V576-A581 VanDerWaalsContact CG1-C 3.45Å; V576-A581 HydrophobicContact CG1-CB 3.92Å; V576-A581 WeakPolarHBondContact CG1-O 3.41Å; V576-A581 PolarHBondContact O-N 2.97Å; V576-R585 HydrophobicContact CG1-CB 4.01Å
577	A	79.3	Confident	86	Confident	59 Å²	59	77.8 Å²	77.8	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-42.6	172.1	0	0	0	0	0	111.5	E573 K574 S579 G580	E573-A577 WeakPolarHBondContact O-CB 3.49Å; E573-A577 PolarHBondContact O-N 3.31Å; K574-A577 PolarHBondContact O-N 3.48Å; A577-S579 PolarHBondContact O-N 2.88Å; A577-G580 PolarHBondContact O-N 3.48Å
578	C	80.3	Confident	86.1	Confident	121 Å²	121	78.6 Å²	78.6	82%	0.818	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.1	176.5	-64.1	0	0	0	0	114	K574 V576	K574-C578 PolarHBondContact O-N 2.8Å; K574-C578 PolarHBondContact O-SG 2.8Å; K574-C578 VanDerWaalsContact O-SG 3.34Å; V576-C578 VanDerWaalsContact C-N 3.33Å
579	S	80.7	Confident	86.2	Confident	83 Å²	83	70.7 Å²	70.7	58%	0.58	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	3.9	179.5	80.1	0	0	0	0	113.7	V576 A577 A581	V576-S579 PolarHBondContact O-N 3.49Å; V576-S579 PolarHBondContact O-OG 3.36Å; A577-S579 PolarHBondContact O-N 2.88Å; S579-A581 PolarHBondContact O-N 3.46Å
580	G	79.6	Confident	86.2	Confident	69 Å²	69	68.4 Å²	68.4	71%	0.711	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	3.2	-177	0	0	0	0	0	115.2	V576 A577	V576-G580 PolarHBondContact O-N 3.39Å; A577-G580 PolarHBondContact O-N 3.48Å
581	A	86.1	Confident	86.1	Confident	35 Å²	35	69.7 Å²	69.7	29%	0.289	41%	0.405	S	S	.	.			trans	-97.1	19.6	-174.5	0	0	0	0	0	113.6	V576 S579 Q583 V584 R585	V576-A581 VanDerWaalsContact CG1-C 3.45Å; V576-A581 HydrophobicContact CG1-CB 3.92Å; V576-A581 WeakPolarHBondContact CG1-O 3.41Å; V576-A581 PolarHBondContact O-N 2.97Å; S579-A581 PolarHBondContact O-N 3.46Å; A581-Q583 VanDerWaalsContact C-N 3.3Å; A581-Q583 PolarHBondContact O-N 3.47Å; A581-V584 PolarHBondContact O-N 2.88Å; A581-V584 VanDerWaalsContact O-N 3.14Å; A581-R585 PolarHBondContact O-N 3.1Å; A581-R585 VanDerWaalsContact O-N 3.16Å
582	A	85.9	Confident	86	Confident	35 Å²	35	62 Å²	62	29%	0.289	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-41.9	-177.5	0	0	0	0	0	112.7	V584 R585 I586	A582-V584 VanDerWaalsContact C-N 3.33Å; A582-V584 PolarHBondContact O-N 3.32Å; A582-R585 WeakPolarHBondContact O-CB 3.39Å; A582-R585 PolarHBondContact O-N 2.95Å; A582-I586 WeakPolarHBondContact O-CG1 3.19Å; A582-I586 PolarHBondContact O-N 3.06Å
583	Q	86.8	Confident	85.8	Confident	110 Å²	110	60.6 Å²	60.6	51%	0.514	37%	0.367	S	S	.	.	H	α-helix	trans	-65.9	-34.8	179.4	-64.7	-58.1	-23.7	0	0	112.8	A581 I586 K587	A581-Q583 VanDerWaalsContact C-N 3.3Å; A581-Q583 PolarHBondContact O-N 3.47Å; Q583-I586 PolarHBondContact O-N 3Å; Q583-K587 WeakPolarHBondContact O-CG 3.28Å; Q583-K587 PolarHBondContact O-N 3Å
584	V	88.9	Confident	85.7	Confident	87 Å²	87	59.2 Å²	59.2	53%	0.527	36%	0.362	S	S	.	.	H	α-helix	trans	-67.2	-43.3	176	-178.5	0	0	0	0	110.2	A581 A582 I586 K587 I588	A581-V584 PolarHBondContact O-N 2.88Å; A581-V584 VanDerWaalsContact O-N 3.14Å; A582-V584 VanDerWaalsContact C-N 3.33Å; A582-V584 PolarHBondContact O-N 3.32Å; V584-I586 VanDerWaalsContact C-N 3.33Å; V584-I586 PolarHBondContact O-N 3.3Å; V584-K587 PolarHBondContact O-N 3.33Å; V584-I588 HydrophobicContact CG1-CD1 3.85Å; V584-I588 HydrophobicContact CG1-CG1 4.41Å; V584-I588 VanDerWaalsContact O-CG1 3.28Å; V584-I588 WeakPolarHBondContact O-CG1 3.41Å; V584-I588 PolarHBondContact O-N 3.18Å
585	R	90.8	Very high	85.6	Confident	21 Å²	21	57.4 Å²	57.4	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-58.7	-43.9	174.7	171.3	-179.4	166.9	-84.2	-0.5	111.8	I569 L570 V576 A581 A582 I588 L589	I569-R585 HydrophobicContact CG2-CG 4.07Å; I569-R585 PolarHBondContact O-NE 3Å; L570-R585 PolarHBondContact O-NH2 3.1Å; V576-R585 HydrophobicContact CG1-CB 4.01Å; A581-R585 PolarHBondContact O-N 3.1Å; A581-R585 VanDerWaalsContact O-N 3.16Å; A582-R585 WeakPolarHBondContact O-CB 3.39Å; A582-R585 PolarHBondContact O-N 2.95Å; R585-I588 PolarHBondContact O-N 2.96Å; R585-L589 HydrophobicContact CG-CD1 3.92Å; R585-L589 HydrophobicContact CG-CG 4.49Å; R585-L589 WeakPolarHBondContact O-CB 3.31Å; R585-L589 WeakPolarHBondContact O-CG 3.38Å; R585-L589 PolarHBondContact O-N 3.37Å
586	I	90.9	Very high	85.1	Confident	19 Å²	19	58 Å²	58	10%	0.097	35%	0.345	C	S	.	.	H	α-helix	trans	-60.2	-49	177.7	-70.4	167.9	0	0	0	110.7	A582 Q583 V584 I588 L589 A590 D617 L618 A621	A582-I586 WeakPolarHBondContact O-CG1 3.19Å; A582-I586 PolarHBondContact O-N 3.06Å; Q583-I586 PolarHBondContact O-N 3Å; V584-I586 VanDerWaalsContact C-N 3.33Å; V584-I586 PolarHBondContact O-N 3.3Å; I586-I588 VanDerWaalsContact C-N 3.35Å; I586-I588 PolarHBondContact O-N 3.48Å; I586-L589 PolarHBondContact O-N 3.36Å; I586-A590 WeakPolarHBondContact O-CB 3.29Å; I586-A590 PolarHBondContact O-N 2.99Å; I586-D617 HydrophobicContact CD1-CB 4Å; I586-L618 HydrophobicContact CG2-CD1 4.15Å; I586-A621 HydrophobicContact CG2-CB 3.38Å
587	K	89.4	Confident	84.4	Confident	151 Å²	151	61.1 Å²	61.1	66%	0.657	36%	0.361	S	S	*	.	H	α-helix	trans	-60.1	-42.7	177.4	-72.1	-178.9	179.9	-176.8	0	112.5	Q583 V584 S591	Q583-K587 WeakPolarHBondContact O-CG 3.28Å; Q583-K587 PolarHBondContact O-N 3Å; V584-K587 PolarHBondContact O-N 3.33Å; K587-S591 VanDerWaalsContact O-CB 3.31Å; K587-S591 WeakPolarHBondContact O-CB 3.06Å; K587-S591 PolarHBondContact O-N 3.48Å
588	I	89.4	Confident	83.5	Confident	77 Å²	77	63.5 Å²	63.5	40%	0.395	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-48.8	176.5	-70.1	167.8	0	0	0	110.1	I569 V584 R585 I586 S591 L592	I569-I588 HydrophobicContact CD1-CG2 4.46Å; V584-I588 HydrophobicContact CG1-CD1 3.85Å; V584-I588 HydrophobicContact CG1-CG1 4.41Å; V584-I588 VanDerWaalsContact O-CG1 3.28Å; V584-I588 WeakPolarHBondContact O-CG1 3.41Å; V584-I588 PolarHBondContact O-N 3.18Å; R585-I588 PolarHBondContact O-N 2.96Å; I586-I588 VanDerWaalsContact C-N 3.35Å; I586-I588 PolarHBondContact O-N 3.48Å; I588-S591 PolarHBondContact O-N 3.35Å; I588-L592 HydrophobicContact CG2-CD1 3.64Å; I588-L592 HydrophobicContact CG2-CG 4.17Å; I588-L592 WeakPolarHBondContact O-CB 3.48Å; I588-L592 WeakPolarHBondContact O-CG 3.37Å; I588-L592 PolarHBondContact O-N 3.31Å
589	L	89.3	Confident	82.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-47.2	179.9	-74.3	169.1	0	0	0	112	V566 I569 L570 R585 I586 S591 L592 V593 L618	V566-L589 HydrophobicContact CG1-CD2 4.27Å; I569-L589 HydrophobicContact CB-CD2 4.1Å; I569-L589 HydrophobicContact CG2-CD1 4.23Å; I569-L589 HydrophobicContact CG2-CD2 3.64Å; I569-L589 HydrophobicContact CG2-CG 3.81Å; L570-L589 HydrophobicContact CD2-CD1 3.82Å; L570-L589 HydrophobicContact CD2-CD2 3.85Å; L570-L589 HydrophobicContact CD2-CG 4.47Å; L570-L589 HydrophobicContact CG-CD2 4.07Å; R585-L589 HydrophobicContact CG-CD1 3.92Å; R585-L589 HydrophobicContact CG-CG 4.49Å; R585-L589 WeakPolarHBondContact O-CB 3.31Å; R585-L589 WeakPolarHBondContact O-CG 3.38Å; R585-L589 PolarHBondContact O-N 3.37Å; I586-L589 PolarHBondContact O-N 3.36Å; L589-S591 VanDerWaalsContact C-N 3.33Å; L589-S591 PolarHBondContact O-N 2.9Å; L589-L592 PolarHBondContact O-N 3.47Å; L589-V593 WeakPolarHBondContact O-CG2 3.33Å; L589-V593 PolarHBondContact O-N 2.84Å; L589-L618 HydrophobicContact CB-CD1 3.76Å; L589-L618 HydrophobicContact CD1-CD1 4.2Å; L589-L618 HydrophobicContact CD1-CD2 4.18Å
590	A	89.4	Confident	82.9	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.033	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-42.8	177.6	0	0	0	0	0	112	I586 T594 A621 Q625	I586-A590 WeakPolarHBondContact O-CB 3.29Å; I586-A590 PolarHBondContact O-N 2.99Å; A590-T594 VanDerWaalsContact O-CG2 3.32Å; A590-T594 WeakPolarHBondContact O-CG2 3.41Å; A590-T594 PolarHBondContact O-N 3.16Å; A590-T594 PolarHBondContact O-OG1 3.25Å; A590-A621 HydrophobicContact CB-CB 4.04Å; A590-Q625 HydrophobicContact CB-CB 4.3Å
591	S	87.4	Confident	83.1	Confident	35 Å²	35	54.3 Å²	54.3	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-65.9	-44.6	176.7	-172.7	0	0	0	0	112.5	K587 I588 L589 V593 T594 Q595	K587-S591 VanDerWaalsContact O-CB 3.31Å; K587-S591 WeakPolarHBondContact O-CB 3.06Å; K587-S591 PolarHBondContact O-N 3.48Å; I588-S591 PolarHBondContact O-N 3.35Å; L589-S591 VanDerWaalsContact C-N 3.33Å; L589-S591 PolarHBondContact O-N 2.9Å; S591-V593 PolarHBondContact O-N 3.49Å; S591-T594 WeakPolarHBondContact CA-OG1 3.2Å; S591-T594 PolarHBondContact O-N 3.5Å; S591-T594 PolarHBondContact O-OG1 2.87Å; S591-Q595 WeakPolarHBondContact O-CB 3.44Å; S591-Q595 VanDerWaalsContact O-CG 3.26Å; S591-Q595 WeakPolarHBondContact O-CG 3.36Å; S591-Q595 PolarHBondContact O-N 3.48Å; S591-Q595 PolarHBondContact OG-NE2 2.98Å; S591-Q595 VanDerWaalsContact OG-NE2 3.13Å
592	L	85.9	Confident	83.1	Confident	42 Å²	42	55.7 Å²	55.7	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-41.8	178.2	-72.5	174	0	0	0	112.1	V566 I569 I588 L589 T594 F596	V566-L592 HydrophobicContact CG2-CD1 4.45Å; I569-L592 HydrophobicContact CD1-CD1 3.95Å; I588-L592 HydrophobicContact CG2-CD1 3.64Å; I588-L592 HydrophobicContact CG2-CG 4.17Å; I588-L592 WeakPolarHBondContact O-CB 3.48Å; I588-L592 WeakPolarHBondContact O-CG 3.37Å; I588-L592 PolarHBondContact O-N 3.31Å; L589-L592 PolarHBondContact O-N 3.47Å; L592-T594 VanDerWaalsContact C-N 3.32Å; L592-T594 PolarHBondContact O-N 3.02Å; L592-F596 HydrophobicContact CD2-CD2 3.99Å; L592-F596 HydrophobicContact CD2-CE2 3.64Å; L592-F596 WeakPolarHBondContact O-CB 3.5Å; L592-F596 VanDerWaalsContact O-CD2 3.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.49Å; L592-F596 PolarHBondContact O-N 3.35Å; L592-F596 VanDerWaalsContact O-N 3.1Å
593	V	84.9	Confident	83.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-70.8	-30.7	-177.6	179.9	0	0	0	0	112.3	L589 S591 K601 V604 W622	L589-V593 WeakPolarHBondContact O-CG2 3.33Å; L589-V593 PolarHBondContact O-N 2.84Å; S591-V593 PolarHBondContact O-N 3.49Å; V593-K601 HydrophobicContact CG1-CB 4.44Å; V593-K601 HydrophobicContact CG1-CG 3.71Å; V593-V604 HydrophobicContact CG2-CB 4.06Å; V593-V604 HydrophobicContact CG2-CG1 4.27Å; V593-V604 HydrophobicContact CG2-CG2 3.47Å; V593-V604 VanDerWaalsContact CG2-CG2 3.47Å; V593-W622 HydrophobicContact CG1-CD2 4.12Å; V593-W622 HydrophobicContact CG1-CH2 4.39Å; V593-W622 HydrophobicContact CG1-CZ2 3.56Å
594	T	83.1	Confident	83.2	Confident	17 Å²	17	51.7 Å²	51.7	10%	0.104	29%	0.29	C	S	.	.	H	α-helix	trans	-80	-31.1	178.1	50.7	0	0	0	0	113	A590 S591 L592 Q625 E626	A590-T594 VanDerWaalsContact O-CG2 3.32Å; A590-T594 WeakPolarHBondContact O-CG2 3.41Å; A590-T594 PolarHBondContact O-N 3.16Å; A590-T594 PolarHBondContact O-OG1 3.25Å; S591-T594 WeakPolarHBondContact CA-OG1 3.2Å; S591-T594 PolarHBondContact O-N 3.5Å; S591-T594 PolarHBondContact O-OG1 2.87Å; L592-T594 VanDerWaalsContact C-N 3.32Å; L592-T594 PolarHBondContact O-N 3.02Å; T594-Q625 HydrophobicContact CG2-CB 3.87Å; T594-Q625 HydrophobicContact CG2-CG 3.58Å; T594-Q625 WeakPolarHBondContact OG1-CG 3.3Å; T594-E626 HydrophobicContact CG2-CB 4.43Å; T594-E626 HydrophobicContact CG2-CG 3.58Å; T594-E626 WeakPolarHBondContact CG2-OE1 3.4Å
595	Q	81.7	Confident	83.2	Confident	133 Å²	133	48.6 Å²	48.6	62%	0.621	27%	0.27	S	S	*	.	H	α-helix	trans	-86	-29.2	-178.8	-69	-179.9	9.8	0	0	114.1	S591	S591-Q595 WeakPolarHBondContact O-CB 3.44Å; S591-Q595 VanDerWaalsContact O-CG 3.26Å; S591-Q595 WeakPolarHBondContact O-CG 3.36Å; S591-Q595 PolarHBondContact O-N 3.48Å; S591-Q595 PolarHBondContact OG-NE2 2.98Å; S591-Q595 VanDerWaalsContact OG-NE2 3.13Å
596	F	74.3	Confident	83.2	Confident	85 Å²	85	50.1 Å²	50.1	37%	0.373	28%	0.284	S	S	.	.	S	Bend	trans	-111.5	126.4	-175.7	-65.2	-79.9	0	0	0	111.4	L592 L600	L592-F596 HydrophobicContact CD2-CD2 3.99Å; L592-F596 HydrophobicContact CD2-CE2 3.64Å; L592-F596 WeakPolarHBondContact O-CB 3.5Å; L592-F596 VanDerWaalsContact O-CD2 3.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.49Å; L592-F596 PolarHBondContact O-N 3.35Å; L592-F596 VanDerWaalsContact O-N 3.1Å; F596-L600 HydrophobicContact CB-CD1 3.72Å
597	N	68.6	Low	83.1	Confident	100 Å²	100	50 Å²	50	54%	0.535	28%	0.283	S	S	.	.			trans	-94.8	154.5	-174.1	-101	-1.7	0	0	0	115.1
598	S	59.7	Low	83.1	Confident	109 Å²	109	43 Å²	43	76%	0.762	25%	0.252	S	S	*	.	S	Bend	trans	49.6	99.6	173.2	62.3	0	0	0	0	117.9
599	G	68.3	Low	83.1	Confident	43 Å²	43	40.6 Å²	40.6	44%	0.443	24%	0.24	S	C	.	.	S	Bend	trans	130.7	-43.8	173.1	0	0	0	0	0	112.4
600	L	80.1	Confident	83	Confident	13 Å²	13	47 Å²	47	7%	0.068	27%	0.27	C	S	.	.	H	α-helix	trans	-69.7	-36.2	-179.2	-61.7	177.7	0	0	0	113.3	L563 V566 F596 A602 E603 V604	L563-L600 HydrophobicContact CD1-CD2 3.85Å; V566-L600 HydrophobicContact CB-CD2 3.84Å; V566-L600 HydrophobicContact CG1-CD2 4.15Å; V566-L600 HydrophobicContact CG2-CD1 4.08Å; V566-L600 HydrophobicContact CG2-CD2 3.7Å; V566-L600 HydrophobicContact CG2-CG 4.5Å; F596-L600 HydrophobicContact CB-CD1 3.72Å; L600-A602 VanDerWaalsContact C-N 3.31Å; L600-A602 PolarHBondContact O-N 2.96Å; L600-E603 PolarHBondContact O-N 3.17Å; L600-V604 WeakPolarHBondContact O-CG2 3.3Å; L600-V604 PolarHBondContact O-N 3.27Å
601	K	84.8	Confident	82.9	Confident	25 Å²	25	50.3 Å²	50.3	11%	0.109	29%	0.287	C	S	.	.	H	α-helix	trans	-58.4	-41.9	178.7	-65.5	-168.4	169.8	-160.2	0	112.2	V593 L605 W622 E626	V593-K601 HydrophobicContact CG1-CB 4.44Å; V593-K601 HydrophobicContact CG1-CG 3.71Å; K601-L605 WeakPolarHBondContact O-CB 3.34Å; K601-L605 PolarHBondContact O-N 3.42Å; K601-W622 HydrophobicContact CB-CH2 4.05Å; K601-W622 HydrophobicContact CB-CZ2 3.92Å; K601-W622 HydrophobicContact CD-CZ2 4.08Å; K601-W622 HydrophobicContact CG-CH2 4.43Å; K601-W622 HydrophobicContact CG-CZ2 3.79Å; K601-E626 VanDerWaalsContact CE-OE1 3.31Å; K601-E626 WeakPolarHBondContact CE-OE1 3.39Å; K601-E626 IonicContact NZ-OE1 3.36Å; K601-E626 PolarHBondContact NZ-OE1 3.5Å; K601-E626 IonicContact NZ-OE2 2.7Å
602	A	85.9	Confident	82.8	Confident	64 Å²	64	49.6 Å²	49.6	53%	0.529	28%	0.281	S	S	.	.	H	α-helix	trans	-66.2	-39.9	179.3	0	0	0	0	0	112.1	L600 L605 S606	L600-A602 VanDerWaalsContact C-N 3.31Å; L600-A602 PolarHBondContact O-N 2.96Å; A602-L605 PolarHBondContact O-N 2.99Å; A602-S606 WeakPolarHBondContact O-CB 3.3Å; A602-S606 PolarHBondContact O-N 3.39Å; A602-S606 PolarHBondContact O-OG 2.85Å
603	E	86.8	Confident	82.7	Confident	60 Å²	60	55.9 Å²	55.9	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-75	-35.5	-178.1	-69.8	-90.6	-170.1	0	0	112.6	L563 K567 L600 S606 F607	L563-E603 HydrophobicContact CD1-CG 3.92Å; K567-E603 WeakPolarHBondContact CE-OE1 3.41Å; K567-E603 WeakPolarHBondContact CE-OE2 3.29Å; K567-E603 VanDerWaalsContact NZ-CD 3.33Å; K567-E603 IonicContact NZ-OE1 2.8Å; K567-E603 PolarHBondContact NZ-OE1 3.28Å; K567-E603 IonicContact NZ-OE2 2.88Å; K567-E603 PolarHBondContact NZ-OE2 2.86Å; L600-E603 PolarHBondContact O-N 3.17Å; E603-S606 WeakPolarHBondContact CA-OG 3.16Å; E603-S606 PolarHBondContact O-OG 3.11Å; E603-F607 VanDerWaalsContact O-CB 3.27Å; E603-F607 WeakPolarHBondContact O-CB 3.4Å; E603-F607 PolarHBondContact O-N 2.86Å
604	V	88.1	Confident	82.7	Confident	1 Å²	1	59 Å²	59	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-71.4	-38.9	172.1	175.1	0	0	0	0	110.9	V566 L570 V593 L600 F607 I608 L618 W622	V566-V604 HydrophobicContact CG1-CG2 4.37Å; L570-V604 HydrophobicContact CD1-CG2 4.12Å; L570-V604 HydrophobicContact CD2-CG2 4.17Å; V593-V604 HydrophobicContact CG2-CB 4.06Å; V593-V604 HydrophobicContact CG2-CG1 4.27Å; V593-V604 HydrophobicContact CG2-CG2 3.47Å; V593-V604 VanDerWaalsContact CG2-CG2 3.47Å; L600-V604 WeakPolarHBondContact O-CG2 3.3Å; L600-V604 PolarHBondContact O-N 3.27Å; V604-F607 PolarHBondContact O-N 2.81Å; V604-I608 HydrophobicContact CG1-CD1 3.85Å; V604-I608 HydrophobicContact CG1-CG1 4.42Å; V604-I608 VanDerWaalsContact O-CG1 3.27Å; V604-I608 WeakPolarHBondContact O-CG1 3.42Å; V604-I608 PolarHBondContact O-N 3.24Å; V604-L618 HydrophobicContact CG1-CD2 4.34Å; V604-W622 HydrophobicContact CG1-CE3 4.17Å; V604-W622 HydrophobicContact CG1-CZ3 4.36Å
605	L	88.9	Confident	83	Confident	22 Å²	22	59.7 Å²	59.7	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-60.7	-49.3	173.2	180	67.3	0	0	0	111.4	K601 A602 F607 I608 L609 W622 R648 L649	K601-L605 WeakPolarHBondContact O-CB 3.34Å; K601-L605 PolarHBondContact O-N 3.42Å; A602-L605 PolarHBondContact O-N 2.99Å; L605-F607 VanDerWaalsContact C-N 3.29Å; L605-F607 PolarHBondContact O-N 3.31Å; L605-I608 PolarHBondContact O-N 3.32Å; L605-L609 HydrophobicContact CD1-CD1 3.95Å; L605-L609 HydrophobicContact CD1-CG 4.15Å; L605-L609 HydrophobicContact CG-CD1 3.85Å; L605-L609 HydrophobicContact CG-CG 4.37Å; L605-L609 WeakPolarHBondContact O-CB 3.26Å; L605-L609 VanDerWaalsContact O-CG 3.27Å; L605-L609 WeakPolarHBondContact O-CG 3.36Å; L605-L609 PolarHBondContact O-N 2.86Å; L605-W622 HydrophobicContact CB-CZ3 4.3Å; L605-R648 HydrophobicContact CD2-CB 3.82Å; L605-R648 HydrophobicContact CD2-CG 4.49Å; L605-L649 HydrophobicContact CD1-CD2 3.68Å; L605-L649 HydrophobicContact CD1-CG 4.18Å
606	S	89.3	Confident	83.4	Confident	52 Å²	52	54 Å²	54	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-41.6	177.9	65.4	0	0	0	0	111.4	A602 E603 I608 L609 E610	A602-S606 WeakPolarHBondContact O-CB 3.3Å; A602-S606 PolarHBondContact O-N 3.39Å; A602-S606 PolarHBondContact O-OG 2.85Å; E603-S606 WeakPolarHBondContact CA-OG 3.16Å; E603-S606 PolarHBondContact O-OG 3.11Å; S606-I608 PolarHBondContact O-N 3.44Å; S606-L609 PolarHBondContact O-N 2.86Å; S606-E610 WeakPolarHBondContact O-CG 3.23Å; S606-E610 PolarHBondContact O-N 3.22Å
607	F	89.7	Confident	84.1	Confident	18 Å²	18	54.3 Å²	54.3	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-43	175.2	-178.9	-97.8	0	0	0	112.4	L570 E603 V604 L605 R615 L618	L570-F607 HydrophobicContact CB-CD2 4.2Å; L570-F607 HydrophobicContact CB-CE2 4.23Å; L570-F607 HydrophobicContact CB-CG 4.43Å; L570-F607 HydrophobicContact CB-CZ 4.5Å; L570-F607 HydrophobicContact CD1-CB 4.41Å; L570-F607 HydrophobicContact CD2-CB 4.32Å; L570-F607 HydrophobicContact CD2-CD1 3.6Å; L570-F607 HydrophobicContact CD2-CD2 4.46Å; L570-F607 HydrophobicContact CD2-CE1 3.96Å; L570-F607 HydrophobicContact CD2-CG 3.87Å; L570-F607 WeakPolarHBondContact O-CZ 3.46Å; E603-F607 VanDerWaalsContact O-CB 3.27Å; E603-F607 WeakPolarHBondContact O-CB 3.4Å; E603-F607 PolarHBondContact O-N 2.86Å; V604-F607 PolarHBondContact O-N 2.81Å; L605-F607 VanDerWaalsContact C-N 3.29Å; L605-F607 PolarHBondContact O-N 3.31Å; F607-R615 VanDerWaalsContact CE1-CD 3.49Å; F607-R615 HydrophobicContact CE1-CG 4.18Å; F607-R615 VanDerWaalsContact CZ-NE 3.26Å; F607-R615 VanDerWaalsContact O-CD 3.23Å; F607-R615 WeakPolarHBondContact O-CD 3.46Å; F607-R615 PolarHBondContact O-NH1 3Å; F607-L618 HydrophobicContact CD1-CD2 4.17Å; F607-L618 HydrophobicContact CE1-CD2 4.26Å
608	I	89.8	Confident	85.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-44.4	175.6	-69.1	163.7	0	0	0	110.3	V604 L605 S606 E610 D611 V612 L618 A619 W622 L649	V604-I608 HydrophobicContact CG1-CD1 3.85Å; V604-I608 HydrophobicContact CG1-CG1 4.42Å; V604-I608 VanDerWaalsContact O-CG1 3.27Å; V604-I608 WeakPolarHBondContact O-CG1 3.42Å; V604-I608 PolarHBondContact O-N 3.24Å; L605-I608 PolarHBondContact O-N 3.32Å; S606-I608 PolarHBondContact O-N 3.44Å; I608-E610 VanDerWaalsContact C-N 3.27Å; I608-E610 PolarHBondContact O-N 3.46Å; I608-D611 CarbonylContact O-C 3.5Å; I608-D611 VanDerWaalsContact O-C 3.24Å; I608-D611 PolarHBondContact O-N 3.5Å; I608-V612 VanDerWaalsContact O-CA 3.29Å; I608-V612 WeakPolarHBondContact O-CA 3.27Å; I608-V612 WeakPolarHBondContact O-CG2 3.43Å; I608-V612 PolarHBondContact O-N 3.05Å; I608-V612 VanDerWaalsContact O-N 3.11Å; I608-L618 HydrophobicContact CD1-CD2 4.4Å; I608-L618 HydrophobicContact CD1-CG 4.22Å; I608-L618 HydrophobicContact CG1-CD2 4.07Å; I608-L618 HydrophobicContact CG1-CG 4.31Å; I608-A619 HydrophobicContact CD1-CB 4.15Å; I608-A619 HydrophobicContact CG2-CB 3.99Å; I608-W622 HydrophobicContact CD1-CE3 4.02Å; I608-W622 HydrophobicContact CD1-CZ3 4.4Å; I608-L649 HydrophobicContact CD1-CD2 4.44Å; I608-L649 HydrophobicContact CG2-CD2 4.34Å
609	L	88.4	Confident	86.7	Confident	27 Å²	27	44.8 Å²	44.8	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-15.8	-176.8	-66.2	176.6	0	0	0	114.2	L605 S606 V612 L653 K656	L605-L609 HydrophobicContact CD1-CD1 3.95Å; L605-L609 HydrophobicContact CD1-CG 4.15Å; L605-L609 HydrophobicContact CG-CD1 3.85Å; L605-L609 HydrophobicContact CG-CG 4.37Å; L605-L609 WeakPolarHBondContact O-CB 3.26Å; L605-L609 VanDerWaalsContact O-CG 3.27Å; L605-L609 WeakPolarHBondContact O-CG 3.36Å; L605-L609 PolarHBondContact O-N 2.86Å; S606-L609 PolarHBondContact O-N 2.86Å; L609-V612 HydrophobicContact CD2-CG2 4.28Å; L609-L653 HydrophobicContact CD2-CD2 4.22Å; L609-L653 HydrophobicContact CD2-CG 4.42Å; L609-K656 WeakPolarHBondContact O-CE 3.28Å; L609-K656 PolarHBondContact O-NZ 3.11Å
610	E	88.3	Confident	87.9	Confident	135 Å²	135	44 Å²	44	63%	0.631	23%	0.233	S	C	*	.	H	α-helix	trans	-66.9	-42	170.7	-81.1	171.8	-171.9	0	0	112.3	S606 I608 R615	S606-E610 WeakPolarHBondContact O-CG 3.23Å; S606-E610 PolarHBondContact O-N 3.22Å; I608-E610 VanDerWaalsContact C-N 3.27Å; I608-E610 PolarHBondContact O-N 3.46Å; E610-R615 IonicContact OE2-NH1 2.72Å; E610-R615 PolarHBondContact OE2-NH1 3.34Å
611	D	86.1	Confident	88.4	Confident	73 Å²	73	44.7 Å²	44.7	39%	0.39	24%	0.24	S	C	.	.	S	Bend	trans	-145.7	78.2	178.8	-173.8	-8.2	0	0	0	110.3	I608 R613 A614 R615	I608-D611 CarbonylContact O-C 3.5Å; I608-D611 VanDerWaalsContact O-C 3.24Å; I608-D611 PolarHBondContact O-N 3.5Å; D611-R613 PolarHBondContact O-N 2.67Å; D611-R613 PolarHBondContact OD1-N 3.49Å; D611-A614 PolarHBondContact OD1-N 2.92Å; D611-A614 VanDerWaalsContact OD1-N 3.12Å; D611-A614 WeakPolarHBondContact OD2-CB 3.46Å; D611-R615 WeakPolarHBondContact O-CB 3.34Å; D611-R615 WeakPolarHBondContact O-CD 3.14Å; D611-R615 VanDerWaalsContact O-CG 3.26Å; D611-R615 WeakPolarHBondContact O-CG 3.11Å; D611-R615 PolarHBondContact O-N 2.83Å; D611-R615 VanDerWaalsContact O-N 3.12Å
612	V	85.4	Confident	88.8	Confident	20 Å²	20	43.7 Å²	43.7	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-35.5	-174.9	-174.8	0	0	0	0	111.2	I608 L609 R615 L616 L653 I663	I608-V612 VanDerWaalsContact O-CA 3.29Å; I608-V612 WeakPolarHBondContact O-CA 3.27Å; I608-V612 WeakPolarHBondContact O-CG2 3.43Å; I608-V612 PolarHBondContact O-N 3.05Å; I608-V612 VanDerWaalsContact O-N 3.11Å; L609-V612 HydrophobicContact CD2-CG2 4.28Å; V612-R615 CarbonylContact O-C 3.24Å; V612-R615 PolarHBondContact O-N 3.1Å; V612-L616 HydrophobicContact CG1-CD1 4.17Å; V612-L616 WeakPolarHBondContact O-CA 3.29Å; V612-L616 WeakPolarHBondContact O-CB 3.47Å; V612-L616 PolarHBondContact O-N 2.99Å; V612-L653 HydrophobicContact CB-CD2 4.23Å; V612-L653 HydrophobicContact CG1-CD2 3.58Å; V612-L653 HydrophobicContact CG2-CD2 3.72Å; V612-I663 HydrophobicContact CG1-CG2 3.6Å
613	R	84.6	Confident	89	Confident	175 Å²	175	40.7 Å²	40.7	66%	0.66	21%	0.211	S	C	*	.	H	α-helix	trans	-68.3	-45.6	-174	-174.4	171.8	177.4	156.7	-5.4	111.4	D611 R615 D661 I663	D611-R613 PolarHBondContact O-N 2.67Å; D611-R613 PolarHBondContact OD1-N 3.49Å; R613-R615 VanDerWaalsContact C-N 3.33Å; R613-D661 IonicContact CZ-OD2 2.6Å; R613-D661 IonicContact NH1-OD1 3.01Å; R613-D661 IonicContact NH1-OD2 3.25Å; R613-D661 PolarHBondContact NH1-OD2 3.03Å; R613-I663 HydrophobicContact CB-CD1 4.3Å
614	A	85.6	Confident	89.3	Confident	64 Å²	64	42.2 Å²	42.2	53%	0.529	22%	0.215	S	C	.	.	H	α-helix	trans	-74.3	-25.1	176.4	0	0	0	0	0	112.8	D611	D611-A614 PolarHBondContact OD1-N 2.92Å; D611-A614 VanDerWaalsContact OD1-N 3.12Å; D611-A614 WeakPolarHBondContact OD2-CB 3.46Å
615	R	89.6	Confident	89.4	Confident	32 Å²	32	45.6 Å²	45.6	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-108.6	13.4	-169.8	-59.2	168.9	176.7	166	3.7	114	E573 F607 E610 D611 V612 R613 D617 L618 A619	E573-R615 IonicContact OE1-NE 3.25Å; E573-R615 PolarHBondContact OE1-NE 3.41Å; E573-R615 IonicContact OE2-CZ 2.68Å; E573-R615 IonicContact OE2-NE 2.8Å; E573-R615 PolarHBondContact OE2-NE 3.38Å; E573-R615 IonicContact OE2-NH2 3.36Å; E573-R615 PolarHBondContact OE2-NH2 2.91Å; F607-R615 VanDerWaalsContact CE1-CD 3.49Å; F607-R615 HydrophobicContact CE1-CG 4.18Å; F607-R615 VanDerWaalsContact CZ-NE 3.26Å; F607-R615 VanDerWaalsContact O-CD 3.23Å; F607-R615 WeakPolarHBondContact O-CD 3.46Å; F607-R615 PolarHBondContact O-NH1 3Å; E610-R615 IonicContact OE2-NH1 2.72Å; E610-R615 PolarHBondContact OE2-NH1 3.34Å; D611-R615 WeakPolarHBondContact O-CB 3.34Å; D611-R615 WeakPolarHBondContact O-CD 3.14Å; D611-R615 VanDerWaalsContact O-CG 3.26Å; D611-R615 WeakPolarHBondContact O-CG 3.11Å; D611-R615 PolarHBondContact O-N 2.83Å; D611-R615 VanDerWaalsContact O-N 3.12Å; V612-R615 CarbonylContact O-C 3.24Å; V612-R615 PolarHBondContact O-N 3.1Å; R613-R615 VanDerWaalsContact C-N 3.33Å; R615-D617 VanDerWaalsContact C-N 3.29Å; R615-D617 PolarHBondContact O-N 2.93Å; R615-L618 WeakPolarHBondContact O-CB 3.38Å; R615-L618 PolarHBondContact O-N 3.37Å; R615-L618 VanDerWaalsContact O-N 3.13Å; R615-A619 PolarHBondContact O-N 3.43Å
616	L	88.8	Confident	89.4	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-61.4	-37.6	-176.6	-164.5	68.6	0	0	0	112.5	V612 L618 A619 F620 I663 K666 V667	V612-L616 HydrophobicContact CG1-CD1 4.17Å; V612-L616 WeakPolarHBondContact O-CA 3.29Å; V612-L616 WeakPolarHBondContact O-CB 3.47Å; V612-L616 PolarHBondContact O-N 2.99Å; L616-L618 PolarHBondContact O-N 3.27Å; L616-A619 WeakPolarHBondContact O-CB 3.24Å; L616-A619 PolarHBondContact O-N 2.94Å; L616-A619 VanDerWaalsContact O-N 3.08Å; L616-F620 HydrophobicContact CD1-CE2 4.29Å; L616-F620 HydrophobicContact CD1-CZ 4.34Å; L616-F620 HydrophobicContact CD2-CE2 3.6Å; L616-F620 HydrophobicContact CD2-CZ 4.09Å; L616-F620 HydrophobicContact CG-CD2 4.05Å; L616-F620 HydrophobicContact CG-CE2 3.52Å; L616-F620 HydrophobicContact CG-CZ 4.04Å; L616-F620 WeakPolarHBondContact O-CD2 3.49Å; L616-F620 PolarHBondContact O-N 2.83Å; L616-I663 HydrophobicContact CD1-CG2 3.83Å; L616-K666 HydrophobicContact CD2-CD 3.78Å; L616-V667 HydrophobicContact CD1-CG2 3.8Å
617	D	90.1	Very high	89.5	Confident	90 Å²	90	44.9 Å²	44.9	48%	0.481	22%	0.219	S	C	.	.	H	α-helix	trans	-62	-33.1	178.1	-63.9	-21.2	0	0	0	112.2	I586 R615 A621	I586-D617 HydrophobicContact CD1-CB 4Å; R615-D617 VanDerWaalsContact C-N 3.29Å; R615-D617 PolarHBondContact O-N 2.93Å; D617-A621 VanDerWaalsContact O-CB 3.29Å; D617-A621 WeakPolarHBondContact O-CB 3.38Å; D617-A621 PolarHBondContact O-N 2.79Å
618	L	91.2	Very high	89.5	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-70.2	-39.6	174.3	178.3	61.9	0	0	0	111.5	I586 L589 V604 F607 I608 R615 L616 A621 W622	I586-L618 HydrophobicContact CG2-CD1 4.15Å; L589-L618 HydrophobicContact CB-CD1 3.76Å; L589-L618 HydrophobicContact CD1-CD1 4.2Å; L589-L618 HydrophobicContact CD1-CD2 4.18Å; V604-L618 HydrophobicContact CG1-CD2 4.34Å; F607-L618 HydrophobicContact CD1-CD2 4.17Å; F607-L618 HydrophobicContact CE1-CD2 4.26Å; I608-L618 HydrophobicContact CD1-CD2 4.4Å; I608-L618 HydrophobicContact CD1-CG 4.22Å; I608-L618 HydrophobicContact CG1-CD2 4.07Å; I608-L618 HydrophobicContact CG1-CG 4.31Å; R615-L618 WeakPolarHBondContact O-CB 3.38Å; R615-L618 PolarHBondContact O-N 3.37Å; R615-L618 VanDerWaalsContact O-N 3.13Å; L616-L618 PolarHBondContact O-N 3.27Å; L618-A621 PolarHBondContact O-N 2.98Å; L618-W622 WeakPolarHBondContact O-CB 3.38Å; L618-W622 PolarHBondContact O-N 3.4Å
619	A	90.8	Very high	89.3	Confident	4 Å²	4	50 Å²	50	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-44.7	175.9	0	0	0	0	0	111.2	I608 R615 L616 W622 L623 L649	I608-A619 HydrophobicContact CD1-CB 4.15Å; I608-A619 HydrophobicContact CG2-CB 3.99Å; R615-A619 PolarHBondContact O-N 3.43Å; L616-A619 WeakPolarHBondContact O-CB 3.24Å; L616-A619 PolarHBondContact O-N 2.94Å; L616-A619 VanDerWaalsContact O-N 3.08Å; A619-W622 PolarHBondContact O-N 3.23Å; A619-L623 WeakPolarHBondContact O-CB 3.44Å; A619-L623 PolarHBondContact O-N 2.95Å; A619-L649 HydrophobicContact CB-CD2 4.28Å
620	F	92.9	Very high	89.2	Confident	26 Å²	26	52.3 Å²	52.3	11%	0.114	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-50.4	174.8	-69.4	-45.2	0	0	0	112	L616 W622 L623 Y624 K666 V667 E670	L616-F620 HydrophobicContact CD1-CE2 4.29Å; L616-F620 HydrophobicContact CD1-CZ 4.34Å; L616-F620 HydrophobicContact CD2-CE2 3.6Å; L616-F620 HydrophobicContact CD2-CZ 4.09Å; L616-F620 HydrophobicContact CG-CD2 4.05Å; L616-F620 HydrophobicContact CG-CE2 3.52Å; L616-F620 HydrophobicContact CG-CZ 4.04Å; L616-F620 WeakPolarHBondContact O-CD2 3.49Å; L616-F620 PolarHBondContact O-N 2.83Å; F620-W622 PolarHBondContact O-N 3.05Å; F620-L623 PolarHBondContact O-N 3.24Å; F620-L623 VanDerWaalsContact O-N 3.09Å; F620-Y624 HydrophobicContact CB-CD2 4.34Å; F620-Y624 VanDerWaalsContact O-CD2 3.29Å; F620-Y624 WeakPolarHBondContact O-CD2 3.45Å; F620-Y624 PolarHBondContact O-N 3.21Å; F620-K666 HydrophobicContact CZ-CG 4.22Å; F620-V667 HydrophobicContact CE1-CG2 4.31Å; F620-V667 HydrophobicContact CZ-CG2 4.4Å; F620-E670 HydrophobicContact CD1-CB 4.21Å; F620-E670 HydrophobicContact CE1-CB 3.52Å; F620-E670 HydrophobicContact CE1-CG 4.19Å; F620-E670 HydrophobicContact CZ-CB 3.79Å; F620-E670 HydrophobicContact CZ-CG 3.92Å
621	A	91.6	Very high	89.2	Confident	28 Å²	28	50.3 Å²	50.3	23%	0.231	25%	0.254	C	S	.	.	H	α-helix	trans	-55.6	-40.3	179.2	0	0	0	0	0	112	I586 A590 D617 L618 Q625	I586-A621 HydrophobicContact CG2-CB 3.38Å; A590-A621 HydrophobicContact CB-CB 4.04Å; D617-A621 VanDerWaalsContact O-CB 3.29Å; D617-A621 WeakPolarHBondContact O-CB 3.38Å; D617-A621 PolarHBondContact O-N 2.79Å; L618-A621 PolarHBondContact O-N 2.98Å; A621-Q625 WeakPolarHBondContact O-CB 3.31Å; A621-Q625 PolarHBondContact O-N 3.32Å
622	W	91.8	Very high	89.1	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-47.8	175.3	-178.1	20.9	0	0	0	112.3	V593 K601 V604 L605 I608 L618 A619 F620 Y624 Q625 E626 C645	V593-W622 HydrophobicContact CG1-CD2 4.12Å; V593-W622 HydrophobicContact CG1-CH2 4.39Å; V593-W622 HydrophobicContact CG1-CZ2 3.56Å; K601-W622 HydrophobicContact CB-CH2 4.05Å; K601-W622 HydrophobicContact CB-CZ2 3.92Å; K601-W622 HydrophobicContact CD-CZ2 4.08Å; K601-W622 HydrophobicContact CG-CH2 4.43Å; K601-W622 HydrophobicContact CG-CZ2 3.79Å; V604-W622 HydrophobicContact CG1-CE3 4.17Å; V604-W622 HydrophobicContact CG1-CZ3 4.36Å; L605-W622 HydrophobicContact CB-CZ3 4.3Å; I608-W622 HydrophobicContact CD1-CE3 4.02Å; I608-W622 HydrophobicContact CD1-CZ3 4.4Å; L618-W622 WeakPolarHBondContact O-CB 3.38Å; L618-W622 PolarHBondContact O-N 3.4Å; A619-W622 PolarHBondContact O-N 3.23Å; F620-W622 PolarHBondContact O-N 3.05Å; W622-Y624 PolarHBondContact O-N 2.91Å; W622-Q625 PolarHBondContact O-N 3.33Å; W622-E626 PolarHBondContact NE1-OE1 3.21Å; W622-E626 VanDerWaalsContact NE1-OE1 3.14Å; W622-E626 PolarHBondContact O-N 3.26Å; W622-C645 VanDerWaalsContact CE2-SG 3.52Å
623	L	92.1	Very high	88.9	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-45.6	179.7	-174.5	67.7	0	0	0	112.4	A619 F620 Q625 E626 Y627 Y642 L646 A671	A619-L623 WeakPolarHBondContact O-CB 3.44Å; A619-L623 PolarHBondContact O-N 2.95Å; F620-L623 PolarHBondContact O-N 3.24Å; F620-L623 VanDerWaalsContact O-N 3.09Å; L623-Q625 VanDerWaalsContact C-N 3.35Å; L623-E626 PolarHBondContact O-N 3.44Å; L623-Y627 PolarHBondContact O-N 3.35Å; L623-Y627 VanDerWaalsContact O-N 3.12Å; L623-Y642 HydrophobicContact CD1-CD2 3.93Å; L623-Y642 HydrophobicContact CD1-CE2 3.4Å; L623-Y642 HydrophobicContact CG-CE2 3.78Å; L623-L646 HydrophobicContact CD1-CB 3.93Å; L623-L646 HydrophobicContact CD1-CD1 4.08Å; L623-L646 HydrophobicContact CD2-CD1 4.16Å; L623-A671 HydrophobicContact CD2-CB 3.81Å
624	Y	92.4	Very high	88.5	Confident	93 Å²	93	46 Å²	46	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-67.1	-35.7	176.5	-84.6	-89	0	0	0	112	F620 W622 Y627 N628 E670 P672	F620-Y624 HydrophobicContact CB-CD2 4.34Å; F620-Y624 VanDerWaalsContact O-CD2 3.29Å; F620-Y624 WeakPolarHBondContact O-CD2 3.45Å; F620-Y624 PolarHBondContact O-N 3.21Å; W622-Y624 PolarHBondContact O-N 2.91Å; Y624-Y627 PolarHBondContact O-N 3.3Å; Y624-N628 WeakPolarHBondContact O-CB 3.47Å; Y624-N628 PolarHBondContact O-N 2.95Å; Y624-N628 PolarHBondContact O-ND2 3.23Å; Y624-E670 PolarHBondContact OH-O 3.5Å; Y624-P672 HydrophobicContact CD1-CG 3.74Å; Y624-P672 HydrophobicContact CD2-CG 4.49Å; Y624-P672 HydrophobicContact CE1-CG 3.73Å; Y624-P672 HydrophobicContact CE2-CG 4.47Å; Y624-P672 HydrophobicContact CG-CG 4.16Å
625	Q	90.4	Very high	87.3	Confident	72 Å²	72	48.8 Å²	48.8	34%	0.336	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-41.2	177.5	-170.7	66.4	16.9	0	0	112	A590 T594 A621 W622 L623 Y627 N628 A629	A590-Q625 HydrophobicContact CB-CB 4.3Å; T594-Q625 HydrophobicContact CG2-CB 3.87Å; T594-Q625 HydrophobicContact CG2-CG 3.58Å; T594-Q625 WeakPolarHBondContact OG1-CG 3.3Å; A621-Q625 WeakPolarHBondContact O-CB 3.31Å; A621-Q625 PolarHBondContact O-N 3.32Å; W622-Q625 PolarHBondContact O-N 3.33Å; L623-Q625 VanDerWaalsContact C-N 3.35Å; Q625-Y627 VanDerWaalsContact C-N 3.33Å; Q625-N628 PolarHBondContact O-N 3.39Å; Q625-A629 WeakPolarHBondContact O-CB 3.5Å; Q625-A629 PolarHBondContact O-N 3.03Å
626	E	88.6	Confident	86.2	Confident	5 Å²	5	52.4 Å²	52.4	2%	0.023	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-39.2	174.1	-67.7	-76.8	-174.2	0	0	111.1	T594 K601 W622 L623 A629 Y630 Y642 C645	T594-E626 HydrophobicContact CG2-CB 4.43Å; T594-E626 HydrophobicContact CG2-CG 3.58Å; T594-E626 WeakPolarHBondContact CG2-OE1 3.4Å; K601-E626 VanDerWaalsContact CE-OE1 3.31Å; K601-E626 WeakPolarHBondContact CE-OE1 3.39Å; K601-E626 IonicContact NZ-OE1 3.36Å; K601-E626 PolarHBondContact NZ-OE1 3.5Å; K601-E626 IonicContact NZ-OE2 2.7Å; W622-E626 PolarHBondContact NE1-OE1 3.21Å; W622-E626 VanDerWaalsContact NE1-OE1 3.14Å; W622-E626 PolarHBondContact O-N 3.26Å; L623-E626 PolarHBondContact O-N 3.44Å; E626-A629 PolarHBondContact O-N 3.13Å; E626-Y630 PolarHBondContact O-N 3.1Å; E626-Y642 HydrophobicContact CB-CD2 4.42Å; E626-C645 HydrophobicContact CG-CB 4.33Å
627	Y	90.6	Very high	85.3	Confident	54 Å²	54	52.7 Å²	52.7	21%	0.212	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-42.4	175.3	-174.3	-109	0	0	0	112.6	L623 Y624 Q625 A629 Y630 L631 Y642 P672 L673	L623-Y627 PolarHBondContact O-N 3.35Å; L623-Y627 VanDerWaalsContact O-N 3.12Å; Y624-Y627 PolarHBondContact O-N 3.3Å; Q625-Y627 VanDerWaalsContact C-N 3.33Å; Y627-A629 VanDerWaalsContact C-N 3.31Å; Y627-A629 PolarHBondContact O-N 3.06Å; Y627-Y630 HydrophobicContact CD2-CD1 4.28Å; Y627-Y630 HydrophobicContact CE2-CD1 4.15Å; Y627-Y630 HydrophobicContact CE2-CE1 4.45Å; Y627-Y630 WeakPolarHBondContact O-CB 3.16Å; Y627-Y630 PolarHBondContact O-N 2.86Å; Y627-L631 HydrophobicContact CD1-CD1 3.98Å; Y627-L631 HydrophobicContact CD1-CG 4.34Å; Y627-L631 HydrophobicContact CE1-CD1 3.54Å; Y627-L631 HydrophobicContact CE1-CD2 4.41Å; Y627-L631 HydrophobicContact CE1-CG 4Å; Y627-L631 PolarHBondContact O-N 3.36Å; Y627-Y642 HydrophobicContact CD2-CD2 4.25Å; Y627-Y642 HydrophobicContact CD2-CE2 4.2Å; Y627-Y642 HydrophobicContact CD2-CG 4.46Å; Y627-Y642 HydrophobicContact CG-CD2 4.48Å; Y627-Y642 HydrophobicContact CG-CE2 4.38Å; Y627-P672 HydrophobicContact CD1-CB 3.54Å; Y627-P672 HydrophobicContact CD1-CG 3.95Å; Y627-P672 HydrophobicContact CD2-CB 3.93Å; Y627-P672 HydrophobicContact CE1-CB 3.76Å; Y627-P672 HydrophobicContact CE2-CB 4.15Å; Y627-P672 HydrophobicContact CG-CB 3.62Å; Y627-P672 HydrophobicContact CG-CG 3.93Å; Y627-L673 HydrophobicContact CE2-CB 4.17Å
628	N	89.5	Confident	84.8	Confident	79 Å²	79	51.3 Å²	51.3	42%	0.422	33%	0.33	S	S	.	.	H	α-helix	trans	-64.8	-36.7	175.6	-73.4	-23.5	0	0	0	111.8	Y624 Q625 Y630 L631 A632	Y624-N628 WeakPolarHBondContact O-CB 3.47Å; Y624-N628 PolarHBondContact O-N 2.95Å; Y624-N628 PolarHBondContact O-ND2 3.23Å; Q625-N628 PolarHBondContact O-N 3.39Å; N628-Y630 VanDerWaalsContact C-N 3.3Å; N628-Y630 PolarHBondContact O-N 3.01Å; N628-L631 PolarHBondContact O-N 3.2Å; N628-A632 WeakPolarHBondContact O-CB 3.39Å; N628-A632 PolarHBondContact O-N 3.24Å
629	A	86.4	Confident	84.5	Confident	47 Å²	47	53 Å²	53	39%	0.388	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-38	173.9	0	0	0	0	0	111.7	Q625 E626 Y627 A633	Q625-A629 WeakPolarHBondContact O-CB 3.5Å; Q625-A629 PolarHBondContact O-N 3.03Å; E626-A629 PolarHBondContact O-N 3.13Å; Y627-A629 VanDerWaalsContact C-N 3.31Å; Y627-A629 PolarHBondContact O-N 3.06Å; A629-A633 PolarHBondContact O-N 3.29Å
630	Y	87.2	Confident	84.2	Confident	76 Å²	76	58 Å²	58	30%	0.298	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-49.8	171	161.7	-102.1	0	0	0	111.8	E626 Y627 N628 A632 A633 G637 L639	E626-Y630 PolarHBondContact O-N 3.1Å; Y627-Y630 HydrophobicContact CD2-CD1 4.28Å; Y627-Y630 HydrophobicContact CE2-CD1 4.15Å; Y627-Y630 HydrophobicContact CE2-CE1 4.45Å; Y627-Y630 WeakPolarHBondContact O-CB 3.16Å; Y627-Y630 PolarHBondContact O-N 2.86Å; N628-Y630 VanDerWaalsContact C-N 3.3Å; N628-Y630 PolarHBondContact O-N 3.01Å; Y630-A632 VanDerWaalsContact C-N 3.31Å; Y630-A632 PolarHBondContact O-N 3.45Å; Y630-A633 PolarHBondContact O-N 3.31Å; Y630-A633 VanDerWaalsContact O-N 3.13Å; Y630-G637 WeakPolarHBondContact CE2-O 3.45Å; Y630-L639 HydrophobicContact CD1-CD1 4.14Å; Y630-L639 HydrophobicContact CD2-CD1 4.25Å; Y630-L639 HydrophobicContact CE1-CD1 4.19Å; Y630-L639 HydrophobicContact CE2-CB 4.36Å; Y630-L639 HydrophobicContact CE2-CD1 4.3Å; Y630-L639 HydrophobicContact CG-CD1 4.17Å
631	L	86.8	Confident	83.9	Confident	93 Å²	93	61.8 Å²	61.8	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-60.6	-39.7	178.5	-69.2	-179.9	0	0	0	112.6	Y627 N628 A633 G634	Y627-L631 HydrophobicContact CD1-CD1 3.98Å; Y627-L631 HydrophobicContact CD1-CG 4.34Å; Y627-L631 HydrophobicContact CE1-CD1 3.54Å; Y627-L631 HydrophobicContact CE1-CD2 4.41Å; Y627-L631 HydrophobicContact CE1-CG 4Å; Y627-L631 PolarHBondContact O-N 3.36Å; N628-L631 PolarHBondContact O-N 3.2Å; L631-A633 VanDerWaalsContact C-N 3.25Å; L631-A633 PolarHBondContact O-N 3.25Å; L631-G634 PolarHBondContact O-N 2.71Å
632	A	85.3	Confident	83.9	Confident	91 Å²	91	60.5 Å²	60.5	75%	0.752	37%	0.371	S	S	*	.	H	α-helix	trans	-66.3	-26	178.4	0	0	0	0	0	113.2	N628 Y630 G634	N628-A632 WeakPolarHBondContact O-CB 3.39Å; N628-A632 PolarHBondContact O-N 3.24Å; Y630-A632 VanDerWaalsContact C-N 3.31Å; Y630-A632 PolarHBondContact O-N 3.45Å; A632-G634 VanDerWaalsContact C-N 3.33Å
633	A	81.6	Confident	83.8	Confident	40 Å²	40	62 Å²	62	33%	0.331	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-9.2	178.6	0	0	0	0	0	113.8	A629 Y630 L631 A635 S636 G637	A629-A633 PolarHBondContact O-N 3.29Å; Y630-A633 PolarHBondContact O-N 3.31Å; Y630-A633 VanDerWaalsContact O-N 3.13Å; L631-A633 VanDerWaalsContact C-N 3.25Å; L631-A633 PolarHBondContact O-N 3.25Å; A633-A635 PolarHBondContact O-N 2.98Å; A633-S636 PolarHBondContact O-N 3.43Å; A633-S636 PolarHBondContact O-OG 3.17Å; A633-G637 VanDerWaalsContact CB-CA 3.47Å; A633-G637 PolarHBondContact O-N 2.84Å
634	G	74.8	Confident	83.7	Confident	48 Å²	48	64.9 Å²	64.9	50%	0.495	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	54.5	-132.4	174.9	0	0	0	0	0	113.2	L631 A632 S636 G637	L631-G634 PolarHBondContact O-N 2.71Å; A632-G634 VanDerWaalsContact C-N 3.33Å; G634-S636 PolarHBondContact O-N 2.78Å; G634-S636 VanDerWaalsContact O-N 3.1Å; G634-G637 PolarHBondContact O-N 3.35Å; G634-G637 VanDerWaalsContact O-N 3.13Å
635	A	60.9	Low	83.6	Confident	121 Å²	121	60.5 Å²	60.5	100%	1	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-65.5	-10.9	-177.7	0	0	0	0	0	115.2	A633	A633-A635 PolarHBondContact O-N 2.98Å
636	S	66.9	Low	83.7	Confident	108 Å²	108	57 Å²	57	76%	0.755	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-103.2	-4.2	177.7	68.9	0	0	0	0	113.6	A633 G634 S638	A633-S636 PolarHBondContact O-N 3.43Å; A633-S636 PolarHBondContact O-OG 3.17Å; G634-S636 PolarHBondContact O-N 2.78Å; G634-S636 VanDerWaalsContact O-N 3.1Å; S636-S638 PolarHBondContact O-N 3.46Å
637	G	70.2	Confident	83.9	Confident	21 Å²	21	58.9 Å²	58.9	22%	0.216	37%	0.37	C	S	.	.			trans	-73.3	122.4	-177.8	0	0	0	0	0	111.9	Y630 A633 G634	Y630-G637 WeakPolarHBondContact CE2-O 3.45Å; A633-G637 VanDerWaalsContact CB-CA 3.47Å; A633-G637 PolarHBondContact O-N 2.84Å; G634-G637 PolarHBondContact O-N 3.35Å; G634-G637 VanDerWaalsContact O-N 3.13Å
638	S	78.3	Confident	83.8	Confident	62 Å²	62	61 Å²	61	43%	0.434	38%	0.377	S	S	.	.			trans	-85.5	136.2	166.6	172.9	0	0	0	0	110.5	S636 D640	S636-S638 PolarHBondContact O-N 3.46Å; S638-D640 PolarHBondContact O-N 3.23Å; S638-D640 WeakPolarHBondContact OG-CB 3.4Å; S638-D640 PolarHBondContact OG-N 2.83Å; S638-D640 VanDerWaalsContact OG-N 3.08Å; S638-D640 PolarHBondContact OG-OD1 3.46Å; S638-D640 PolarHBondContact OG-OD2 3.38Å
639	L	85.5	Confident	83.9	Confident	41 Å²	41	57.6 Å²	57.6	22%	0.215	36%	0.359	C	S	.	.	S	Bend	trans	-73.9	-12.6	174.4	-165.6	65.1	0	0	0	112.4	Y630 K641 Y642 E643 L673 T675	Y630-L639 HydrophobicContact CD1-CD1 4.14Å; Y630-L639 HydrophobicContact CD2-CD1 4.25Å; Y630-L639 HydrophobicContact CE1-CD1 4.19Å; Y630-L639 HydrophobicContact CE2-CB 4.36Å; Y630-L639 HydrophobicContact CE2-CD1 4.3Å; Y630-L639 HydrophobicContact CG-CD1 4.17Å; L639-K641 VanDerWaalsContact C-N 3.28Å; L639-K641 PolarHBondContact O-N 3.33Å; L639-K641 VanDerWaalsContact O-N 3.14Å; L639-Y642 HydrophobicContact CD1-CD1 3.8Å; L639-Y642 HydrophobicContact CD1-CG 4.32Å; L639-Y642 HydrophobicContact CG-CD1 4.31Å; L639-Y642 WeakPolarHBondContact O-CB 3.41Å; L639-Y642 PolarHBondContact O-N 3.43Å; L639-E643 PolarHBondContact O-N 3.19Å; L639-L673 HydrophobicContact CD1-CD2 4.32Å; L639-L673 HydrophobicContact CD2-CD2 4.12Å; L639-T675 HydrophobicContact CD2-CG2 3.71Å; L639-T675 HydrophobicContact CG-CG2 4.33Å
640	D	85.4	Confident	84.2	Confident	107 Å²	107	55.3 Å²	55.3	57%	0.572	34%	0.34	S	S	*	.	H	α-helix	trans	-54.6	-40.9	-171	-56.9	-26.7	0	0	0	112.4	S638 Y642 E643 D644	S638-D640 PolarHBondContact O-N 3.23Å; S638-D640 WeakPolarHBondContact OG-CB 3.4Å; S638-D640 PolarHBondContact OG-N 2.83Å; S638-D640 VanDerWaalsContact OG-N 3.08Å; S638-D640 PolarHBondContact OG-OD1 3.46Å; S638-D640 PolarHBondContact OG-OD2 3.38Å; D640-Y642 PolarHBondContact O-N 3.04Å; D640-E643 PolarHBondContact O-N 3.26Å; D640-D644 WeakPolarHBondContact O-CB 3.16Å; D640-D644 PolarHBondContact O-N 3.2Å
641	K	86	Confident	84.3	Confident	106 Å²	106	53.5 Å²	53.5	46%	0.461	34%	0.338	S	S	.	.	H	α-helix	trans	-67.5	-37.9	-178	-66	-178.4	-177	177.9	0	112.9	L639 C645	L639-K641 VanDerWaalsContact C-N 3.28Å; L639-K641 PolarHBondContact O-N 3.33Å; L639-K641 VanDerWaalsContact O-N 3.14Å; K641-C645 WeakPolarHBondContact O-CB 3.21Å; K641-C645 PolarHBondContact O-N 3.02Å; K641-C645 VanDerWaalsContact O-N 3.17Å
642	Y	90.7	Very high	84.4	Confident	1 Å²	1	49.4 Å²	49.4	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-70.2	-47.5	176.4	168.5	-98.4	0	0	0	110.2	L623 E626 Y627 L639 D640 D644 C645 L646 P672 L673 T675	L623-Y642 HydrophobicContact CD1-CD2 3.93Å; L623-Y642 HydrophobicContact CD1-CE2 3.4Å; L623-Y642 HydrophobicContact CG-CE2 3.78Å; E626-Y642 HydrophobicContact CB-CD2 4.42Å; Y627-Y642 HydrophobicContact CD2-CD2 4.25Å; Y627-Y642 HydrophobicContact CD2-CE2 4.2Å; Y627-Y642 HydrophobicContact CD2-CG 4.46Å; Y627-Y642 HydrophobicContact CG-CD2 4.48Å; Y627-Y642 HydrophobicContact CG-CE2 4.38Å; L639-Y642 HydrophobicContact CD1-CD1 3.8Å; L639-Y642 HydrophobicContact CD1-CG 4.32Å; L639-Y642 HydrophobicContact CG-CD1 4.31Å; L639-Y642 WeakPolarHBondContact O-CB 3.41Å; L639-Y642 PolarHBondContact O-N 3.43Å; D640-Y642 PolarHBondContact O-N 3.04Å; Y642-D644 PolarHBondContact O-N 3.17Å; Y642-C645 WeakPolarHBondContact O-CB 3.31Å; Y642-C645 PolarHBondContact O-N 3.44Å; Y642-L646 HydrophobicContact CE1-CD2 4.15Å; Y642-L646 WeakPolarHBondContact O-CB 3.32Å; Y642-L646 PolarHBondContact O-N 3.26Å; Y642-P672 HydrophobicContact CE2-CG 4.35Å; Y642-P672 WeakPolarHBondContact OH-CD 3.26Å; Y642-L673 HydrophobicContact CE1-CB 4.16Å; Y642-L673 VanDerWaalsContact CE1-O 3.28Å; Y642-L673 WeakPolarHBondContact CE1-O 3.41Å; Y642-L673 PolarHBondContact OH-N 2.97Å; Y642-L673 VanDerWaalsContact OH-N 3.07Å; Y642-L673 PolarHBondContact OH-O 2.94Å; Y642-T675 HydrophobicContact CD1-CG2 4.4Å; Y642-T675 HydrophobicContact CE1-CG2 4.32Å
643	E	90.2	Very high	84.5	Confident	37 Å²	37	45.2 Å²	45.2	17%	0.173	28%	0.284	C	S	.	.	H	α-helix	trans	-58.8	-48.6	177.9	176.4	157.4	-137.3	0	0	111.7	L639 D640 C645 L646 I647 T675 S677	L639-E643 PolarHBondContact O-N 3.19Å; D640-E643 PolarHBondContact O-N 3.26Å; E643-C645 VanDerWaalsContact C-N 3.27Å; E643-C645 PolarHBondContact O-N 3.36Å; E643-L646 PolarHBondContact O-N 2.7Å; E643-I647 HydrophobicContact CG-CD1 3.51Å; E643-I647 HydrophobicContact CG-CG1 4.23Å; E643-I647 WeakPolarHBondContact O-CB 3.48Å; E643-I647 VanDerWaalsContact O-CG1 3.25Å; E643-I647 WeakPolarHBondContact O-CG1 3.38Å; E643-I647 PolarHBondContact O-N 3.1Å; E643-T675 HydrophobicContact CB-CG2 4.19Å; E643-T675 HydrophobicContact CG-CG2 4.32Å; E643-T675 VanDerWaalsContact OE1-CB 3.3Å; E643-T675 WeakPolarHBondContact OE1-CB 3.41Å; E643-T675 PolarHBondContact OE1-OG1 3.46Å; E643-S677 WeakPolarHBondContact OE1-CB 3.38Å; E643-S677 PolarHBondContact OE1-OG 3.46Å
644	D	89.6	Confident	84.7	Confident	61 Å²	61	45.8 Å²	45.8	33%	0.326	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-29.6	178.3	-173.2	45.6	0	0	0	112.8	D640 Y642 R648	D640-D644 WeakPolarHBondContact O-CB 3.16Å; D640-D644 PolarHBondContact O-N 3.2Å; Y642-D644 PolarHBondContact O-N 3.17Å; D644-R648 WeakPolarHBondContact O-CB 3.31Å; D644-R648 VanDerWaalsContact O-CG 3.3Å; D644-R648 WeakPolarHBondContact O-CG 3.38Å; D644-R648 PolarHBondContact O-N 3.1Å; D644-R648 PolarHBondContact O-NH1 3.43Å; D644-R648 VanDerWaalsContact O-NH1 3.09Å; D644-R648 IonicContact OD1-CZ 3.53Å; D644-R648 IonicContact OD1-NE 2.67Å; D644-R648 IonicContact OD1-NH1 3.47Å; D644-R648 PolarHBondContact OD1-NH1 3.45Å; D644-R648 IonicContact OD1-NH2 3.56Å; D644-R648 PolarHBondContact OD1-NH2 3.34Å; D644-R648 IonicContact OD2-CZ 3.76Å; D644-R648 IonicContact OD2-NH1 3.71Å; D644-R648 PolarHBondContact OD2-NH1 3.2Å; D644-R648 IonicContact OD2-NH2 2.89Å; D644-R648 PolarHBondContact OD2-NH2 3.26Å
645	C	90.3	Very high	85.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-71.5	-50.8	170.7	-177.7	0	0	0	0	111.3	W622 E626 K641 Y642 E643 R648 L649	W622-C645 VanDerWaalsContact CE2-SG 3.52Å; E626-C645 HydrophobicContact CG-CB 4.33Å; K641-C645 WeakPolarHBondContact O-CB 3.21Å; K641-C645 PolarHBondContact O-N 3.02Å; K641-C645 VanDerWaalsContact O-N 3.17Å; Y642-C645 WeakPolarHBondContact O-CB 3.31Å; Y642-C645 PolarHBondContact O-N 3.44Å; E643-C645 VanDerWaalsContact C-N 3.27Å; E643-C645 PolarHBondContact O-N 3.36Å; C645-R648 PolarHBondContact O-N 3.11Å; C645-L649 WeakPolarHBondContact O-CG 3.38Å; C645-L649 PolarHBondContact O-N 2.97Å
646	L	92.5	Very high	86	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-48.3	-178.9	-179	58.9	0	0	0	111.6	L623 Y642 E643 R648 L649 L650 A671 I674 A678	L623-L646 HydrophobicContact CD1-CB 3.93Å; L623-L646 HydrophobicContact CD1-CD1 4.08Å; L623-L646 HydrophobicContact CD2-CD1 4.16Å; Y642-L646 HydrophobicContact CE1-CD2 4.15Å; Y642-L646 WeakPolarHBondContact O-CB 3.32Å; Y642-L646 PolarHBondContact O-N 3.26Å; E643-L646 PolarHBondContact O-N 2.7Å; L646-R648 VanDerWaalsContact C-N 3.35Å; L646-R648 PolarHBondContact O-N 3.28Å; L646-L649 PolarHBondContact O-N 3.43Å; L646-L650 HydrophobicContact CD1-CD1 3.93Å; L646-L650 HydrophobicContact CD1-CG 4.05Å; L646-L650 HydrophobicContact CG-CD1 3.98Å; L646-L650 HydrophobicContact CG-CG 4.43Å; L646-L650 WeakPolarHBondContact O-CB 3.38Å; L646-L650 VanDerWaalsContact O-CG 3.31Å; L646-L650 WeakPolarHBondContact O-CG 3.23Å; L646-L650 PolarHBondContact O-N 3.21Å; L646-A671 HydrophobicContact CD1-CB 4.1Å; L646-I674 HydrophobicContact CD2-CD1 4.37Å; L646-A678 HydrophobicContact CD2-CB 3.62Å; L646-A678 HydrophobicContact CG-CB 4.05Å
647	I	92.5	Very high	85.9	Confident	43 Å²	43	49.9 Å²	49.9	22%	0.221	26%	0.262	C	S	.	.	H	α-helix	trans	-60.1	-45.1	179.7	-68.7	168.4	0	0	0	110.7	E643 L650 S651 V681	E643-I647 HydrophobicContact CG-CD1 3.51Å; E643-I647 HydrophobicContact CG-CG1 4.23Å; E643-I647 WeakPolarHBondContact O-CB 3.48Å; E643-I647 VanDerWaalsContact O-CG1 3.25Å; E643-I647 WeakPolarHBondContact O-CG1 3.38Å; E643-I647 PolarHBondContact O-N 3.1Å; I647-L650 PolarHBondContact O-N 3.5Å; I647-S651 VanDerWaalsContact O-CB 3.24Å; I647-S651 WeakPolarHBondContact O-CB 3.3Å; I647-S651 PolarHBondContact O-N 2.55Å; I647-S651 PolarHBondContact O-OG 2.91Å; I647-V681 HydrophobicContact CG2-CG2 4.21Å
648	R	90.4	Very high	85.7	Confident	100 Å²	100	54.7 Å²	54.7	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-67	-38.3	180	-75.8	-161.2	-161.2	88.8	0.7	112.8	L605 D644 C645 L646 G652	L605-R648 HydrophobicContact CD2-CB 3.82Å; L605-R648 HydrophobicContact CD2-CG 4.49Å; D644-R648 WeakPolarHBondContact O-CB 3.31Å; D644-R648 VanDerWaalsContact O-CG 3.3Å; D644-R648 WeakPolarHBondContact O-CG 3.38Å; D644-R648 PolarHBondContact O-N 3.1Å; D644-R648 PolarHBondContact O-NH1 3.43Å; D644-R648 VanDerWaalsContact O-NH1 3.09Å; D644-R648 IonicContact OD1-CZ 3.53Å; D644-R648 IonicContact OD1-NE 2.67Å; D644-R648 IonicContact OD1-NH1 3.47Å; D644-R648 PolarHBondContact OD1-NH1 3.45Å; D644-R648 IonicContact OD1-NH2 3.56Å; D644-R648 PolarHBondContact OD1-NH2 3.34Å; D644-R648 IonicContact OD2-CZ 3.76Å; D644-R648 IonicContact OD2-NH1 3.71Å; D644-R648 PolarHBondContact OD2-NH1 3.2Å; D644-R648 IonicContact OD2-NH2 2.89Å; D644-R648 PolarHBondContact OD2-NH2 3.26Å; C645-R648 PolarHBondContact O-N 3.11Å; L646-R648 VanDerWaalsContact C-N 3.35Å; L646-R648 PolarHBondContact O-N 3.28Å; R648-G652 PolarHBondContact O-N 3.16Å
649	L	90.9	Very high	85.2	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-50	173	-76.3	168.4	0	0	0	110.7	L605 I608 A619 C645 L646 G652 L653	L605-L649 HydrophobicContact CD1-CD2 3.68Å; L605-L649 HydrophobicContact CD1-CG 4.18Å; I608-L649 HydrophobicContact CD1-CD2 4.44Å; I608-L649 HydrophobicContact CG2-CD2 4.34Å; A619-L649 HydrophobicContact CB-CD2 4.28Å; C645-L649 WeakPolarHBondContact O-CG 3.38Å; C645-L649 PolarHBondContact O-N 2.97Å; L646-L649 PolarHBondContact O-N 3.43Å; L649-G652 PolarHBondContact O-N 3.34Å; L649-L653 WeakPolarHBondContact O-CG 3.3Å; L649-L653 PolarHBondContact O-N 2.93Å
650	L	91.8	Very high	84	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-43	-179.1	-67	178.6	0	0	0	112.6	L646 I647 L653 Q654 F664 V667 V668 A678 V681	L646-L650 HydrophobicContact CD1-CD1 3.93Å; L646-L650 HydrophobicContact CD1-CG 4.05Å; L646-L650 HydrophobicContact CG-CD1 3.98Å; L646-L650 HydrophobicContact CG-CG 4.43Å; L646-L650 WeakPolarHBondContact O-CB 3.38Å; L646-L650 VanDerWaalsContact O-CG 3.31Å; L646-L650 WeakPolarHBondContact O-CG 3.23Å; L646-L650 PolarHBondContact O-N 3.21Å; I647-L650 PolarHBondContact O-N 3.5Å; L650-L653 PolarHBondContact O-N 3.18Å; L650-Q654 PolarHBondContact O-N 3.26Å; L650-F664 HydrophobicContact CB-CE2 4.15Å; L650-F664 HydrophobicContact CD2-CD2 4.26Å; L650-F664 HydrophobicContact CD2-CE2 3.89Å; L650-F664 HydrophobicContact CD2-CZ 4.24Å; L650-V667 HydrophobicContact CD2-CB 4.45Å; L650-V667 HydrophobicContact CD2-CG1 3.94Å; L650-V668 HydrophobicContact CD1-CG2 4.37Å; L650-V668 HydrophobicContact CD2-CG2 3.57Å; L650-A678 HydrophobicContact CD1-CB 4.21Å; L650-V681 HydrophobicContact CB-CG1 3.78Å
651	S	90.6	Very high	83.1	Confident	37 Å²	37	58.9 Å²	58.9	26%	0.259	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-43.2	178.2	-54.6	0	0	0	0	111.2	I647 L653 Q654 E655	I647-S651 VanDerWaalsContact O-CB 3.24Å; I647-S651 WeakPolarHBondContact O-CB 3.3Å; I647-S651 PolarHBondContact O-N 2.55Å; I647-S651 PolarHBondContact O-OG 2.91Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.15Å; S651-Q654 WeakPolarHBondContact O-CB 3.23Å; S651-Q654 PolarHBondContact O-N 2.6Å; S651-Q654 VanDerWaalsContact O-N 3.1Å; S651-E655 PolarHBondContact O-N 2.75Å; S651-E655 VanDerWaalsContact O-N 3.15Å
652	G	87.9	Confident	83	Confident	7 Å²	7	54.8 Å²	54.8	7%	0.072	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-32	175.5	0	0	0	0	0	113.4	R648 L649	R648-G652 PolarHBondContact O-N 3.16Å; L649-G652 PolarHBondContact O-N 3.34Å
653	L	87.9	Confident	82.8	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-71.3	-38.2	171.8	-69.2	172.3	0	0	0	112	L609 V612 L649 L650 S651 E655 K656 Q659 F664 V667	L609-L653 HydrophobicContact CD2-CD2 4.22Å; L609-L653 HydrophobicContact CD2-CG 4.42Å; V612-L653 HydrophobicContact CB-CD2 4.23Å; V612-L653 HydrophobicContact CG1-CD2 3.58Å; V612-L653 HydrophobicContact CG2-CD2 3.72Å; L649-L653 WeakPolarHBondContact O-CG 3.3Å; L649-L653 PolarHBondContact O-N 2.93Å; L650-L653 PolarHBondContact O-N 3.18Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.15Å; L653-E655 VanDerWaalsContact C-N 3.31Å; L653-E655 PolarHBondContact O-N 2.71Å; L653-K656 PolarHBondContact O-N 2.91Å; L653-Q659 PolarHBondContact O-NE2 2.96Å; L653-F664 HydrophobicContact CB-CD2 4.11Å; L653-V667 HydrophobicContact CD1-CB 4.29Å; L653-V667 HydrophobicContact CD1-CG2 3.94Å
654	Q	85.9	Confident	82.8	Confident	52 Å²	52	54.1 Å²	54.1	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-39.7	178.5	-176.3	175.5	-4.4	0	0	111.9	L650 S651 K656 Y685 R691	L650-Q654 PolarHBondContact O-N 3.26Å; S651-Q654 WeakPolarHBondContact O-CB 3.23Å; S651-Q654 PolarHBondContact O-N 2.6Å; S651-Q654 VanDerWaalsContact O-N 3.1Å; Q654-K656 VanDerWaalsContact C-N 3.26Å; Q654-K656 PolarHBondContact O-N 3.25Å; Q654-Y685 HydrophobicContact CG-CD2 4.29Å; Q654-R691 PolarHBondContact O-NH1 3.25Å
655	E	84	Confident	82.8	Confident	164 Å²	164	51.9 Å²	51.9	77%	0.766	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.7	179.8	-69.8	177.3	-175	0	0	114.3	S651 L653	S651-E655 PolarHBondContact O-N 2.75Å; S651-E655 VanDerWaalsContact O-N 3.15Å; L653-E655 VanDerWaalsContact C-N 3.31Å; L653-E655 PolarHBondContact O-N 2.71Å
656	K	79.3	Confident	82.9	Confident	84 Å²	84	57 Å²	57	37%	0.365	29%	0.287	S	S	.	.			trans	-78.6	130.4	-177.5	-69.6	-72.9	-177	164.5	0	111.1	L609 L653 Q654 D658 R691	L609-K656 WeakPolarHBondContact O-CE 3.28Å; L609-K656 PolarHBondContact O-NZ 3.11Å; L653-K656 PolarHBondContact O-N 2.91Å; Q654-K656 VanDerWaalsContact C-N 3.26Å; Q654-K656 PolarHBondContact O-N 3.25Å; K656-D658 PolarHBondContact O-N 3.05Å; K656-R691 VanDerWaalsContact O-CZ 3.24Å; K656-R691 PolarHBondContact O-NH1 3.25Å; K656-R691 VanDerWaalsContact O-NH1 3.15Å; K656-R691 PolarHBondContact O-NH2 3.38Å
657	P	65.1	Low	82.8	Confident	115 Å²	115	57.1 Å²	57.1	75%	0.747	29%	0.288	S	S	*	.	S	Bend	trans	-68.2	-28.3	-174.7	24.2	-32.6	0	0	0	114.5	R691	P657-R691 PolarHBondContact O-NH2 3.05Å
658	D	65.8	Low	82.8	Confident	122 Å²	122	55.1 Å²	55.1	65%	0.652	28%	0.278	S	S	*	.			trans	-106.4	80.6	-170.4	-161.2	10.8	0	0	0	113.1	K656	K656-D658 PolarHBondContact O-N 3.05Å
659	Q	66.1	Low	82.8	Confident	13 Å²	13	51.5 Å²	51.5	6%	0.061	27%	0.266	C	S	.	.			trans	-107.1	27.7	-178.3	-74.8	-76.1	-15.7	0	0	112.9	L653 D661 L694	L653-Q659 PolarHBondContact O-NE2 2.96Å; Q659-D661 PolarHBondContact O-N 2.74Å; Q659-L694 WeakPolarHBondContact O-CD2 3.38Å
660	K	61.4	Low	82.8	Confident	188 Å²	188	55.5 Å²	55.5	82%	0.817	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.3	-179.2	-69.1	-177.8	-179.7	175.3	0	113.7	G662	K660-G662 VanDerWaalsContact C-N 3.27Å; K660-G662 PolarHBondContact O-N 3.22Å
661	D	67.1	Low	82.8	Confident	96 Å²	96	55.5 Å²	55.5	51%	0.513	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.5	-174.9	-74.1	-9	0	0	0	114.2	R613 Q659 I663	R613-D661 IonicContact CZ-OD2 2.6Å; R613-D661 IonicContact NH1-OD1 3.01Å; R613-D661 IonicContact NH1-OD2 3.25Å; R613-D661 PolarHBondContact NH1-OD2 3.03Å; Q659-D661 PolarHBondContact O-N 2.74Å; D661-I663 HydrophobicContact CB-CD1 3.95Å; D661-I663 HydrophobicContact CB-CG1 3.85Å; D661-I663 PolarHBondContact O-N 3.17Å
662	G	83.1	Confident	82.7	Confident	20 Å²	20	55.1 Å²	55.1	21%	0.206	28%	0.281	C	S	.	.			trans	68.1	18.7	178.5	0	0	0	0	0	114.4	K660 F664 T665 K666	K660-G662 VanDerWaalsContact C-N 3.27Å; K660-G662 PolarHBondContact O-N 3.22Å; G662-F664 PolarHBondContact O-N 3.27Å; G662-T665 WeakPolarHBondContact O-CB 3.31Å; G662-T665 PolarHBondContact O-N 2.98Å; G662-K666 PolarHBondContact O-N 2.88Å
663	I	87.3	Confident	82.8	Confident	25 Å²	25	56.6 Å²	56.6	13%	0.128	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-42.5	-176	-61.1	169.4	0	0	0	111.2	V612 R613 L616 D661 T665 K666 V667	V612-I663 HydrophobicContact CG1-CG2 3.6Å; R613-I663 HydrophobicContact CB-CD1 4.3Å; L616-I663 HydrophobicContact CD1-CG2 3.83Å; D661-I663 HydrophobicContact CB-CD1 3.95Å; D661-I663 HydrophobicContact CB-CG1 3.85Å; D661-I663 PolarHBondContact O-N 3.17Å; I663-T665 VanDerWaalsContact C-N 3.31Å; I663-T665 PolarHBondContact O-N 3.23Å; I663-K666 PolarHBondContact O-N 2.94Å; I663-K666 VanDerWaalsContact O-N 3.13Å; I663-V667 HydrophobicContact CG2-CG2 4.48Å; I663-V667 WeakPolarHBondContact O-CG2 3.31Å; I663-V667 PolarHBondContact O-N 2.56Å
664	F	89.9	Confident	83	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.6	-48.8	173.2	-176.6	-87	0	0	0	111.6	L650 L653 G662 K666 V667 V668 V682 Y685	L650-F664 HydrophobicContact CB-CE2 4.15Å; L650-F664 HydrophobicContact CD2-CD2 4.26Å; L650-F664 HydrophobicContact CD2-CE2 3.89Å; L650-F664 HydrophobicContact CD2-CZ 4.24Å; L653-F664 HydrophobicContact CB-CD2 4.11Å; G662-F664 PolarHBondContact O-N 3.27Å; F664-K666 VanDerWaalsContact C-N 3.32Å; F664-K666 PolarHBondContact O-N 2.98Å; F664-V667 PolarHBondContact O-N 2.81Å; F664-V668 HydrophobicContact CD1-CG2 4.09Å; F664-V668 HydrophobicContact CE1-CG2 3.75Å; F664-V668 HydrophobicContact CZ-CG2 4.12Å; F664-V668 WeakPolarHBondContact O-CG2 3.48Å; F664-V668 PolarHBondContact O-N 3.4Å; F664-V682 HydrophobicContact CE1-CG2 4.27Å; F664-V682 HydrophobicContact CZ-CG2 4.15Å; F664-Y685 HydrophobicContact CB-CE2 4.37Å; F664-Y685 AromaticContact CD1-CD1 3.62Å; F664-Y685 HydrophobicContact CD1-CD1 3.62Å; F664-Y685 HydrophobicContact CD1-CD2 4.29Å; F664-Y685 AromaticContact CD1-CE1 3.52Å; F664-Y685 HydrophobicContact CD1-CE1 3.52Å; F664-Y685 HydrophobicContact CD1-CE2 4.21Å; F664-Y685 HydrophobicContact CD1-CG 4.01Å; F664-Y685 AromaticContact CD1-CZ 3.83Å; F664-Y685 HydrophobicContact CD2-CD2 4.09Å; F664-Y685 HydrophobicContact CD2-CE2 4.1Å; F664-Y685 HydrophobicContact CD2-CG 4.45Å; F664-Y685 AromaticContact CE1-CD1 3.42Å; F664-Y685 HydrophobicContact CE1-CD1 3.42Å; F664-Y685 VanDerWaalsContact CE1-CD1 3.42Å; F664-Y685 HydrophobicContact CE1-CD2 4.2Å; F664-Y685 AromaticContact CE1-CE1 3.86Å; F664-Y685 HydrophobicContact CE1-CE1 3.86Å; F664-Y685 AromaticContact CE1-CG 3.61Å; F664-Y685 HydrophobicContact CE1-CG 3.61Å; F664-Y685 AromaticContact CE2-CD2 3.99Å; F664-Y685 HydrophobicContact CE2-CD2 3.99Å; F664-Y685 HydrophobicContact CE2-CE2 4.46Å; F664-Y685 HydrophobicContact CE2-CG 4.09Å; F664-Y685 HydrophobicContact CG-CD1 4.34Å; F664-Y685 HydrophobicContact CG-CD2 4.24Å; F664-Y685 HydrophobicContact CG-CE1 4.06Å; F664-Y685 AromaticContact CG-CE2 3.97Å; F664-Y685 HydrophobicContact CG-CE2 3.97Å; F664-Y685 HydrophobicContact CG-CG 4.42Å; F664-Y685 AromaticContact CG-CZ 3.86Å; F664-Y685 AromaticContact CZ-CD1 3.99Å; F664-Y685 HydrophobicContact CZ-CD1 3.99Å; F664-Y685 HydrophobicContact CZ-CD2 4.05Å; F664-Y685 AromaticContact CZ-CG 3.66Å; F664-Y685 HydrophobicContact CZ-CG 3.66Å
665	T	90	Very high	83.2	Confident	14 Å²	14	54.3 Å²	54.3	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-43.3	177.1	-51.4	0	0	0	0	111.4	G662 I663 V668 L669 T698	G662-T665 WeakPolarHBondContact O-CB 3.31Å; G662-T665 PolarHBondContact O-N 2.98Å; I663-T665 VanDerWaalsContact C-N 3.31Å; I663-T665 PolarHBondContact O-N 3.23Å; T665-V668 PolarHBondContact O-N 3.36Å; T665-L669 HydrophobicContact CG2-CD1 3.89Å; T665-L669 HydrophobicContact CG2-CG 4.29Å; T665-L669 WeakPolarHBondContact O-CB 3.44Å; T665-L669 VanDerWaalsContact O-CG 3.28Å; T665-L669 WeakPolarHBondContact O-CG 3.44Å; T665-L669 PolarHBondContact O-N 3.43Å; T665-T698 WeakPolarHBondContact CB-OG1 3.14Å; T665-T698 HydrophobicContact CG2-CG2 4.06Å; T665-T698 WeakPolarHBondContact CG2-OG1 3.4Å; T665-T698 PolarHBondContact OG1-OG1 2.71Å
666	K	90.8	Very high	83.4	Confident	106 Å²	106	53.1 Å²	53.1	46%	0.461	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-44.4	178.4	-166.4	174.3	173.4	-175.7	0	111.8	L616 F620 G662 I663 F664 V668 L669 E670	L616-K666 HydrophobicContact CD2-CD 3.78Å; F620-K666 HydrophobicContact CZ-CG 4.22Å; G662-K666 PolarHBondContact O-N 2.88Å; I663-K666 PolarHBondContact O-N 2.94Å; I663-K666 VanDerWaalsContact O-N 3.13Å; F664-K666 VanDerWaalsContact C-N 3.32Å; F664-K666 PolarHBondContact O-N 2.98Å; K666-V668 VanDerWaalsContact C-N 3.35Å; K666-V668 PolarHBondContact O-N 3.44Å; K666-L669 PolarHBondContact O-N 3.46Å; K666-E670 HydrophobicContact CG-CG 4.28Å; K666-E670 WeakPolarHBondContact O-CB 3.5Å; K666-E670 VanDerWaalsContact O-CG 3.29Å; K666-E670 WeakPolarHBondContact O-CG 3.32Å; K666-E670 PolarHBondContact O-N 2.84Å
667	V	91.1	Very high	83.9	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-43.4	177.7	175.2	0	0	0	0	111.5	L616 F620 L650 L653 I663 F664 A671	L616-V667 HydrophobicContact CD1-CG2 3.8Å; F620-V667 HydrophobicContact CE1-CG2 4.31Å; F620-V667 HydrophobicContact CZ-CG2 4.4Å; L650-V667 HydrophobicContact CD2-CB 4.45Å; L650-V667 HydrophobicContact CD2-CG1 3.94Å; L653-V667 HydrophobicContact CD1-CB 4.29Å; L653-V667 HydrophobicContact CD1-CG2 3.94Å; I663-V667 HydrophobicContact CG2-CG2 4.48Å; I663-V667 WeakPolarHBondContact O-CG2 3.31Å; I663-V667 PolarHBondContact O-N 2.56Å; F664-V667 PolarHBondContact O-N 2.81Å; V667-A671 WeakPolarHBondContact O-CB 3.48Å; V667-A671 PolarHBondContact O-N 3.38Å; V667-A671 VanDerWaalsContact O-N 3.07Å
668	V	92.5	Very high	85.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-41	177.8	171.2	0	0	0	0	112	L650 F664 T665 K666 I674 V682 T698 L702	L650-V668 HydrophobicContact CD1-CG2 4.37Å; L650-V668 HydrophobicContact CD2-CG2 3.57Å; F664-V668 HydrophobicContact CD1-CG2 4.09Å; F664-V668 HydrophobicContact CE1-CG2 3.75Å; F664-V668 HydrophobicContact CZ-CG2 4.12Å; F664-V668 WeakPolarHBondContact O-CG2 3.48Å; F664-V668 PolarHBondContact O-N 3.4Å; T665-V668 PolarHBondContact O-N 3.36Å; K666-V668 VanDerWaalsContact C-N 3.35Å; K666-V668 PolarHBondContact O-N 3.44Å; V668-I674 HydrophobicContact CG1-CD1 4.25Å; V668-V682 HydrophobicContact CG1-CG2 4.33Å; V668-V682 HydrophobicContact CG2-CG2 4.02Å; V668-T698 HydrophobicContact CB-CG2 4.09Å; V668-T698 HydrophobicContact CG1-CG2 3.87Å; V668-T698 HydrophobicContact CG2-CG2 4.48Å; V668-L702 HydrophobicContact CG1-CD1 3.61Å; V668-L702 HydrophobicContact CG1-CD2 3.82Å; V668-L702 HydrophobicContact CG1-CG 3.9Å
669	L	91.3	Very high	86.4	Confident	24 Å²	24	40.9 Å²	40.9	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-74.1	-31.8	-178.4	-71.5	179.8	0	0	0	113.6	T665 K666 D701 L702 K705 R706	T665-L669 HydrophobicContact CG2-CD1 3.89Å; T665-L669 HydrophobicContact CG2-CG 4.29Å; T665-L669 WeakPolarHBondContact O-CB 3.44Å; T665-L669 VanDerWaalsContact O-CG 3.28Å; T665-L669 WeakPolarHBondContact O-CG 3.44Å; T665-L669 PolarHBondContact O-N 3.43Å; K666-L669 PolarHBondContact O-N 3.46Å; L669-D701 HydrophobicContact CD1-CB 4.08Å; L669-D701 HydrophobicContact CD2-CB 4.04Å; L669-L702 HydrophobicContact CD2-CD2 4.04Å; L669-L702 HydrophobicContact CD2-CG 4.2Å; L669-K705 HydrophobicContact CD1-CD 4.05Å; L669-K705 HydrophobicContact CD2-CD 4.09Å; L669-R706 PolarHBondContact O-NE 3.21Å; L669-R706 PolarHBondContact O-NH2 2.97Å
670	E	90.9	Very high	87.5	Confident	91 Å²	91	45.7 Å²	45.7	43%	0.425	23%	0.229	S	C	.	.	H	α-helix	trans	-90	-13.2	-179.6	-63.1	-62.8	157.1	0	0	113	F620 Y624 K666	F620-E670 HydrophobicContact CD1-CB 4.21Å; F620-E670 HydrophobicContact CE1-CB 3.52Å; F620-E670 HydrophobicContact CE1-CG 4.19Å; F620-E670 HydrophobicContact CZ-CB 3.79Å; F620-E670 HydrophobicContact CZ-CG 3.92Å; Y624-E670 PolarHBondContact OH-O 3.5Å; K666-E670 HydrophobicContact CG-CG 4.28Å; K666-E670 WeakPolarHBondContact O-CB 3.5Å; K666-E670 VanDerWaalsContact O-CG 3.29Å; K666-E670 WeakPolarHBondContact O-CG 3.32Å; K666-E670 PolarHBondContact O-N 2.84Å
671	A	91.1	Very high	89	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-60	132.3	178.8	0	0	0	0	0	111.9	L623 L646 V667 L673 I674 R706	L623-A671 HydrophobicContact CD2-CB 3.81Å; L646-A671 HydrophobicContact CD1-CB 4.1Å; V667-A671 WeakPolarHBondContact O-CB 3.48Å; V667-A671 PolarHBondContact O-N 3.38Å; V667-A671 VanDerWaalsContact O-N 3.07Å; A671-L673 VanDerWaalsContact C-N 3.32Å; A671-L673 PolarHBondContact O-N 2.92Å; A671-I674 HydrophobicContact CB-CD1 3.82Å; A671-R706 PolarHBondContact O-NH1 2.97Å; A671-R706 PolarHBondContact O-NH2 3.43Å
672	P	89.3	Confident	90.2	Very high	28 Å²	28	32.8 Å²	32.8	18%	0.182	17%	0.17	C	C	.	.	S	Bend	trans	-52	-46.1	-178.2	-29.9	33.2	0	0	0	114.3	Y624 Y627 Y642 R706	Y624-P672 HydrophobicContact CD1-CG 3.74Å; Y624-P672 HydrophobicContact CD2-CG 4.49Å; Y624-P672 HydrophobicContact CE1-CG 3.73Å; Y624-P672 HydrophobicContact CE2-CG 4.47Å; Y624-P672 HydrophobicContact CG-CG 4.16Å; Y627-P672 HydrophobicContact CD1-CB 3.54Å; Y627-P672 HydrophobicContact CD1-CG 3.95Å; Y627-P672 HydrophobicContact CD2-CB 3.93Å; Y627-P672 HydrophobicContact CE1-CB 3.76Å; Y627-P672 HydrophobicContact CE2-CB 4.15Å; Y627-P672 HydrophobicContact CG-CB 3.62Å; Y627-P672 HydrophobicContact CG-CG 3.93Å; Y642-P672 HydrophobicContact CE2-CG 4.35Å; Y642-P672 WeakPolarHBondContact OH-CD 3.26Å; P672-R706 PolarHBondContact O-NH1 3.45Å
673	L	89.4	Confident	90.6	Very high	38 Å²	38	35 Å²	35	20%	0.199	17%	0.172	C	C	.	.			trans	-141.3	131.5	-177.6	-178.5	67.7	0	0	0	110.5	Y627 L639 Y642 A671	Y627-L673 HydrophobicContact CE2-CB 4.17Å; L639-L673 HydrophobicContact CD1-CD2 4.32Å; L639-L673 HydrophobicContact CD2-CD2 4.12Å; Y642-L673 HydrophobicContact CE1-CB 4.16Å; Y642-L673 VanDerWaalsContact CE1-O 3.28Å; Y642-L673 WeakPolarHBondContact CE1-O 3.41Å; Y642-L673 PolarHBondContact OH-N 2.97Å; Y642-L673 VanDerWaalsContact OH-N 3.07Å; Y642-L673 PolarHBondContact OH-O 2.94Å; A671-L673 VanDerWaalsContact C-N 3.32Å; A671-L673 PolarHBondContact O-N 2.92Å
674	I	91.3	Very high	90.7	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.19	C	C	.	.			trans	-91.9	113.3	171.1	-58.2	-57.8	0	0	0	108.8	L646 V668 A671 A678 L679 L702 R709 Y713	L646-I674 HydrophobicContact CD2-CD1 4.37Å; V668-I674 HydrophobicContact CG1-CD1 4.25Å; A671-I674 HydrophobicContact CB-CD1 3.82Å; I674-A678 HydrophobicContact CG2-CB 4.38Å; I674-L679 HydrophobicContact CG2-CB 4.16Å; I674-L702 HydrophobicContact CG1-CD2 4.33Å; I674-R709 PolarHBondContact O-NH1 3.46Å; I674-Y713 HydrophobicContact CB-CE1 4.31Å; I674-Y713 HydrophobicContact CG2-CE1 4.26Å
675	T	89.9	Confident	90.7	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.037	19%	0.19	C	C	.	.			trans	-76.5	164.9	174.6	70.5	0	0	0	0	111.3	L639 Y642 E643 A678 L679	L639-T675 HydrophobicContact CD2-CG2 3.71Å; L639-T675 HydrophobicContact CG-CG2 4.33Å; Y642-T675 HydrophobicContact CD1-CG2 4.4Å; Y642-T675 HydrophobicContact CE1-CG2 4.32Å; E643-T675 HydrophobicContact CB-CG2 4.19Å; E643-T675 HydrophobicContact CG-CG2 4.32Å; E643-T675 VanDerWaalsContact OE1-CB 3.3Å; E643-T675 WeakPolarHBondContact OE1-CB 3.41Å; E643-T675 PolarHBondContact OE1-OG1 3.46Å; T675-A678 PolarHBondContact O-N 3.12Å; T675-A678 WeakPolarHBondContact OG1-CB 3.28Å; T675-A678 PolarHBondContact OG1-N 3.33Å; T675-L679 WeakPolarHBondContact O-CB 3.34Å; T675-L679 PolarHBondContact O-N 3.26Å
676	E	88.6	Confident	90.7	Very high	140 Å²	140	38.7 Å²	38.7	65%	0.654	19%	0.186	S	C	*	.	H	α-helix	trans	-62.4	-44.2	179.1	-67.2	-176.6	174.1	0	0	111.2	A678 L679 E680	E676-A678 VanDerWaalsContact C-N 3.34Å; E676-A678 PolarHBondContact O-N 3.11Å; E676-L679 WeakPolarHBondContact O-CA 2.99Å; E676-L679 WeakPolarHBondContact O-CB 3.33Å; E676-L679 PolarHBondContact O-N 3.14Å; E676-L679 VanDerWaalsContact O-N 3.08Å; E676-E680 PolarHBondContact O-N 3.06Å
677	S	89.8	Confident	90.7	Very high	47 Å²	47	36 Å²	36	33%	0.329	18%	0.175	S	C	.	.	H	α-helix	trans	-64.2	-37.4	176.3	-37.8	0	0	0	0	112.4	E643 L679 E680 V681	E643-S677 WeakPolarHBondContact OE1-CB 3.38Å; E643-S677 PolarHBondContact OE1-OG 3.46Å; S677-L679 VanDerWaalsContact C-N 3.3Å; S677-L679 PolarHBondContact O-N 3.2Å; S677-E680 WeakPolarHBondContact O-CB 3.45Å; S677-E680 PolarHBondContact O-N 3.02Å; S677-V681 PolarHBondContact O-N 2.87Å
678	A	91.1	Very high	90.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-34.8	174	0	0	0	0	0	111.8	L646 L650 I674 T675 E676 E680 V681 V682	L646-A678 HydrophobicContact CD2-CB 3.62Å; L646-A678 HydrophobicContact CG-CB 4.05Å; L650-A678 HydrophobicContact CD1-CB 4.21Å; I674-A678 HydrophobicContact CG2-CB 4.38Å; T675-A678 PolarHBondContact O-N 3.12Å; T675-A678 WeakPolarHBondContact OG1-CB 3.28Å; T675-A678 PolarHBondContact OG1-N 3.33Å; E676-A678 VanDerWaalsContact C-N 3.34Å; E676-A678 PolarHBondContact O-N 3.11Å; A678-E680 VanDerWaalsContact C-N 3.32Å; A678-V681 WeakPolarHBondContact O-CB 3.39Å; A678-V681 PolarHBondContact O-N 3.26Å; A678-V682 WeakPolarHBondContact O-CG2 3.23Å; A678-V682 PolarHBondContact O-N 2.9Å; A678-V682 VanDerWaalsContact O-N 3.09Å
679	L	91.7	Very high	90.1	Very high	17 Å²	17	42.6 Å²	42.6	9%	0.089	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-32.8	174.3	-174.2	60.2	0	0	0	111.9	I674 T675 E676 S677 V681 V682 R683 L699 Y713 V716	I674-L679 HydrophobicContact CG2-CB 4.16Å; T675-L679 WeakPolarHBondContact O-CB 3.34Å; T675-L679 PolarHBondContact O-N 3.26Å; E676-L679 WeakPolarHBondContact O-CA 2.99Å; E676-L679 WeakPolarHBondContact O-CB 3.33Å; E676-L679 PolarHBondContact O-N 3.14Å; E676-L679 VanDerWaalsContact O-N 3.08Å; S677-L679 VanDerWaalsContact C-N 3.3Å; S677-L679 PolarHBondContact O-N 3.2Å; L679-V681 VanDerWaalsContact C-N 3.35Å; L679-V682 HydrophobicContact CD1-CB 4.48Å; L679-V682 WeakPolarHBondContact O-CB 3.41Å; L679-V682 PolarHBondContact O-N 3.49Å; L679-R683 PolarHBondContact O-N 3.02Å; L679-L699 HydrophobicContact CD1-CD2 4.33Å; L679-Y713 HydrophobicContact CD1-CD1 3.82Å; L679-Y713 HydrophobicContact CD1-CE1 4.27Å; L679-Y713 HydrophobicContact CD2-CD1 4.16Å; L679-Y713 HydrophobicContact CD2-CE1 4.47Å; L679-V716 HydrophobicContact CD1-CG2 4.11Å; L679-V716 HydrophobicContact CD2-CG2 3.7Å; L679-V716 HydrophobicContact CG-CG2 3.83Å
680	E	90.9	Very high	89.7	Confident	114 Å²	114	45.8 Å²	45.8	53%	0.533	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-37.7	170.4	-67.1	-179.2	-179.5	0	0	112.6	E676 S677 A678 V682 R683 K684	E676-E680 PolarHBondContact O-N 3.06Å; S677-E680 WeakPolarHBondContact O-CB 3.45Å; S677-E680 PolarHBondContact O-N 3.02Å; A678-E680 VanDerWaalsContact C-N 3.32Å; E680-V682 VanDerWaalsContact C-N 3.33Å; E680-R683 WeakPolarHBondContact O-CB 3.39Å; E680-R683 PolarHBondContact O-N 3.03Å; E680-K684 WeakPolarHBondContact O-CG 3.24Å; E680-K684 PolarHBondContact O-N 2.94Å
681	V	91.8	Very high	89.4	Confident	13 Å²	13	42.9 Å²	42.9	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-41.7	173	-177.9	0	0	0	0	110.5	I647 L650 S677 A678 L679 R683 K684 Y685	I647-V681 HydrophobicContact CG2-CG2 4.21Å; L650-V681 HydrophobicContact CB-CG1 3.78Å; S677-V681 PolarHBondContact O-N 2.87Å; A678-V681 WeakPolarHBondContact O-CB 3.39Å; A678-V681 PolarHBondContact O-N 3.26Å; L679-V681 VanDerWaalsContact C-N 3.35Å; V681-R683 VanDerWaalsContact C-N 3.33Å; V681-R683 PolarHBondContact O-N 2.93Å; V681-K684 PolarHBondContact O-N 3.27Å; V681-Y685 WeakPolarHBondContact O-CB 3.34Å; V681-Y685 PolarHBondContact O-N 3.33Å
682	V	91.8	Very high	89.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-38.9	173.9	176.8	0	0	0	0	111.4	F664 V668 A678 L679 E680 Y685 C686 L699	F664-V682 HydrophobicContact CE1-CG2 4.27Å; F664-V682 HydrophobicContact CZ-CG2 4.15Å; V668-V682 HydrophobicContact CG1-CG2 4.33Å; V668-V682 HydrophobicContact CG2-CG2 4.02Å; A678-V682 WeakPolarHBondContact O-CG2 3.23Å; A678-V682 PolarHBondContact O-N 2.9Å; A678-V682 VanDerWaalsContact O-N 3.09Å; L679-V682 HydrophobicContact CD1-CB 4.48Å; L679-V682 WeakPolarHBondContact O-CB 3.41Å; L679-V682 PolarHBondContact O-N 3.49Å; E680-V682 VanDerWaalsContact C-N 3.33Å; V682-Y685 WeakPolarHBondContact O-CB 3.32Å; V682-Y685 PolarHBondContact O-N 3.06Å; V682-C686 PolarHBondContact O-N 3.25Å; V682-C686 PolarHBondContact O-SG 2.76Å; V682-L699 HydrophobicContact CG1-CD2 3.77Å; V682-L699 HydrophobicContact CG1-CG 4.12Å
683	R	91.4	Very high	89.2	Confident	65 Å²	65	48.1 Å²	48.1	25%	0.245	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-51.6	173.3	-178	-169.2	-68.3	-86.9	6.5	110.8	L679 E680 V681 Y685 C686 E687 V716 D719 L720	L679-R683 PolarHBondContact O-N 3.02Å; E680-R683 WeakPolarHBondContact O-CB 3.39Å; E680-R683 PolarHBondContact O-N 3.03Å; V681-R683 VanDerWaalsContact C-N 3.33Å; V681-R683 PolarHBondContact O-N 2.93Å; R683-Y685 PolarHBondContact O-N 2.92Å; R683-C686 WeakPolarHBondContact O-CA 3.47Å; R683-C686 WeakPolarHBondContact O-CB 3.3Å; R683-C686 PolarHBondContact O-N 2.8Å; R683-E687 WeakPolarHBondContact O-CG 3.48Å; R683-E687 PolarHBondContact O-N 2.95Å; R683-E687 VanDerWaalsContact O-N 3.13Å; R683-V716 HydrophobicContact CB-CG1 4.13Å; R683-V716 HydrophobicContact CG-CG1 4.28Å; R683-D719 IonicContact CZ-OD2 2.92Å; R683-D719 VanDerWaalsContact NH1-CB 3.33Å; R683-D719 IonicContact NH1-OD2 3.8Å; R683-D719 PolarHBondContact NH1-OD2 3.29Å; R683-D719 IonicContact NH2-OD2 2.95Å; R683-D719 PolarHBondContact NH2-OD2 2.92Å; R683-L720 HydrophobicContact CG-CD2 4.44Å
684	K	90.4	Very high	89.2	Confident	118 Å²	118	48.2 Å²	48.2	51%	0.513	24%	0.235	S	C	.	.	H	α-helix	trans	-57.8	-36.4	176.1	-71.4	177.6	179.9	174.4	0	112.3	E680 V681 C686 E687	E680-K684 WeakPolarHBondContact O-CG 3.24Å; E680-K684 PolarHBondContact O-N 2.94Å; V681-K684 PolarHBondContact O-N 3.27Å; K684-C686 VanDerWaalsContact C-N 3.32Å; K684-C686 PolarHBondContact O-N 3.38Å; K684-E687 PolarHBondContact O-N 2.92Å
685	Y	89.5	Confident	89.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-34.2	174.3	-174.3	-102.2	0	0	0	112.9	Q654 F664 V681 V682 R683 E687 R691 L694	Q654-Y685 HydrophobicContact CG-CD2 4.29Å; F664-Y685 HydrophobicContact CB-CE2 4.37Å; F664-Y685 AromaticContact CD1-CD1 3.62Å; F664-Y685 HydrophobicContact CD1-CD1 3.62Å; F664-Y685 HydrophobicContact CD1-CD2 4.29Å; F664-Y685 AromaticContact CD1-CE1 3.52Å; F664-Y685 HydrophobicContact CD1-CE1 3.52Å; F664-Y685 HydrophobicContact CD1-CE2 4.21Å; F664-Y685 HydrophobicContact CD1-CG 4.01Å; F664-Y685 AromaticContact CD1-CZ 3.83Å; F664-Y685 HydrophobicContact CD2-CD2 4.09Å; F664-Y685 HydrophobicContact CD2-CE2 4.1Å; F664-Y685 HydrophobicContact CD2-CG 4.45Å; F664-Y685 AromaticContact CE1-CD1 3.42Å; F664-Y685 HydrophobicContact CE1-CD1 3.42Å; F664-Y685 VanDerWaalsContact CE1-CD1 3.42Å; F664-Y685 HydrophobicContact CE1-CD2 4.2Å; F664-Y685 AromaticContact CE1-CE1 3.86Å; F664-Y685 HydrophobicContact CE1-CE1 3.86Å; F664-Y685 AromaticContact CE1-CG 3.61Å; F664-Y685 HydrophobicContact CE1-CG 3.61Å; F664-Y685 AromaticContact CE2-CD2 3.99Å; F664-Y685 HydrophobicContact CE2-CD2 3.99Å; F664-Y685 HydrophobicContact CE2-CE2 4.46Å; F664-Y685 HydrophobicContact CE2-CG 4.09Å; F664-Y685 HydrophobicContact CG-CD1 4.34Å; F664-Y685 HydrophobicContact CG-CD2 4.24Å; F664-Y685 HydrophobicContact CG-CE1 4.06Å; F664-Y685 AromaticContact CG-CE2 3.97Å; F664-Y685 HydrophobicContact CG-CE2 3.97Å; F664-Y685 HydrophobicContact CG-CG 4.42Å; F664-Y685 AromaticContact CG-CZ 3.86Å; F664-Y685 AromaticContact CZ-CD1 3.99Å; F664-Y685 HydrophobicContact CZ-CD1 3.99Å; F664-Y685 HydrophobicContact CZ-CD2 4.05Å; F664-Y685 AromaticContact CZ-CG 3.66Å; F664-Y685 HydrophobicContact CZ-CG 3.66Å; V681-Y685 WeakPolarHBondContact O-CB 3.34Å; V681-Y685 PolarHBondContact O-N 3.33Å; V682-Y685 WeakPolarHBondContact O-CB 3.32Å; V682-Y685 PolarHBondContact O-N 3.06Å; R683-Y685 PolarHBondContact O-N 2.92Å; Y685-E687 VanDerWaalsContact C-N 3.35Å; Y685-R691 HydrophobicContact CE2-CB 4.46Å; Y685-L694 HydrophobicContact CE1-CG 4.39Å; Y685-L694 WeakPolarHBondContact OH-CD2 3.12Å
686	C	90.2	Very high	89.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-73.9	-25.1	175.3	-61.1	0	0	0	0	113.2	V682 R683 K684 D688 G695 M696 L699 L720	V682-C686 PolarHBondContact O-N 3.25Å; V682-C686 PolarHBondContact O-SG 2.76Å; R683-C686 WeakPolarHBondContact O-CA 3.47Å; R683-C686 WeakPolarHBondContact O-CB 3.3Å; R683-C686 PolarHBondContact O-N 2.8Å; K684-C686 VanDerWaalsContact C-N 3.32Å; K684-C686 PolarHBondContact O-N 3.38Å; C686-D688 VanDerWaalsContact C-N 3.31Å; C686-G695 VanDerWaalsContact SG-CA 3.59Å; C686-G695 PolarHBondContact SG-O 2.94Å; C686-M696 HydrophobicContact CB-CE 4.13Å; C686-M696 HydrophobicContact CB-SD 4.44Å; C686-L699 WeakPolarHBondContact SG-CD1 3.49Å; C686-L720 HydrophobicContact CB-CD1 3.65Å
687	E	90	Very high	89.4	Confident	50 Å²	50	41.9 Å²	41.9	23%	0.234	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11	179.4	-68.1	171.1	-172.1	0	0	113.9	R683 K684 Y685 E689 L720 H723 K725	R683-E687 WeakPolarHBondContact O-CG 3.48Å; R683-E687 PolarHBondContact O-N 2.95Å; R683-E687 VanDerWaalsContact O-N 3.13Å; K684-E687 PolarHBondContact O-N 2.92Å; Y685-E687 VanDerWaalsContact C-N 3.35Å; E687-E689 PolarHBondContact O-N 2.96Å; E687-L720 HydrophobicContact CG-CD2 4.01Å; E687-H723 IonicContact OE1-NE2 3.12Å; E687-K725 PolarHBondContact O-NZ 3.21Å
688	D	86.9	Confident	89.5	Confident	47 Å²	47	39.6 Å²	39.6	25%	0.251	19%	0.19	S	C	.	.			trans	-74.1	118.8	174.3	-176	-19.9	0	0	0	110.3	C686 S690 R691 T692	C686-D688 VanDerWaalsContact C-N 3.31Å; D688-S690 VanDerWaalsContact CG-OG 3.31Å; D688-S690 PolarHBondContact O-N 3.47Å; D688-S690 WeakPolarHBondContact OD1-CB 3.25Å; D688-S690 PolarHBondContact OD1-N 3.26Å; D688-S690 PolarHBondContact OD1-OG 3.36Å; D688-S690 PolarHBondContact OD2-OG 2.72Å; D688-R691 CarbonylContact O-C 3.47Å; D688-R691 PolarHBondContact O-N 2.98Å; D688-R691 IonicContact OD2-NE 2.74Å; D688-T692 WeakPolarHBondContact O-CA 3.33Å; D688-T692 PolarHBondContact O-N 3.06Å; D688-T692 PolarHBondContact O-OG1 2.94Å
689	E	84.3	Confident	89.6	Confident	94 Å²	94	39.6 Å²	39.6	44%	0.439	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.2	-177.9	-67.7	-160.8	174.4	0	0	114	E687 R691 T692 K725 K727	E687-E689 PolarHBondContact O-N 2.96Å; E689-R691 VanDerWaalsContact C-N 3.29Å; E689-T692 WeakPolarHBondContact CA-OG1 3.46Å; E689-K725 HydrophobicContact CG-CD 4.4Å; E689-K727 HydrophobicContact CB-CD 4.29Å; E689-K727 HydrophobicContact CG-CD 4.33Å; E689-K727 IonicContact OE2-NZ 2.75Å; E689-K727 PolarHBondContact OE2-NZ 2.93Å
690	S	84.2	Confident	89.6	Confident	91 Å²	91	41.9 Å²	41.9	64%	0.636	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.2	-179.3	69.6	0	0	0	0	112.3	D688	D688-S690 VanDerWaalsContact CG-OG 3.31Å; D688-S690 PolarHBondContact O-N 3.47Å; D688-S690 WeakPolarHBondContact OD1-CB 3.25Å; D688-S690 PolarHBondContact OD1-N 3.26Å; D688-S690 PolarHBondContact OD1-OG 3.36Å; D688-S690 PolarHBondContact OD2-OG 2.72Å
691	R	84.3	Confident	89.7	Confident	31 Å²	31	38 Å²	38	12%	0.117	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	6.4	-169.4	-67.1	166.4	-161	-178.2	1.9	114	Q654 K656 P657 Y685 D688 E689 Y693 L694 G695	Q654-R691 PolarHBondContact O-NH1 3.25Å; K656-R691 VanDerWaalsContact O-CZ 3.24Å; K656-R691 PolarHBondContact O-NH1 3.25Å; K656-R691 VanDerWaalsContact O-NH1 3.15Å; K656-R691 PolarHBondContact O-NH2 3.38Å; P657-R691 PolarHBondContact O-NH2 3.05Å; Y685-R691 HydrophobicContact CE2-CB 4.46Å; D688-R691 CarbonylContact O-C 3.47Å; D688-R691 PolarHBondContact O-N 2.98Å; D688-R691 IonicContact OD2-NE 2.74Å; E689-R691 VanDerWaalsContact C-N 3.29Å; R691-Y693 PolarHBondContact O-N 3.15Å; R691-Y693 VanDerWaalsContact O-N 3.1Å; R691-L694 PolarHBondContact O-N 2.89Å; R691-G695 PolarHBondContact O-N 3.12Å
692	T	87.6	Confident	89.7	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-47.6	-46.6	-176.8	-54.5	0	0	0	0	111.9	D688 E689 L694 G695 M696 V728 Q731	D688-T692 WeakPolarHBondContact O-CA 3.33Å; D688-T692 PolarHBondContact O-N 3.06Å; D688-T692 PolarHBondContact O-OG1 2.94Å; E689-T692 WeakPolarHBondContact CA-OG1 3.46Å; T692-L694 PolarHBondContact O-N 3.5Å; T692-G695 PolarHBondContact O-N 3.2Å; T692-M696 HydrophobicContact CG2-CE 3.9Å; T692-M696 HydrophobicContact CG2-CG 4.19Å; T692-M696 WeakPolarHBondContact O-CG 3.48Å; T692-M696 PolarHBondContact O-N 3.45Å; T692-V728 HydrophobicContact CG2-CB 4.35Å; T692-V728 HydrophobicContact CG2-CG2 4.21Å; T692-Q731 HydrophobicContact CG2-CB 3.78Å; T692-Q731 HydrophobicContact CG2-CG 3.95Å
693	Y	89.2	Confident	89.7	Confident	132 Å²	132	37.3 Å²	37.3	52%	0.518	18%	0.177	S	C	.	.	H	α-helix	trans	-59.5	-44.5	179.4	179.2	-92.6	0	0	0	112.9	R691 M696 S697 F735	R691-Y693 PolarHBondContact O-N 3.15Å; R691-Y693 VanDerWaalsContact O-N 3.1Å; Y693-M696 PolarHBondContact O-N 3.26Å; Y693-S697 WeakPolarHBondContact O-CB 3.26Å; Y693-S697 PolarHBondContact O-N 3.45Å; Y693-F735 HydrophobicContact CD2-CE2 4.02Å; Y693-F735 HydrophobicContact CD2-CZ 4.2Å; Y693-F735 HydrophobicContact CE2-CE2 4.06Å; Y693-F735 AromaticContact CE2-CZ 3.89Å; Y693-F735 HydrophobicContact CE2-CZ 3.89Å
694	L	88.6	Confident	89.6	Confident	40 Å²	40	37.7 Å²	37.7	21%	0.209	18%	0.18	C	C	.	.	H	α-helix	trans	-69	-38.4	179.9	-175.4	59.2	0	0	0	111.2	Q659 Y685 R691 T692 S697 T698	Q659-L694 WeakPolarHBondContact O-CD2 3.38Å; Y685-L694 HydrophobicContact CE1-CG 4.39Å; Y685-L694 WeakPolarHBondContact OH-CD2 3.12Å; R691-L694 PolarHBondContact O-N 2.89Å; T692-L694 PolarHBondContact O-N 3.5Å; L694-S697 PolarHBondContact O-N 3.09Å; L694-T698 WeakPolarHBondContact O-CB 3.39Å; L694-T698 PolarHBondContact O-N 2.67Å; L694-T698 PolarHBondContact O-OG1 3.37Å
695	G	89.9	Confident	89.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-50.1	172.6	0	0	0	0	0	112.4	C686 R691 T692 S697 T698 L699	C686-G695 VanDerWaalsContact SG-CA 3.59Å; C686-G695 PolarHBondContact SG-O 2.94Å; R691-G695 PolarHBondContact O-N 3.12Å; T692-G695 PolarHBondContact O-N 3.2Å; G695-S697 VanDerWaalsContact C-N 3.33Å; G695-S697 PolarHBondContact O-N 2.98Å; G695-T698 WeakPolarHBondContact O-CA 3.34Å; G695-T698 VanDerWaalsContact O-CB 3.32Å; G695-T698 WeakPolarHBondContact O-CB 3.21Å; G695-T698 PolarHBondContact O-N 3.45Å; G695-L699 PolarHBondContact O-N 3.42Å
696	M	91.6	Very high	89.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-38.9	177.3	-62.4	-58.4	171.7	0	0	112.2	C686 T692 Y693 T698 L699 R700 L717 L720 V728 Q731 A732 F735	C686-M696 HydrophobicContact CB-CE 4.13Å; C686-M696 HydrophobicContact CB-SD 4.44Å; T692-M696 HydrophobicContact CG2-CE 3.9Å; T692-M696 HydrophobicContact CG2-CG 4.19Å; T692-M696 WeakPolarHBondContact O-CG 3.48Å; T692-M696 PolarHBondContact O-N 3.45Å; Y693-M696 PolarHBondContact O-N 3.26Å; M696-T698 VanDerWaalsContact C-N 3.31Å; M696-T698 PolarHBondContact O-N 3.06Å; M696-L699 PolarHBondContact O-N 2.81Å; M696-R700 WeakPolarHBondContact O-CB 3.35Å; M696-R700 PolarHBondContact O-N 2.95Å; M696-L717 HydrophobicContact SD-CD1 3.57Å; M696-L717 VanDerWaalsContact SD-CD1 3.57Å; M696-L720 HydrophobicContact CE-CB 4.1Å; M696-L720 HydrophobicContact CE-CD1 3.87Å; M696-L720 HydrophobicContact CE-CG 4.44Å; M696-L720 HydrophobicContact SD-CD1 4.02Å; M696-V728 HydrophobicContact CE-CG1 3.6Å; M696-Q731 HydrophobicContact CG-CB 4.15Å; M696-A732 HydrophobicContact CE-CB 3.9Å; M696-A732 HydrophobicContact SD-CB 4.03Å; M696-F735 HydrophobicContact CB-CD2 3.6Å; M696-F735 HydrophobicContact CB-CE2 3.62Å; M696-F735 HydrophobicContact CB-CG 4.17Å; M696-F735 HydrophobicContact CB-CZ 4.18Å; M696-F735 HydrophobicContact CG-CD2 4.4Å
697	S	92.1	Very high	89	Confident	14 Å²	14	45.8 Å²	45.8	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-39	172.5	-169.8	0	0	0	0	111.8	Y693 L694 G695 R700 D701	Y693-S697 WeakPolarHBondContact O-CB 3.26Å; Y693-S697 PolarHBondContact O-N 3.45Å; L694-S697 PolarHBondContact O-N 3.09Å; G695-S697 VanDerWaalsContact C-N 3.33Å; G695-S697 PolarHBondContact O-N 2.98Å; S697-R700 PolarHBondContact O-N 3.28Å; S697-R700 PolarHBondContact OG-NH2 3.47Å; S697-D701 WeakPolarHBondContact O-CB 3.41Å; S697-D701 PolarHBondContact O-N 2.88Å
698	T	92.4	Very high	88.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-45.8	176.9	-55.9	0	0	0	0	111.2	T665 V668 L694 G695 M696 D701 L702	T665-T698 WeakPolarHBondContact CB-OG1 3.14Å; T665-T698 HydrophobicContact CG2-CG2 4.06Å; T665-T698 WeakPolarHBondContact CG2-OG1 3.4Å; T665-T698 PolarHBondContact OG1-OG1 2.71Å; V668-T698 HydrophobicContact CB-CG2 4.09Å; V668-T698 HydrophobicContact CG1-CG2 3.87Å; V668-T698 HydrophobicContact CG2-CG2 4.48Å; L694-T698 WeakPolarHBondContact O-CB 3.39Å; L694-T698 PolarHBondContact O-N 2.67Å; L694-T698 PolarHBondContact O-OG1 3.37Å; G695-T698 WeakPolarHBondContact O-CA 3.34Å; G695-T698 VanDerWaalsContact O-CB 3.32Å; G695-T698 WeakPolarHBondContact O-CB 3.21Å; G695-T698 PolarHBondContact O-N 3.45Å; M696-T698 VanDerWaalsContact C-N 3.31Å; M696-T698 PolarHBondContact O-N 3.06Å; T698-D701 PolarHBondContact O-N 3.09Å; T698-L702 WeakPolarHBondContact O-CG 3.17Å; T698-L702 PolarHBondContact O-N 3.32Å
699	L	92.9	Very high	88.6	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-44.2	174.9	-77.6	176	0	0	0	112	L679 V682 C686 G695 M696 D701 L702 I703 V716 L717 L720	L679-L699 HydrophobicContact CD1-CD2 4.33Å; V682-L699 HydrophobicContact CG1-CD2 3.77Å; V682-L699 HydrophobicContact CG1-CG 4.12Å; C686-L699 WeakPolarHBondContact SG-CD1 3.49Å; G695-L699 PolarHBondContact O-N 3.42Å; M696-L699 PolarHBondContact O-N 2.81Å; L699-D701 VanDerWaalsContact C-N 3.31Å; L699-D701 PolarHBondContact O-N 2.97Å; L699-L702 HydrophobicContact CD2-CD1 4.38Å; L699-L702 WeakPolarHBondContact O-CB 3.35Å; L699-L702 PolarHBondContact O-N 3.25Å; L699-I703 WeakPolarHBondContact O-CD1 3.46Å; L699-I703 VanDerWaalsContact O-CG1 3.22Å; L699-I703 WeakPolarHBondContact O-CG1 3.39Å; L699-I703 PolarHBondContact O-N 3.45Å; L699-V716 HydrophobicContact CD1-CG1 4Å; L699-V716 HydrophobicContact CD2-CB 4.5Å; L699-V716 HydrophobicContact CD2-CG1 4.23Å; L699-L717 HydrophobicContact CD1-CB 4.44Å; L699-L717 HydrophobicContact CD1-CD1 4.4Å; L699-L720 HydrophobicContact CD1-CD1 3.72Å
700	R	92.3	Very high	88.8	Confident	65 Å²	65	47.9 Å²	47.9	25%	0.245	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-47.7	174.3	-178.3	-157.5	63.4	-158.6	-4.8	111.1	M696 S697 L702 I703 F704 F735 M739	M696-R700 WeakPolarHBondContact O-CB 3.35Å; M696-R700 PolarHBondContact O-N 2.95Å; S697-R700 PolarHBondContact O-N 3.28Å; S697-R700 PolarHBondContact OG-NH2 3.47Å; R700-L702 VanDerWaalsContact C-N 3.34Å; R700-L702 PolarHBondContact O-N 2.92Å; R700-I703 PolarHBondContact O-N 2.92Å; R700-F704 HydrophobicContact CG-CD2 3.8Å; R700-F704 HydrophobicContact CG-CE2 3.57Å; R700-F704 WeakPolarHBondContact O-CD2 2.72Å; R700-F704 PolarHBondContact O-N 3.43Å; R700-F704 VanDerWaalsContact O-N 3.12Å; R700-F735 HydrophobicContact CB-CD1 3.9Å; R700-F735 HydrophobicContact CB-CE1 4.16Å; R700-F735 HydrophobicContact CG-CD1 4.15Å; R700-F735 HydrophobicContact CG-CE1 4.49Å; R700-M739 HydrophobicContact CB-SD 4.49Å; R700-M739 HydrophobicContact CG-SD 4.12Å
701	D	91.9	Very high	89	Confident	31 Å²	31	48.4 Å²	48.4	17%	0.166	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-34.5	-177.5	-65.4	-10.6	0	0	0	111.5	L669 S697 T698 L699 F704 K705	L669-D701 HydrophobicContact CD1-CB 4.08Å; L669-D701 HydrophobicContact CD2-CB 4.04Å; S697-D701 WeakPolarHBondContact O-CB 3.41Å; S697-D701 PolarHBondContact O-N 2.88Å; T698-D701 PolarHBondContact O-N 3.09Å; L699-D701 VanDerWaalsContact C-N 3.31Å; L699-D701 PolarHBondContact O-N 2.97Å; D701-F704 PolarHBondContact O-N 2.93Å; D701-K705 WeakPolarHBondContact O-CB 3.34Å; D701-K705 WeakPolarHBondContact O-CG 3.46Å; D701-K705 PolarHBondContact O-N 3.12Å
702	L	91.9	Very high	89.2	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-46.1	169.8	-81.2	173.4	0	0	0	112	V668 L669 I674 T698 L699 R700 F704 R706 Y713	V668-L702 HydrophobicContact CG1-CD1 3.61Å; V668-L702 HydrophobicContact CG1-CD2 3.82Å; V668-L702 HydrophobicContact CG1-CG 3.9Å; L669-L702 HydrophobicContact CD2-CD2 4.04Å; L669-L702 HydrophobicContact CD2-CG 4.2Å; I674-L702 HydrophobicContact CG1-CD2 4.33Å; T698-L702 WeakPolarHBondContact O-CG 3.17Å; T698-L702 PolarHBondContact O-N 3.32Å; L699-L702 HydrophobicContact CD2-CD1 4.38Å; L699-L702 WeakPolarHBondContact O-CB 3.35Å; L699-L702 PolarHBondContact O-N 3.25Å; R700-L702 VanDerWaalsContact C-N 3.34Å; R700-L702 PolarHBondContact O-N 2.92Å; L702-F704 VanDerWaalsContact C-N 3.27Å; L702-F704 PolarHBondContact O-N 3.48Å; L702-R706 WeakPolarHBondContact O-CB 3.49Å; L702-R706 PolarHBondContact O-N 3.07Å; L702-Y713 HydrophobicContact CB-CD2 3.97Å; L702-Y713 HydrophobicContact CB-CE2 4.37Å; L702-Y713 HydrophobicContact CB-CG 4.15Å; L702-Y713 HydrophobicContact CD1-CD1 4.47Å
703	I	91.3	Very high	89.4	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-37.1	179.4	-66	161.3	0	0	0	111.1	L699 R700 Q710 L714 L717 M739 L745	L699-I703 WeakPolarHBondContact O-CD1 3.46Å; L699-I703 VanDerWaalsContact O-CG1 3.22Å; L699-I703 WeakPolarHBondContact O-CG1 3.39Å; L699-I703 PolarHBondContact O-N 3.45Å; R700-I703 PolarHBondContact O-N 2.92Å; I703-Q710 HydrophobicContact CG2-CG 3.62Å; I703-Q710 WeakPolarHBondContact O-CG 3.38Å; I703-Q710 PolarHBondContact O-NE2 3.14Å; I703-L714 HydrophobicContact CD1-CB 4.18Å; I703-L714 HydrophobicContact CD1-CD1 4.22Å; I703-L714 HydrophobicContact CG1-CB 4.44Å; I703-L717 HydrophobicContact CD1-CB 4.42Å; I703-L717 HydrophobicContact CD1-CD2 3.98Å; I703-M739 HydrophobicContact CB-CE 3.92Å; I703-M739 HydrophobicContact CD1-CE 3.51Å; I703-M739 HydrophobicContact CD1-SD 4.33Å; I703-M739 HydrophobicContact CG1-CE 4.29Å; I703-M739 HydrophobicContact CG2-CE 3.46Å; I703-M739 VanDerWaalsContact CG2-CE 3.46Å; I703-L745 HydrophobicContact CG2-CD1 4.27Å
704	F	89.3	Confident	89.5	Confident	73 Å²	73	44.7 Å²	44.7	32%	0.32	22%	0.221	S	C	.	.	H	α-helix	trans	-87.8	-33.7	-178.9	-68.4	-46.3	0	0	0	114.7	R700 D701 L702 M739 K742 L745	R700-F704 HydrophobicContact CG-CD2 3.8Å; R700-F704 HydrophobicContact CG-CE2 3.57Å; R700-F704 WeakPolarHBondContact O-CD2 2.72Å; R700-F704 PolarHBondContact O-N 3.43Å; R700-F704 VanDerWaalsContact O-N 3.12Å; D701-F704 PolarHBondContact O-N 2.93Å; L702-F704 VanDerWaalsContact C-N 3.27Å; L702-F704 PolarHBondContact O-N 3.48Å; F704-M739 HydrophobicContact CE1-CE 4.41Å; F704-M739 HydrophobicContact CE2-CE 4.35Å; F704-M739 HydrophobicContact CE2-CG 4.26Å; F704-M739 HydrophobicContact CZ-CE 3.97Å; F704-M739 HydrophobicContact CZ-CG 3.93Å; F704-K742 HydrophobicContact CD1-CD 4.49Å; F704-K742 HydrophobicContact CE1-CD 3.49Å; F704-K742 VanDerWaalsContact CE1-CD 3.49Å; F704-K742 HydrophobicContact CZ-CD 3.79Å; F704-K742 VanDerWaalsContact CZ-NZ 3.29Å; F704-L745 HydrophobicContact CE1-CD1 4.15Å
705	K	88.9	Confident	89.6	Confident	138 Å²	138	46.3 Å²	46.3	60%	0.6	23%	0.227	S	C	*	.	H	α-helix	trans	-89.1	-15.7	-176.9	-64.8	179.2	175.4	-178	0	113.2	L669 D701	L669-K705 HydrophobicContact CD1-CD 4.05Å; L669-K705 HydrophobicContact CD2-CD 4.09Å; D701-K705 WeakPolarHBondContact O-CB 3.34Å; D701-K705 WeakPolarHBondContact O-CG 3.46Å; D701-K705 PolarHBondContact O-N 3.12Å
706	R	88.2	Confident	89.7	Confident	57 Å²	57	46.6 Å²	46.6	22%	0.215	23%	0.228	C	C	.	.			trans	-131.6	77.6	-175.8	-64.1	-173.5	172.1	-114.1	-5.8	112.9	L669 A671 P672 L702 S708 Y713	L669-R706 PolarHBondContact O-NE 3.21Å; L669-R706 PolarHBondContact O-NH2 2.97Å; A671-R706 PolarHBondContact O-NH1 2.97Å; A671-R706 PolarHBondContact O-NH2 3.43Å; P672-R706 PolarHBondContact O-NH1 3.45Å; L702-R706 WeakPolarHBondContact O-CB 3.49Å; L702-R706 PolarHBondContact O-N 3.07Å; R706-S708 VanDerWaalsContact C-N 3.29Å; R706-S708 PolarHBondContact O-N 2.97Å; R706-Y713 HydrophobicContact CB-CE2 3.97Å
707	P	81.8	Confident	89.7	Confident	92 Å²	92	46.6 Å²	46.6	60%	0.597	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-64.1	-26.9	-174.2	23.5	-32.6	0	0	0	114.4	R709 Q710	P707-R709 PolarHBondContact O-N 2.71Å; P707-R709 VanDerWaalsContact O-N 3.12Å; P707-Q710 VanDerWaalsContact O-CB 3.3Å; P707-Q710 WeakPolarHBondContact O-CB 3.42Å; P707-Q710 PolarHBondContact O-N 3.22Å; P707-Q710 VanDerWaalsContact O-N 3.15Å
708	S	82.7	Confident	89.7	Confident	123 Å²	123	45.9 Å²	45.9	86%	0.86	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-59.3	-28.9	-175.7	-44.8	0	0	0	0	114.6	R706	R706-S708 VanDerWaalsContact C-N 3.29Å; R706-S708 PolarHBondContact O-N 2.97Å
709	R	85.8	Confident	89.6	Confident	83 Å²	83	47.2 Å²	47.2	31%	0.313	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-125.3	24.3	177.8	-67.5	-176.2	178.1	-162.7	-7.6	112	I674 P707 F711 Q712 Y713	I674-R709 PolarHBondContact O-NH1 3.46Å; P707-R709 PolarHBondContact O-N 2.71Å; P707-R709 VanDerWaalsContact O-N 3.12Å; R709-F711 VanDerWaalsContact C-N 3.28Å; R709-F711 PolarHBondContact O-N 3.05Å; R709-Q712 WeakPolarHBondContact O-CB 3.11Å; R709-Q712 PolarHBondContact O-N 3.24Å; R709-Y713 HydrophobicContact CB-CE1 4.36Å; R709-Y713 HydrophobicContact CB-CE2 3.8Å; R709-Y713 WeakPolarHBondContact O-CD2 3.42Å; R709-Y713 PolarHBondContact O-N 3Å
710	Q	88.1	Confident	89.5	Confident	29 Å²	29	47.2 Å²	47.2	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-51.2	-45.4	-173.1	-170.2	175.6	30.9	0	0	113.3	I703 P707 Q712 Y713 L714 L745	I703-Q710 HydrophobicContact CG2-CG 3.62Å; I703-Q710 WeakPolarHBondContact O-CG 3.38Å; I703-Q710 PolarHBondContact O-NE2 3.14Å; P707-Q710 VanDerWaalsContact O-CB 3.3Å; P707-Q710 WeakPolarHBondContact O-CB 3.42Å; P707-Q710 PolarHBondContact O-N 3.22Å; P707-Q710 VanDerWaalsContact O-N 3.15Å; Q710-Q712 VanDerWaalsContact C-N 3.33Å; Q710-Q712 PolarHBondContact O-N 2.59Å; Q710-Y713 PolarHBondContact O-N 3.41Å; Q710-L714 WeakPolarHBondContact O-CB 3.29Å; Q710-L714 PolarHBondContact O-N 2.84Å; Q710-L745 HydrophobicContact CG-CD2 4.42Å
711	F	87.9	Confident	89.4	Confident	103 Å²	103	44.3 Å²	44.3	45%	0.452	22%	0.22	S	C	.	.	H	α-helix	trans	-68.7	-29.6	-177.8	-62.2	-68.5	0	0	0	113.3	R709 H715 Y748	R709-F711 VanDerWaalsContact C-N 3.28Å; R709-F711 PolarHBondContact O-N 3.05Å; F711-H715 VanDerWaalsContact O-CB 3.31Å; F711-H715 WeakPolarHBondContact O-CB 3.39Å; F711-H715 PolarHBondContact O-N 2.92Å; F711-Y748 HydrophobicContact CB-CE2 4.49Å; F711-Y748 HydrophobicContact CD1-CD1 4.17Å; F711-Y748 AromaticContact CD1-CD2 3.76Å; F711-Y748 HydrophobicContact CD1-CD2 3.76Å; F711-Y748 HydrophobicContact CD1-CE1 4.4Å; F711-Y748 HydrophobicContact CD1-CE2 4.04Å; F711-Y748 AromaticContact CD1-CG 3.83Å; F711-Y748 HydrophobicContact CD1-CG 3.83Å; F711-Y748 HydrophobicContact CE1-CD2 4.13Å; F711-Y748 HydrophobicContact CE1-CG 4.14Å
712	Q	89.5	Confident	89.1	Confident	84 Å²	84	43.8 Å²	43.8	39%	0.393	22%	0.219	S	C	.	.	H	α-helix	trans	-68.1	-44.9	175.5	-64	179.4	-4.6	0	0	110.6	R709 Q710 H715 V716	R709-Q712 WeakPolarHBondContact O-CB 3.11Å; R709-Q712 PolarHBondContact O-N 3.24Å; Q710-Q712 VanDerWaalsContact C-N 3.33Å; Q710-Q712 PolarHBondContact O-N 2.59Å; Q712-H715 WeakPolarHBondContact O-CB 3.3Å; Q712-H715 PolarHBondContact O-N 2.94Å; Q712-V716 PolarHBondContact O-N 3.33Å
713	Y	91.8	Very high	89	Confident	6 Å²	6	45.7 Å²	45.7	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-67.7	-38.8	177.2	-50.3	-41.2	0	0	0	111.9	I674 L679 L702 R706 R709 Q710 H715 V716 L717	I674-Y713 HydrophobicContact CB-CE1 4.31Å; I674-Y713 HydrophobicContact CG2-CE1 4.26Å; L679-Y713 HydrophobicContact CD1-CD1 3.82Å; L679-Y713 HydrophobicContact CD1-CE1 4.27Å; L679-Y713 HydrophobicContact CD2-CD1 4.16Å; L679-Y713 HydrophobicContact CD2-CE1 4.47Å; L702-Y713 HydrophobicContact CB-CD2 3.97Å; L702-Y713 HydrophobicContact CB-CE2 4.37Å; L702-Y713 HydrophobicContact CB-CG 4.15Å; L702-Y713 HydrophobicContact CD1-CD1 4.47Å; R706-Y713 HydrophobicContact CB-CE2 3.97Å; R709-Y713 HydrophobicContact CB-CE1 4.36Å; R709-Y713 HydrophobicContact CB-CE2 3.8Å; R709-Y713 WeakPolarHBondContact O-CD2 3.42Å; R709-Y713 PolarHBondContact O-N 3Å; Q710-Y713 PolarHBondContact O-N 3.41Å; Y713-H715 VanDerWaalsContact C-N 3.34Å; Y713-V716 PolarHBondContact O-N 2.94Å; Y713-L717 PolarHBondContact O-N 3.15Å
714	L	90.9	Very high	88.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-40.8	174.8	-179.6	60.4	0	0	0	111.4	I703 Q710 V716 L717 L718 M739 L745 Y748 V749	I703-L714 HydrophobicContact CD1-CB 4.18Å; I703-L714 HydrophobicContact CD1-CD1 4.22Å; I703-L714 HydrophobicContact CG1-CB 4.44Å; Q710-L714 WeakPolarHBondContact O-CB 3.29Å; Q710-L714 PolarHBondContact O-N 2.84Å; L714-V716 VanDerWaalsContact C-N 3.34Å; L714-V716 PolarHBondContact O-N 2.67Å; L714-L717 PolarHBondContact O-N 3.34Å; L714-L718 HydrophobicContact CD1-CD1 4.34Å; L714-L718 HydrophobicContact CD1-CG 4.26Å; L714-L718 HydrophobicContact CG-CD1 3.88Å; L714-L718 HydrophobicContact CG-CG 4.29Å; L714-L718 WeakPolarHBondContact O-CB 3.47Å; L714-L718 VanDerWaalsContact O-CG 3.25Å; L714-L718 WeakPolarHBondContact O-CG 3.43Å; L714-L718 PolarHBondContact O-N 3.12Å; L714-M739 HydrophobicContact CD1-CE 4.35Å; L714-L745 HydrophobicContact CD2-CD2 4.03Å; L714-Y748 HydrophobicContact CD2-CD1 3.57Å; L714-Y748 HydrophobicContact CD2-CE1 4.23Å; L714-Y748 HydrophobicContact CD2-CG 4.34Å; L714-Y748 HydrophobicContact CG-CD1 4.16Å; L714-Y748 HydrophobicContact CG-CE1 4.42Å; L714-V749 HydrophobicContact CD1-CG2 4.29Å; L714-V749 HydrophobicContact CD2-CG2 4.23Å
715	H	91.2	Very high	88.6	Confident	74 Å²	74	51.6 Å²	51.6	34%	0.343	26%	0.255	S	S	.	.	H	α-helix	trans	-58	-45.1	175.2	-171.5	-67.4	0	0	0	111.7	F711 Q712 Y713 L717 L718 D719	F711-H715 VanDerWaalsContact O-CB 3.31Å; F711-H715 WeakPolarHBondContact O-CB 3.39Å; F711-H715 PolarHBondContact O-N 2.92Å; Q712-H715 WeakPolarHBondContact O-CB 3.3Å; Q712-H715 PolarHBondContact O-N 2.94Å; Y713-H715 VanDerWaalsContact C-N 3.34Å; H715-L717 VanDerWaalsContact C-N 3.31Å; H715-L717 PolarHBondContact O-N 2.5Å; H715-L718 WeakPolarHBondContact O-CB 3.28Å; H715-L718 PolarHBondContact O-N 3.49Å; H715-L718 VanDerWaalsContact O-N 3.15Å; H715-D719 IonicContact CE1-OD1 2.71Å; H715-D719 PolarHBondContact CE1-OD1 2.92Å; H715-D719 IonicContact CE1-OD2 2.71Å; H715-D719 PolarHBondContact CE1-OD2 3.33Å; H715-D719 VanDerWaalsContact CE1-OD2 3.31Å; H715-D719 IonicContact ND1-OD1 3.95Å; H715-D719 PolarHBondContact ND1-OD1 3.39Å; H715-D719 IonicContact ND1-OD2 3.17Å; H715-D719 PolarHBondContact ND1-OD2 3.28Å; H715-D719 PolarHBondContact O-N 3.11Å
716	V	91.3	Very high	88.6	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.03	25%	0.25	C	S	.	.	H	α-helix	trans	-59.3	-43.8	176.1	176.4	0	0	0	0	111.4	L679 R683 L699 Q712 Y713 L714 L718 D719 L720	L679-V716 HydrophobicContact CD1-CG2 4.11Å; L679-V716 HydrophobicContact CD2-CG2 3.7Å; L679-V716 HydrophobicContact CG-CG2 3.83Å; R683-V716 HydrophobicContact CB-CG1 4.13Å; R683-V716 HydrophobicContact CG-CG1 4.28Å; L699-V716 HydrophobicContact CD1-CG1 4Å; L699-V716 HydrophobicContact CD2-CB 4.5Å; L699-V716 HydrophobicContact CD2-CG1 4.23Å; Q712-V716 PolarHBondContact O-N 3.33Å; Y713-V716 PolarHBondContact O-N 2.94Å; L714-V716 VanDerWaalsContact C-N 3.34Å; L714-V716 PolarHBondContact O-N 2.67Å; V716-L718 VanDerWaalsContact C-N 3.33Å; V716-L718 PolarHBondContact O-N 3Å; V716-D719 PolarHBondContact O-N 3.37Å; V716-L720 HydrophobicContact CG1-CD1 4.24Å; V716-L720 VanDerWaalsContact O-CG 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.37Å; V716-L720 PolarHBondContact O-N 3.24Å; V716-L720 VanDerWaalsContact O-N 3.15Å
717	L	92.4	Very high	88.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-38.9	176.9	-176.9	63.7	0	0	0	112	M696 L699 I703 Y713 L714 H715 L720 S721 A732 I736 M739	M696-L717 HydrophobicContact SD-CD1 3.57Å; M696-L717 VanDerWaalsContact SD-CD1 3.57Å; L699-L717 HydrophobicContact CD1-CB 4.44Å; L699-L717 HydrophobicContact CD1-CD1 4.4Å; I703-L717 HydrophobicContact CD1-CB 4.42Å; I703-L717 HydrophobicContact CD1-CD2 3.98Å; Y713-L717 PolarHBondContact O-N 3.15Å; L714-L717 PolarHBondContact O-N 3.34Å; H715-L717 VanDerWaalsContact C-N 3.31Å; H715-L717 PolarHBondContact O-N 2.5Å; L717-L720 PolarHBondContact O-N 3.15Å; L717-S721 PolarHBondContact O-N 3.49Å; L717-A732 HydrophobicContact CD1-CB 4.27Å; L717-I736 HydrophobicContact CD2-CG1 3.92Å; L717-I736 HydrophobicContact CG-CD1 4.24Å; L717-I736 HydrophobicContact CG-CG1 3.84Å; L717-M739 HydrophobicContact CD2-CE 4.46Å; L717-M739 HydrophobicContact CD2-SD 3.62Å
718	L	91.3	Very high	89	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-42	176.8	-71.5	168.7	0	0	0	111.8	L714 H715 V716 L720 S721 I736 Y748 V749 F752 L793	L714-L718 HydrophobicContact CD1-CD1 4.34Å; L714-L718 HydrophobicContact CD1-CG 4.26Å; L714-L718 HydrophobicContact CG-CD1 3.88Å; L714-L718 HydrophobicContact CG-CG 4.29Å; L714-L718 WeakPolarHBondContact O-CB 3.47Å; L714-L718 VanDerWaalsContact O-CG 3.25Å; L714-L718 WeakPolarHBondContact O-CG 3.43Å; L714-L718 PolarHBondContact O-N 3.12Å; H715-L718 WeakPolarHBondContact O-CB 3.28Å; H715-L718 PolarHBondContact O-N 3.49Å; H715-L718 VanDerWaalsContact O-N 3.15Å; V716-L718 VanDerWaalsContact C-N 3.33Å; V716-L718 PolarHBondContact O-N 3Å; L718-L720 VanDerWaalsContact C-N 3.28Å; L718-L720 PolarHBondContact O-N 2.78Å; L718-S721 VanDerWaalsContact O-CB 3.22Å; L718-S721 WeakPolarHBondContact O-CB 3.38Å; L718-S721 PolarHBondContact O-N 3.21Å; L718-S721 PolarHBondContact O-OG 3.24Å; L718-I736 HydrophobicContact CD2-CD1 4.01Å; L718-I736 HydrophobicContact CD2-CG1 4.39Å; L718-I736 HydrophobicContact CD2-CG2 4.3Å; L718-Y748 HydrophobicContact CD1-CD1 3.94Å; L718-Y748 HydrophobicContact CD1-CE1 3.88Å; L718-V749 HydrophobicContact CD2-CB 4.47Å; L718-V749 HydrophobicContact CD2-CG1 4.04Å; L718-V749 HydrophobicContact CD2-CG2 4.19Å; L718-F752 HydrophobicContact CB-CD1 3.92Å; L718-F752 HydrophobicContact CB-CD2 4.11Å; L718-F752 HydrophobicContact CB-CE1 3.79Å; L718-F752 HydrophobicContact CB-CE2 3.98Å; L718-F752 HydrophobicContact CB-CG 4.07Å; L718-F752 HydrophobicContact CB-CZ 3.8Å; L718-F752 HydrophobicContact CD1-CB 3.92Å; L718-F752 HydrophobicContact CD1-CD1 4.4Å; L718-F752 HydrophobicContact CD1-CD2 4.11Å; L718-F752 HydrophobicContact CD1-CG 3.9Å; L718-F752 HydrophobicContact CD2-CD1 4.24Å; L718-F752 HydrophobicContact CG-CD1 4.42Å; L718-F752 HydrophobicContact CG-CG 4.4Å; L718-L793 HydrophobicContact CD2-CD2 3.62Å
719	D	89.6	Confident	89.5	Confident	27 Å²	27	42.6 Å²	42.6	14%	0.144	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-43.7	174.1	-64.6	-25.9	0	0	0	111	R683 H715 V716 S721 S722	R683-D719 IonicContact CZ-OD2 2.92Å; R683-D719 VanDerWaalsContact NH1-CB 3.33Å; R683-D719 IonicContact NH1-OD2 3.8Å; R683-D719 PolarHBondContact NH1-OD2 3.29Å; R683-D719 IonicContact NH2-OD2 2.95Å; R683-D719 PolarHBondContact NH2-OD2 2.92Å; H715-D719 IonicContact CE1-OD1 2.71Å; H715-D719 PolarHBondContact CE1-OD1 2.92Å; H715-D719 IonicContact CE1-OD2 2.71Å; H715-D719 PolarHBondContact CE1-OD2 3.33Å; H715-D719 VanDerWaalsContact CE1-OD2 3.31Å; H715-D719 IonicContact ND1-OD1 3.95Å; H715-D719 PolarHBondContact ND1-OD1 3.39Å; H715-D719 IonicContact ND1-OD2 3.17Å; H715-D719 PolarHBondContact ND1-OD2 3.28Å; H715-D719 PolarHBondContact O-N 3.11Å; V716-D719 PolarHBondContact O-N 3.37Å; D719-S721 PolarHBondContact O-N 3.03Å; D719-S721 VanDerWaalsContact O-N 3.13Å; D719-S722 PolarHBondContact O-N 3.34Å; D719-S722 PolarHBondContact O-OG 3.28Å
720	L	90.8	Very high	89.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-18.6	178.9	-68.7	167.5	0	0	0	113.1	R683 C686 E687 M696 L699 V716 L717 L718 S722 H723 V728 A732	R683-L720 HydrophobicContact CG-CD2 4.44Å; C686-L720 HydrophobicContact CB-CD1 3.65Å; E687-L720 HydrophobicContact CG-CD2 4.01Å; M696-L720 HydrophobicContact CE-CB 4.1Å; M696-L720 HydrophobicContact CE-CD1 3.87Å; M696-L720 HydrophobicContact CE-CG 4.44Å; M696-L720 HydrophobicContact SD-CD1 4.02Å; L699-L720 HydrophobicContact CD1-CD1 3.72Å; V716-L720 HydrophobicContact CG1-CD1 4.24Å; V716-L720 VanDerWaalsContact O-CG 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.37Å; V716-L720 PolarHBondContact O-N 3.24Å; V716-L720 VanDerWaalsContact O-N 3.15Å; L717-L720 PolarHBondContact O-N 3.15Å; L718-L720 VanDerWaalsContact C-N 3.28Å; L718-L720 PolarHBondContact O-N 2.78Å; L720-S722 PolarHBondContact O-N 2.55Å; L720-H723 VanDerWaalsContact O-CB 3.29Å; L720-H723 WeakPolarHBondContact O-CB 3.49Å; L720-H723 PolarHBondContact O-N 2.94Å; L720-V728 HydrophobicContact CB-CG1 4.48Å; L720-V728 HydrophobicContact CD2-CG1 3.95Å; L720-A732 HydrophobicContact CB-CB 4.02Å
721	S	90.5	Very high	89.9	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.021	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.1	172.9	81.9	0	0	0	0	113.9	L717 L718 D719 R729	L717-S721 PolarHBondContact O-N 3.49Å; L718-S721 VanDerWaalsContact O-CB 3.22Å; L718-S721 WeakPolarHBondContact O-CB 3.38Å; L718-S721 PolarHBondContact O-N 3.21Å; L718-S721 PolarHBondContact O-OG 3.24Å; D719-S721 PolarHBondContact O-N 3.03Å; D719-S721 VanDerWaalsContact O-N 3.13Å; S721-R729 WeakPolarHBondContact O-CG 3.33Å
722	S	87.1	Confident	90.2	Very high	21 Å²	21	37.9 Å²	37.9	15%	0.147	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	9.6	176.3	66.6	0	0	0	0	113.2	D719 L720	D719-S722 PolarHBondContact O-N 3.34Å; D719-S722 PolarHBondContact O-OG 3.28Å; L720-S722 PolarHBondContact O-N 2.55Å
723	H	88.8	Confident	90.4	Very high	39 Å²	39	35 Å²	35	18%	0.181	17%	0.173	C	C	.	.			trans	-66.3	149.7	-174.7	-165.4	-89.4	0	0	0	113.2	E687 L720 K725 V728 R729	E687-H723 IonicContact OE1-NE2 3.12Å; L720-H723 VanDerWaalsContact O-CB 3.29Å; L720-H723 WeakPolarHBondContact O-CB 3.49Å; L720-H723 PolarHBondContact O-N 2.94Å; H723-K725 PolarHBondContact ND1-N 3.04Å; H723-K725 VanDerWaalsContact ND1-N 3.12Å; H723-K725 PolarHBondContact O-N 3.46Å; H723-V728 HydrophobicContact CB-CG1 4.21Å; H723-R729 PolarHBondContact O-NH1 3.44Å; H723-R729 VanDerWaalsContact O-NH1 3.12Å
724	E	83.8	Confident	90.4	Very high	115 Å²	115	37.9 Å²	37.9	54%	0.537	19%	0.188	S	C	.	.	S	Bend	trans	-63.5	-37.3	-178.3	-61.2	-174.6	172.6	0	0	112.3	K774	E724-K774 IonicContact OE1-NZ 3.38Å; E724-K774 PolarHBondContact OE1-NZ 2.68Å; E724-K774 IonicContact OE2-NZ 2.84Å
725	K	88.1	Confident	90.4	Very high	82 Å²	82	37.9 Å²	37.9	36%	0.357	19%	0.188	S	C	.	.	S	Bend	trans	-74.8	122.4	177.8	-63.7	174.1	-178.4	161.2	0	112.4	E687 E689 H723 K727 V728 R729	E687-K725 PolarHBondContact O-NZ 3.21Å; E689-K725 HydrophobicContact CG-CD 4.4Å; H723-K725 PolarHBondContact ND1-N 3.04Å; H723-K725 VanDerWaalsContact ND1-N 3.12Å; H723-K725 PolarHBondContact O-N 3.46Å; K725-K727 PolarHBondContact O-N 3.38Å; K725-V728 HydrophobicContact CB-CB 4.18Å; K725-V728 HydrophobicContact CB-CG2 3.88Å; K725-V728 HydrophobicContact CD-CG2 4.07Å; K725-V728 PolarHBondContact O-N 2.95Å; K725-R729 PolarHBondContact O-N 3.31Å; K725-R729 VanDerWaalsContact O-N 3.09Å
726	D	88.1	Confident	90.5	Very high	92 Å²	92	34.3 Å²	34.3	49%	0.492	17%	0.172	S	C	.	.	H	α-helix	trans	-62.6	-41.4	-176.5	-174.2	70.2	0	0	0	114.4	V728 R729 S730	D726-V728 PolarHBondContact O-N 3.49Å; D726-R729 PolarHBondContact O-N 2.9Å; D726-R729 IonicContact OD1-CZ 2.81Å; D726-R729 IonicContact OD1-NE 3.76Å; D726-R729 IonicContact OD1-NH2 3.92Å; D726-R729 PolarHBondContact OD1-NH2 2.94Å; D726-S730 VanDerWaalsContact O-CB 3.25Å; D726-S730 WeakPolarHBondContact O-CB 3.37Å; D726-S730 PolarHBondContact O-N 2.85Å; D726-S730 PolarHBondContact O-OG 3.33Å; D726-S730 VanDerWaalsContact O-OG 3.05Å
727	K	88.4	Confident	90.5	Very high	114 Å²	114	37.7 Å²	37.7	50%	0.496	19%	0.186	S	C	.	.	H	α-helix	trans	-61.6	-43.5	178.2	-70.9	-178.9	-171.9	159.2	0	112.1	E689 K725 Q731	E689-K727 HydrophobicContact CB-CD 4.29Å; E689-K727 HydrophobicContact CG-CD 4.33Å; E689-K727 IonicContact OE2-NZ 2.75Å; E689-K727 PolarHBondContact OE2-NZ 2.93Å; K725-K727 PolarHBondContact O-N 3.38Å; K727-Q731 WeakPolarHBondContact O-CB 3.05Å; K727-Q731 VanDerWaalsContact O-CG 3.31Å; K727-Q731 WeakPolarHBondContact O-CG 3.35Å; K727-Q731 PolarHBondContact O-N 3.11Å; K727-Q731 VanDerWaalsContact O-N 3.1Å
728	V	91.2	Very high	90.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-52.6	179.1	179.5	0	0	0	0	109.9	T692 M696 L720 H723 K725 D726 S730 Q731 A732	T692-V728 HydrophobicContact CG2-CB 4.35Å; T692-V728 HydrophobicContact CG2-CG2 4.21Å; M696-V728 HydrophobicContact CE-CG1 3.6Å; L720-V728 HydrophobicContact CB-CG1 4.48Å; L720-V728 HydrophobicContact CD2-CG1 3.95Å; H723-V728 HydrophobicContact CB-CG1 4.21Å; K725-V728 HydrophobicContact CB-CB 4.18Å; K725-V728 HydrophobicContact CB-CG2 3.88Å; K725-V728 HydrophobicContact CD-CG2 4.07Å; K725-V728 PolarHBondContact O-N 2.95Å; D726-V728 PolarHBondContact O-N 3.49Å; V728-S730 PolarHBondContact O-N 3.18Å; V728-Q731 PolarHBondContact O-N 3.49Å; V728-A732 WeakPolarHBondContact O-CB 3.44Å; V728-A732 PolarHBondContact O-N 3.08Å
729	R	92.4	Very high	90	Very high	16 Å²	16	44 Å²	44	6%	0.06	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-51.4	177.3	169.4	175.2	65.2	-138.3	11.1	112.6	S721 H723 K725 D726 Q731 A732 L733 E785 Y792	S721-R729 WeakPolarHBondContact O-CG 3.33Å; H723-R729 PolarHBondContact O-NH1 3.44Å; H723-R729 VanDerWaalsContact O-NH1 3.12Å; K725-R729 PolarHBondContact O-N 3.31Å; K725-R729 VanDerWaalsContact O-N 3.09Å; D726-R729 PolarHBondContact O-N 2.9Å; D726-R729 IonicContact OD1-CZ 2.81Å; D726-R729 IonicContact OD1-NE 3.76Å; D726-R729 IonicContact OD1-NH2 3.92Å; D726-R729 PolarHBondContact OD1-NH2 2.94Å; R729-Q731 VanDerWaalsContact C-N 3.3Å; R729-Q731 PolarHBondContact O-N 3.03Å; R729-A732 PolarHBondContact O-N 3.45Å; R729-L733 HydrophobicContact CG-CD1 3.88Å; R729-L733 HydrophobicContact CG-CG 4.42Å; R729-L733 WeakPolarHBondContact O-CB 3.48Å; R729-L733 VanDerWaalsContact O-CG 3.28Å; R729-L733 WeakPolarHBondContact O-CG 3.47Å; R729-L733 PolarHBondContact O-N 3.46Å; R729-E785 IonicContact NH1-OE1 2.8Å; R729-Y792 VanDerWaalsContact CD-CE2 3.42Å; R729-Y792 HydrophobicContact CG-CD2 4.46Å; R729-Y792 VanDerWaalsContact CZ-CZ 3.44Å; R729-Y792 VanDerWaalsContact NH1-CE2 3.33Å; R729-Y792 PolarHBondContact NH2-OH 3.26Å
730	S	90.8	Very high	90	Very high	56 Å²	56	42.8 Å²	42.8	39%	0.392	20%	0.204	S	C	.	.	H	α-helix	trans	-61.3	-38.4	-177.7	-70.1	0	0	0	0	112.2	D726 V728 L734	D726-S730 VanDerWaalsContact O-CB 3.25Å; D726-S730 WeakPolarHBondContact O-CB 3.37Å; D726-S730 PolarHBondContact O-N 2.85Å; D726-S730 PolarHBondContact O-OG 3.33Å; D726-S730 VanDerWaalsContact O-OG 3.05Å; V728-S730 PolarHBondContact O-N 3.18Å; S730-L734 PolarHBondContact O-N 3.23Å; S730-L734 VanDerWaalsContact O-N 3.14Å
731	Q	92.4	Very high	89.6	Confident	60 Å²	60	49.4 Å²	49.4	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-69.7	-45.9	173.9	-70.2	-61	-35.2	0	0	112	T692 M696 K727 V728 R729 L733 L734 F735	T692-Q731 HydrophobicContact CG2-CB 3.78Å; T692-Q731 HydrophobicContact CG2-CG 3.95Å; M696-Q731 HydrophobicContact CG-CB 4.15Å; K727-Q731 WeakPolarHBondContact O-CB 3.05Å; K727-Q731 VanDerWaalsContact O-CG 3.31Å; K727-Q731 WeakPolarHBondContact O-CG 3.35Å; K727-Q731 PolarHBondContact O-N 3.11Å; K727-Q731 VanDerWaalsContact O-N 3.1Å; V728-Q731 PolarHBondContact O-N 3.49Å; R729-Q731 VanDerWaalsContact C-N 3.3Å; R729-Q731 PolarHBondContact O-N 3.03Å; Q731-L733 VanDerWaalsContact C-N 3.31Å; Q731-L733 PolarHBondContact O-N 3.09Å; Q731-L734 WeakPolarHBondContact O-CB 3.14Å; Q731-L734 PolarHBondContact O-N 3.22Å; Q731-L734 VanDerWaalsContact O-N 3.1Å; Q731-F735 WeakPolarHBondContact O-CD2 3.48Å; Q731-F735 PolarHBondContact O-N 3.3Å
732	A	94.2	Very high	89.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-55.5	-47.7	176.6	0	0	0	0	0	111.2	M696 L717 L720 V728 R729 L734 F735 I736	M696-A732 HydrophobicContact CE-CB 3.9Å; M696-A732 HydrophobicContact SD-CB 4.03Å; L717-A732 HydrophobicContact CD1-CB 4.27Å; L720-A732 HydrophobicContact CB-CB 4.02Å; V728-A732 WeakPolarHBondContact O-CB 3.44Å; V728-A732 PolarHBondContact O-N 3.08Å; R729-A732 PolarHBondContact O-N 3.45Å; A732-L734 VanDerWaalsContact C-N 3.33Å; A732-L734 PolarHBondContact O-N 2.73Å; A732-F735 PolarHBondContact O-N 3.49Å; A732-I736 WeakPolarHBondContact O-CD1 3.39Å; A732-I736 VanDerWaalsContact O-CG1 3.26Å; A732-I736 WeakPolarHBondContact O-CG1 3.36Å; A732-I736 PolarHBondContact O-N 2.96Å
733	L	92.9	Very high	88.8	Confident	22 Å²	22	61.1 Å²	61.1	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-39.4	176.5	-69.1	172	0	0	0	112.7	R729 Q731 I736 K737 L793 A796	R729-L733 HydrophobicContact CG-CD1 3.88Å; R729-L733 HydrophobicContact CG-CG 4.42Å; R729-L733 WeakPolarHBondContact O-CB 3.48Å; R729-L733 VanDerWaalsContact O-CG 3.28Å; R729-L733 WeakPolarHBondContact O-CG 3.47Å; R729-L733 PolarHBondContact O-N 3.46Å; Q731-L733 VanDerWaalsContact C-N 3.31Å; Q731-L733 PolarHBondContact O-N 3.09Å; L733-I736 PolarHBondContact O-N 3.29Å; L733-K737 WeakPolarHBondContact O-CB 3.41Å; L733-K737 VanDerWaalsContact O-CG 3.25Å; L733-K737 WeakPolarHBondContact O-CG 3.39Å; L733-K737 PolarHBondContact O-N 3.49Å; L733-L793 HydrophobicContact CD2-CB 4.15Å; L733-L793 HydrophobicContact CD2-CD1 3.95Å; L733-A796 HydrophobicContact CD2-CB 3.95Å
734	L	92	Very high	88.5	Confident	67 Å²	67	67.1 Å²	67.1	35%	0.351	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-44.1	176.5	-179.6	67.6	0	0	0	111.7	S730 Q731 A732 R738	S730-L734 PolarHBondContact O-N 3.23Å; S730-L734 VanDerWaalsContact O-N 3.14Å; Q731-L734 WeakPolarHBondContact O-CB 3.14Å; Q731-L734 PolarHBondContact O-N 3.22Å; Q731-L734 VanDerWaalsContact O-N 3.1Å; A732-L734 VanDerWaalsContact C-N 3.33Å; A732-L734 PolarHBondContact O-N 2.73Å; L734-R738 WeakPolarHBondContact O-CG 3.26Å; L734-R738 PolarHBondContact O-N 3.19Å
735	F	91.6	Very high	88.6	Confident	1 Å²	1	61.8 Å²	61.8	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-68.1	-44.9	177.4	-84.3	-92.4	0	0	0	111.6	Y693 M696 R700 Q731 A732 K737 R738 M739	Y693-F735 HydrophobicContact CD2-CE2 4.02Å; Y693-F735 HydrophobicContact CD2-CZ 4.2Å; Y693-F735 HydrophobicContact CE2-CE2 4.06Å; Y693-F735 AromaticContact CE2-CZ 3.89Å; Y693-F735 HydrophobicContact CE2-CZ 3.89Å; M696-F735 HydrophobicContact CB-CD2 3.6Å; M696-F735 HydrophobicContact CB-CE2 3.62Å; M696-F735 HydrophobicContact CB-CG 4.17Å; M696-F735 HydrophobicContact CB-CZ 4.18Å; M696-F735 HydrophobicContact CG-CD2 4.4Å; R700-F735 HydrophobicContact CB-CD1 3.9Å; R700-F735 HydrophobicContact CB-CE1 4.16Å; R700-F735 HydrophobicContact CG-CD1 4.15Å; R700-F735 HydrophobicContact CG-CE1 4.49Å; Q731-F735 WeakPolarHBondContact O-CD2 3.48Å; Q731-F735 PolarHBondContact O-N 3.3Å; A732-F735 PolarHBondContact O-N 3.49Å; F735-K737 VanDerWaalsContact C-N 3.33Å; F735-K737 PolarHBondContact O-N 3.4Å; F735-R738 PolarHBondContact O-N 3.15Å; F735-R738 VanDerWaalsContact O-N 3.16Å; F735-M739 VanDerWaalsContact O-CG 3.22Å; F735-M739 WeakPolarHBondContact O-CG 3.45Å; F735-M739 PolarHBondContact O-N 3.33Å
736	I	93.3	Very high	88.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-43.6	177.4	-65.5	159.1	0	0	0	110.9	L717 L718 A732 L733 R738 M739 Y740 V749 L793	L717-I736 HydrophobicContact CD2-CG1 3.92Å; L717-I736 HydrophobicContact CG-CD1 4.24Å; L717-I736 HydrophobicContact CG-CG1 3.84Å; L718-I736 HydrophobicContact CD2-CD1 4.01Å; L718-I736 HydrophobicContact CD2-CG1 4.39Å; L718-I736 HydrophobicContact CD2-CG2 4.3Å; A732-I736 WeakPolarHBondContact O-CD1 3.39Å; A732-I736 VanDerWaalsContact O-CG1 3.26Å; A732-I736 WeakPolarHBondContact O-CG1 3.36Å; A732-I736 PolarHBondContact O-N 2.96Å; L733-I736 PolarHBondContact O-N 3.29Å; I736-R738 VanDerWaalsContact C-N 3.32Å; I736-R738 PolarHBondContact O-N 3.3Å; I736-M739 CarbonylContact O-C 3.47Å; I736-M739 PolarHBondContact O-N 3.46Å; I736-Y740 WeakPolarHBondContact O-CB 2.95Å; I736-Y740 PolarHBondContact O-N 2.98Å; I736-V749 HydrophobicContact CG2-CG1 3.79Å; I736-L793 HydrophobicContact CB-CD1 4.44Å; I736-L793 HydrophobicContact CD1-CD1 4.17Å; I736-L793 HydrophobicContact CG2-CD1 3.72Å
737	K	90.1	Very high	88.7	Confident	76 Å²	76	65.4 Å²	65.4	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-57.2	-41.8	175.5	-80	178.8	-177.2	-169.7	0	113.1	L733 F735 M739 A796	L733-K737 WeakPolarHBondContact O-CB 3.41Å; L733-K737 VanDerWaalsContact O-CG 3.25Å; L733-K737 WeakPolarHBondContact O-CG 3.39Å; L733-K737 PolarHBondContact O-N 3.49Å; F735-K737 VanDerWaalsContact C-N 3.33Å; F735-K737 PolarHBondContact O-N 3.4Å; K737-M739 VanDerWaalsContact C-N 3.33Å; K737-A796 WeakPolarHBondContact CE-O 3.44Å
738	R	88.6	Confident	88.7	Confident	127 Å²	127	63.6 Å²	63.6	48%	0.479	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-34.9	175.8	-70.6	175.8	-179.4	167.4	-0.9	111.8	L734 F735 I736	L734-R738 WeakPolarHBondContact O-CG 3.26Å; L734-R738 PolarHBondContact O-N 3.19Å; F735-R738 PolarHBondContact O-N 3.15Å; F735-R738 VanDerWaalsContact O-N 3.16Å; I736-R738 VanDerWaalsContact C-N 3.32Å; I736-R738 PolarHBondContact O-N 3.3Å
739	M	86.3	Confident	88.8	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.02	29%	0.29	C	S	.	.	H	α-helix	trans	-76.7	-28.2	-179.2	-67.3	176	69.4	0	0	112.8	R700 I703 F704 L714 L717 F735 I736 K737 E741 K742 L745	R700-M739 HydrophobicContact CB-SD 4.49Å; R700-M739 HydrophobicContact CG-SD 4.12Å; I703-M739 HydrophobicContact CB-CE 3.92Å; I703-M739 HydrophobicContact CD1-CE 3.51Å; I703-M739 HydrophobicContact CD1-SD 4.33Å; I703-M739 HydrophobicContact CG1-CE 4.29Å; I703-M739 HydrophobicContact CG2-CE 3.46Å; I703-M739 VanDerWaalsContact CG2-CE 3.46Å; F704-M739 HydrophobicContact CE1-CE 4.41Å; F704-M739 HydrophobicContact CE2-CE 4.35Å; F704-M739 HydrophobicContact CE2-CG 4.26Å; F704-M739 HydrophobicContact CZ-CE 3.97Å; F704-M739 HydrophobicContact CZ-CG 3.93Å; L714-M739 HydrophobicContact CD1-CE 4.35Å; L717-M739 HydrophobicContact CD2-CE 4.46Å; L717-M739 HydrophobicContact CD2-SD 3.62Å; F735-M739 VanDerWaalsContact O-CG 3.22Å; F735-M739 WeakPolarHBondContact O-CG 3.45Å; F735-M739 PolarHBondContact O-N 3.33Å; I736-M739 CarbonylContact O-C 3.47Å; I736-M739 PolarHBondContact O-N 3.46Å; K737-M739 VanDerWaalsContact C-N 3.33Å; M739-E741 PolarHBondContact O-N 3.47Å; M739-K742 WeakPolarHBondContact O-CB 3.36Å; M739-K742 PolarHBondContact O-N 2.81Å; M739-L745 HydrophobicContact CB-CD1 4.34Å; M739-L745 HydrophobicContact CE-CD1 3.79Å
740	Y	87.6	Confident	88.7	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.008	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.6	178	-173.3	-90.6	0	0	0	114	I736 K742 R746 V749 E750 L797 Q800 N801	I736-Y740 WeakPolarHBondContact O-CB 2.95Å; I736-Y740 PolarHBondContact O-N 2.98Å; Y740-K742 PolarHBondContact O-N 3.04Å; Y740-R746 HydrophobicContact CD2-CG 4.16Å; Y740-R746 HydrophobicContact CE1-CG 4.24Å; Y740-R746 HydrophobicContact CE2-CB 4.45Å; Y740-R746 HydrophobicContact CE2-CG 3.59Å; Y740-R746 PolarHBondContact O-NE 3.01Å; Y740-R746 PolarHBondContact O-NH2 2.87Å; Y740-V749 HydrophobicContact CD2-CB 4.22Å; Y740-V749 HydrophobicContact CD2-CG1 3.95Å; Y740-V749 HydrophobicContact CE2-CG1 4.46Å; Y740-E750 HydrophobicContact CE2-CG 3.76Å; Y740-E750 PolarHBondContact OH-OE1 3.23Å; Y740-L797 HydrophobicContact CD1-CD2 4.3Å; Y740-L797 HydrophobicContact CD2-CD1 4.44Å; Y740-L797 HydrophobicContact CD2-CD2 3.52Å; Y740-L797 HydrophobicContact CE2-CD1 4.18Å; Y740-L797 HydrophobicContact CE2-CD2 3.79Å; Y740-L797 HydrophobicContact CE2-CG 4.45Å; Y740-L797 HydrophobicContact CG-CD2 3.77Å; Y740-Q800 HydrophobicContact CD1-CB 4.29Å; Y740-Q800 HydrophobicContact CE1-CB 4.01Å; Y740-N801 WeakPolarHBondContact OH-CB 3.35Å; Y740-N801 PolarHBondContact OH-ND2 2.71Å
741	E	82.5	Confident	88.8	Confident	141 Å²	141	68.3 Å²	68.3	66%	0.659	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.8	170.1	-65.5	178.5	-179.1	0	0	112.2	M739	M739-E741 PolarHBondContact O-N 3.47Å
742	K	82.5	Confident	88.7	Confident	104 Å²	104	66.3 Å²	66.3	45%	0.452	30%	0.295	S	S	.	.	S	Bend	trans	-87.3	123.2	178.2	-62.3	-175.5	176.2	-170.7	0	111.3	F704 M739 Y740 Q744 L745 R746	F704-K742 HydrophobicContact CD1-CD 4.49Å; F704-K742 HydrophobicContact CE1-CD 3.49Å; F704-K742 VanDerWaalsContact CE1-CD 3.49Å; F704-K742 HydrophobicContact CZ-CD 3.79Å; F704-K742 VanDerWaalsContact CZ-NZ 3.29Å; M739-K742 WeakPolarHBondContact O-CB 3.36Å; M739-K742 PolarHBondContact O-N 2.81Å; Y740-K742 PolarHBondContact O-N 3.04Å; K742-Q744 VanDerWaalsContact C-N 3.32Å; K742-Q744 PolarHBondContact O-N 2.92Å; K742-L745 PolarHBondContact O-N 2.87Å; K742-R746 PolarHBondContact O-N 3.07Å
743	E	80	Confident	88.6	Confident	165 Å²	165	66.4 Å²	66.4	77%	0.771	30%	0.296	S	S	*	.	H	α-helix	trans	-58.4	-38.8	-173.7	-63.7	-173.9	163.7	0	0	113.7	L745 R746	E743-L745 PolarHBondContact O-N 2.81Å; E743-R746 WeakPolarHBondContact O-CB 3.4Å; E743-R746 PolarHBondContact O-N 3.11Å
744	Q	82.6	Confident	88.5	Confident	166 Å²	166	67.3 Å²	67.3	78%	0.776	30%	0.301	S	S	*	.	H	α-helix	trans	-62.9	-26.5	-177.2	-63.1	171.2	1.3	0	0	113.9	K742	K742-Q744 VanDerWaalsContact C-N 3.32Å; K742-Q744 PolarHBondContact O-N 2.92Å
745	L	85.1	Confident	88.5	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-97.5	-18.3	-178.2	-61.1	-175.8	0	0	0	112.6	I703 F704 Q710 L714 M739 K742 E743 E747 Y748 V749	I703-L745 HydrophobicContact CG2-CD1 4.27Å; F704-L745 HydrophobicContact CE1-CD1 4.15Å; Q710-L745 HydrophobicContact CG-CD2 4.42Å; L714-L745 HydrophobicContact CD2-CD2 4.03Å; M739-L745 HydrophobicContact CB-CD1 4.34Å; M739-L745 HydrophobicContact CE-CD1 3.79Å; K742-L745 PolarHBondContact O-N 2.87Å; E743-L745 PolarHBondContact O-N 2.81Å; L745-E747 PolarHBondContact O-N 3.48Å; L745-Y748 PolarHBondContact O-N 2.79Å; L745-V749 VanDerWaalsContact O-CG2 3.3Å; L745-V749 WeakPolarHBondContact O-CG2 3.44Å; L745-V749 PolarHBondContact O-N 3.48Å; L745-V749 VanDerWaalsContact O-N 3.11Å
746	R	89.2	Confident	88.3	Confident	92 Å²	92	69.4 Å²	69.4	35%	0.347	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-51.4	-171.3	-177.5	172.6	-66.3	170.5	3	112	Y740 K742 E743 Y748 V749 E750	Y740-R746 HydrophobicContact CD2-CG 4.16Å; Y740-R746 HydrophobicContact CE1-CG 4.24Å; Y740-R746 HydrophobicContact CE2-CB 4.45Å; Y740-R746 HydrophobicContact CE2-CG 3.59Å; Y740-R746 PolarHBondContact O-NE 3.01Å; Y740-R746 PolarHBondContact O-NH2 2.87Å; K742-R746 PolarHBondContact O-N 3.07Å; E743-R746 WeakPolarHBondContact O-CB 3.4Å; E743-R746 PolarHBondContact O-N 3.11Å; R746-Y748 VanDerWaalsContact C-N 3.31Å; R746-Y748 PolarHBondContact O-N 3.44Å; R746-V749 PolarHBondContact O-N 3.16Å; R746-E750 HydrophobicContact CG-CG 4.33Å; R746-E750 VanDerWaalsContact CG-OE1 3.3Å; R746-E750 WeakPolarHBondContact CG-OE1 3.37Å; R746-E750 WeakPolarHBondContact O-CG 3.5Å; R746-E750 PolarHBondContact O-N 3.41Å
747	E	88.6	Confident	88.2	Confident	159 Å²	159	69.5 Å²	69.5	74%	0.743	31%	0.31	S	S	*	.	H	α-helix	trans	-59.8	-41	-177.1	-171.6	-179.3	170.9	0	0	112.1	L745 K751	L745-E747 PolarHBondContact O-N 3.48Å; E747-K751 VanDerWaalsContact O-CB 3.3Å; E747-K751 WeakPolarHBondContact O-CB 3.43Å; E747-K751 PolarHBondContact O-N 3.1Å
748	Y	89.6	Confident	88.2	Confident	75 Å²	75	70.9 Å²	70.9	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-68.5	-42.7	179.7	-168.2	-94.2	0	0	0	112.2	F711 L714 L718 L745 R746 K751 F752	F711-Y748 HydrophobicContact CB-CE2 4.49Å; F711-Y748 HydrophobicContact CD1-CD1 4.17Å; F711-Y748 AromaticContact CD1-CD2 3.76Å; F711-Y748 HydrophobicContact CD1-CD2 3.76Å; F711-Y748 HydrophobicContact CD1-CE1 4.4Å; F711-Y748 HydrophobicContact CD1-CE2 4.04Å; F711-Y748 AromaticContact CD1-CG 3.83Å; F711-Y748 HydrophobicContact CD1-CG 3.83Å; F711-Y748 HydrophobicContact CE1-CD2 4.13Å; F711-Y748 HydrophobicContact CE1-CG 4.14Å; L714-Y748 HydrophobicContact CD2-CD1 3.57Å; L714-Y748 HydrophobicContact CD2-CE1 4.23Å; L714-Y748 HydrophobicContact CD2-CG 4.34Å; L714-Y748 HydrophobicContact CG-CD1 4.16Å; L714-Y748 HydrophobicContact CG-CE1 4.42Å; L718-Y748 HydrophobicContact CD1-CD1 3.94Å; L718-Y748 HydrophobicContact CD1-CE1 3.88Å; L745-Y748 PolarHBondContact O-N 2.79Å; R746-Y748 VanDerWaalsContact C-N 3.31Å; R746-Y748 PolarHBondContact O-N 3.44Å; Y748-K751 PolarHBondContact O-N 3.18Å; Y748-F752 PolarHBondContact O-N 3.32Å
749	V	92.3	Very high	88.2	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-65	-42.2	177.2	174.6	0	0	0	0	110.9	L714 L718 I736 Y740 L745 R746 F752 A753 L797	L714-V749 HydrophobicContact CD1-CG2 4.29Å; L714-V749 HydrophobicContact CD2-CG2 4.23Å; L718-V749 HydrophobicContact CD2-CB 4.47Å; L718-V749 HydrophobicContact CD2-CG1 4.04Å; L718-V749 HydrophobicContact CD2-CG2 4.19Å; I736-V749 HydrophobicContact CG2-CG1 3.79Å; Y740-V749 HydrophobicContact CD2-CB 4.22Å; Y740-V749 HydrophobicContact CD2-CG1 3.95Å; Y740-V749 HydrophobicContact CE2-CG1 4.46Å; L745-V749 VanDerWaalsContact O-CG2 3.3Å; L745-V749 WeakPolarHBondContact O-CG2 3.44Å; L745-V749 PolarHBondContact O-N 3.48Å; L745-V749 VanDerWaalsContact O-N 3.11Å; R746-V749 PolarHBondContact O-N 3.16Å; V749-F752 PolarHBondContact O-N 3.25Å; V749-A753 PolarHBondContact O-N 2.76Å; V749-L797 HydrophobicContact CG1-CD1 3.74Å; V749-L797 HydrophobicContact CG1-CD2 4.36Å
750	E	91.5	Very high	88.3	Confident	39 Å²	39	66.3 Å²	66.3	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-45.6	175	-71.6	-178.5	-173.2	0	0	111.5	Y740 R746 F752 A753 L754 N801	Y740-E750 HydrophobicContact CE2-CG 3.76Å; Y740-E750 PolarHBondContact OH-OE1 3.23Å; R746-E750 HydrophobicContact CG-CG 4.33Å; R746-E750 VanDerWaalsContact CG-OE1 3.3Å; R746-E750 WeakPolarHBondContact CG-OE1 3.37Å; R746-E750 WeakPolarHBondContact O-CG 3.5Å; R746-E750 PolarHBondContact O-N 3.41Å; E750-F752 VanDerWaalsContact C-N 3.32Å; E750-F752 PolarHBondContact O-N 3.39Å; E750-A753 PolarHBondContact O-N 3.46Å; E750-L754 WeakPolarHBondContact O-CB 3.26Å; E750-L754 VanDerWaalsContact O-CG 3.3Å; E750-L754 WeakPolarHBondContact O-CG 3.33Å; E750-L754 PolarHBondContact O-N 3.02Å; E750-N801 PolarHBondContact OE1-ND2 3.45Å
751	K	91.3	Very high	88.3	Confident	132 Å²	132	68.9 Å²	68.9	57%	0.574	32%	0.319	S	S	*	.	H	α-helix	trans	-59.4	-42.6	178.1	-170.1	174.2	-174.9	174.1	0	111.7	E747 Y748 L754 N755	E747-K751 VanDerWaalsContact O-CB 3.3Å; E747-K751 WeakPolarHBondContact O-CB 3.43Å; E747-K751 PolarHBondContact O-N 3.1Å; Y748-K751 PolarHBondContact O-N 3.18Å; K751-L754 PolarHBondContact O-N 3.49Å; K751-N755 WeakPolarHBondContact O-CB 3.48Å; K751-N755 PolarHBondContact O-N 2.71Å; K751-N755 PolarHBondContact O-ND2 3.39Å; K751-N755 PolarHBondContact O-OD1 3.09Å
752	F	90.9	Very high	88.4	Confident	17 Å²	17	66.8 Å²	66.8	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-46.9	174.9	-175.2	-84.3	0	0	0	111.9	L718 Y748 V749 E750 L754 N755 Y756 L793	L718-F752 HydrophobicContact CB-CD1 3.92Å; L718-F752 HydrophobicContact CB-CD2 4.11Å; L718-F752 HydrophobicContact CB-CE1 3.79Å; L718-F752 HydrophobicContact CB-CE2 3.98Å; L718-F752 HydrophobicContact CB-CG 4.07Å; L718-F752 HydrophobicContact CB-CZ 3.8Å; L718-F752 HydrophobicContact CD1-CB 3.92Å; L718-F752 HydrophobicContact CD1-CD1 4.4Å; L718-F752 HydrophobicContact CD1-CD2 4.11Å; L718-F752 HydrophobicContact CD1-CG 3.9Å; L718-F752 HydrophobicContact CD2-CD1 4.24Å; L718-F752 HydrophobicContact CG-CD1 4.42Å; L718-F752 HydrophobicContact CG-CG 4.4Å; Y748-F752 PolarHBondContact O-N 3.32Å; V749-F752 PolarHBondContact O-N 3.25Å; E750-F752 VanDerWaalsContact C-N 3.32Å; E750-F752 PolarHBondContact O-N 3.39Å; F752-L754 VanDerWaalsContact C-N 3.34Å; F752-L754 PolarHBondContact O-N 3.47Å; F752-N755 PolarHBondContact O-N 2.7Å; F752-Y756 AromaticContact CD1-CD2 3.97Å; F752-Y756 HydrophobicContact CD1-CD2 3.97Å; F752-Y756 HydrophobicContact CD1-CE2 4.18Å; F752-Y756 HydrophobicContact CD2-CE2 4.31Å; F752-Y756 AromaticContact CE1-CD2 3.6Å; F752-Y756 HydrophobicContact CE1-CD2 3.6Å; F752-Y756 AromaticContact CE1-CE2 3.45Å; F752-Y756 HydrophobicContact CE1-CE2 3.45Å; F752-Y756 VanDerWaalsContact CE1-CE2 3.45Å; F752-Y756 HydrophobicContact CE1-CG 4.36Å; F752-Y756 HydrophobicContact CE2-CD2 4.28Å; F752-Y756 AromaticContact CE2-CE2 3.61Å; F752-Y756 HydrophobicContact CE2-CE2 3.61Å; F752-Y756 HydrophobicContact CG-CD2 4.47Å; F752-Y756 AromaticContact CZ-CD2 3.78Å; F752-Y756 HydrophobicContact CZ-CD2 3.78Å; F752-Y756 AromaticContact CZ-CE2 3.13Å; F752-Y756 HydrophobicContact CZ-CE2 3.13Å; F752-Y756 AromaticContact CZ-CZ 3.67Å; F752-Y756 PolarHBondContact O-N 3.14Å; F752-L793 HydrophobicContact CD1-CD2 3.69Å; F752-L793 HydrophobicContact CE1-CD2 4.21Å
753	A	92.1	Very high	88.3	Confident	2 Å²	2	66.2 Å²	66.2	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-39.5	178.6	0	0	0	0	0	112.5	V749 E750 Y756 L757 L793 Y794 L797	V749-A753 PolarHBondContact O-N 2.76Å; E750-A753 PolarHBondContact O-N 3.46Å; A753-Y756 PolarHBondContact O-N 3.35Å; A753-L757 WeakPolarHBondContact O-CB 3.26Å; A753-L757 PolarHBondContact O-N 2.77Å; A753-L793 HydrophobicContact CB-CD2 3.96Å; A753-L793 HydrophobicContact CB-CG 4.08Å; A753-Y794 HydrophobicContact CB-CD2 4.15Å; A753-L797 HydrophobicContact CB-CD1 4.04Å
754	L	91.8	Very high	88.4	Confident	41 Å²	41	61.8 Å²	61.8	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-67.3	-41.6	175.9	-73.2	168.2	0	0	0	111.7	E750 K751 F752 Y756 L757 Q758 Y794 L804 E807	E750-L754 WeakPolarHBondContact O-CB 3.26Å; E750-L754 VanDerWaalsContact O-CG 3.3Å; E750-L754 WeakPolarHBondContact O-CG 3.33Å; E750-L754 PolarHBondContact O-N 3.02Å; K751-L754 PolarHBondContact O-N 3.49Å; F752-L754 VanDerWaalsContact C-N 3.34Å; F752-L754 PolarHBondContact O-N 3.47Å; L754-Y756 VanDerWaalsContact C-N 3.33Å; L754-Y756 PolarHBondContact O-N 3.19Å; L754-L757 WeakPolarHBondContact O-CB 3.27Å; L754-L757 PolarHBondContact O-N 3.01Å; L754-Q758 WeakPolarHBondContact O-CG 3.45Å; L754-Q758 PolarHBondContact O-N 2.8Å; L754-Y794 HydrophobicContact CD2-CE2 3.9Å; L754-L804 HydrophobicContact CD2-CD2 4.41Å; L754-E807 HydrophobicContact CD2-CB 3.9Å; L754-E807 HydrophobicContact CD2-CG 3.92Å
755	N	90.7	Very high	88.4	Confident	80 Å²	80	54.6 Å²	54.6	43%	0.428	27%	0.265	S	S	.	.	H	α-helix	trans	-58.8	-45.4	175.4	-70.9	-12.2	0	0	0	111.1	K751 F752 Q758 L759	K751-N755 WeakPolarHBondContact O-CB 3.48Å; K751-N755 PolarHBondContact O-N 2.71Å; K751-N755 PolarHBondContact O-ND2 3.39Å; K751-N755 PolarHBondContact O-OD1 3.09Å; F752-N755 PolarHBondContact O-N 2.7Å; N755-Q758 PolarHBondContact O-N 2.95Å; N755-L759 WeakPolarHBondContact O-CG 3.46Å; N755-L759 PolarHBondContact O-N 2.87Å
756	Y	88.8	Confident	88.1	Confident	33 Å²	33	56 Å²	56	13%	0.129	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-37.4	176.4	-91.9	-106.8	0	0	0	112.8	F752 A753 L754 L759 L769 C790	F752-Y756 AromaticContact CD1-CD2 3.97Å; F752-Y756 HydrophobicContact CD1-CD2 3.97Å; F752-Y756 HydrophobicContact CD1-CE2 4.18Å; F752-Y756 HydrophobicContact CD2-CE2 4.31Å; F752-Y756 AromaticContact CE1-CD2 3.6Å; F752-Y756 HydrophobicContact CE1-CD2 3.6Å; F752-Y756 AromaticContact CE1-CE2 3.45Å; F752-Y756 HydrophobicContact CE1-CE2 3.45Å; F752-Y756 VanDerWaalsContact CE1-CE2 3.45Å; F752-Y756 HydrophobicContact CE1-CG 4.36Å; F752-Y756 HydrophobicContact CE2-CD2 4.28Å; F752-Y756 AromaticContact CE2-CE2 3.61Å; F752-Y756 HydrophobicContact CE2-CE2 3.61Å; F752-Y756 HydrophobicContact CG-CD2 4.47Å; F752-Y756 AromaticContact CZ-CD2 3.78Å; F752-Y756 HydrophobicContact CZ-CD2 3.78Å; F752-Y756 AromaticContact CZ-CE2 3.13Å; F752-Y756 HydrophobicContact CZ-CE2 3.13Å; F752-Y756 AromaticContact CZ-CZ 3.67Å; F752-Y756 PolarHBondContact O-N 3.14Å; A753-Y756 PolarHBondContact O-N 3.35Å; L754-Y756 VanDerWaalsContact C-N 3.33Å; L754-Y756 PolarHBondContact O-N 3.19Å; Y756-L759 HydrophobicContact CD1-CD1 4.32Å; Y756-L759 HydrophobicContact CG-CD1 4.43Å; Y756-L759 WeakPolarHBondContact O-CB 3.42Å; Y756-L759 PolarHBondContact O-N 3.48Å; Y756-L769 HydrophobicContact CD1-CD2 4.19Å; Y756-L769 HydrophobicContact CE1-CD2 3.89Å; Y756-C790 WeakPolarHBondContact O-CB 3.27Å
757	L	90.8	Very high	87.3	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-42.9	174.3	-178.1	75.8	0	0	0	111.3	A753 L754 L759 L760 L791 Y794 E807 L808 V811	A753-L757 WeakPolarHBondContact O-CB 3.26Å; A753-L757 PolarHBondContact O-N 2.77Å; L754-L757 WeakPolarHBondContact O-CB 3.27Å; L754-L757 PolarHBondContact O-N 3.01Å; L757-L759 PolarHBondContact O-N 2.96Å; L757-L760 HydrophobicContact CD1-CD1 4.12Å; L757-L760 VanDerWaalsContact O-CB 3.29Å; L757-L760 WeakPolarHBondContact O-CB 3.4Å; L757-L760 WeakPolarHBondContact O-CG 3.39Å; L757-L760 PolarHBondContact O-N 2.9Å; L757-L760 VanDerWaalsContact O-N 3.09Å; L757-L791 HydrophobicContact CD1-CD2 3.63Å; L757-Y794 HydrophobicContact CB-CD2 4.2Å; L757-Y794 HydrophobicContact CB-CE2 4.45Å; L757-Y794 HydrophobicContact CD1-CD1 4.5Å; L757-Y794 HydrophobicContact CD2-CD2 4.18Å; L757-Y794 HydrophobicContact CD2-CE1 4.36Å; L757-Y794 HydrophobicContact CD2-CE2 3.64Å; L757-Y794 HydrophobicContact CG-CE2 4.49Å; L757-E807 HydrophobicContact CD2-CB 4.48Å; L757-L808 HydrophobicContact CD1-CD1 3.72Å; L757-V811 HydrophobicContact CD1-CG1 4.4Å; L757-V811 HydrophobicContact CD2-CB 4.23Å; L757-V811 HydrophobicContact CD2-CG2 3.85Å; L757-V811 HydrophobicContact CG-CB 4.21Å; L757-V811 HydrophobicContact CG-CG1 4.16Å; L757-V811 HydrophobicContact CG-CG2 4Å
758	Q	90.3	Very high	86.5	Confident	105 Å²	105	53.3 Å²	53.3	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-63.3	-24.5	179.9	-74.6	179.2	5.2	0	0	113.1	L754 N755 L760 V761	L754-Q758 WeakPolarHBondContact O-CG 3.45Å; L754-Q758 PolarHBondContact O-N 2.8Å; N755-Q758 PolarHBondContact O-N 2.95Å; Q758-L760 PolarHBondContact O-N 3.12Å; Q758-L760 VanDerWaalsContact O-N 3.14Å; Q758-V761 WeakPolarHBondContact O-CB 3.31Å; Q758-V761 PolarHBondContact O-N 3.35Å; Q758-V761 VanDerWaalsContact O-N 3.1Å
759	L	87.8	Confident	85.6	Confident	34 Å²	34	50.7 Å²	50.7	18%	0.178	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-58.7	-27.6	174.7	-55.1	179.1	0	0	0	112.1	N755 Y756 L757 V761 H762 P766 L769 W782	N755-L759 WeakPolarHBondContact O-CG 3.46Å; N755-L759 PolarHBondContact O-N 2.87Å; Y756-L759 HydrophobicContact CD1-CD1 4.32Å; Y756-L759 HydrophobicContact CG-CD1 4.43Å; Y756-L759 WeakPolarHBondContact O-CB 3.42Å; Y756-L759 PolarHBondContact O-N 3.48Å; L757-L759 PolarHBondContact O-N 2.96Å; L759-V761 PolarHBondContact O-N 3.32Å; L759-H762 WeakPolarHBondContact O-CB 3.33Å; L759-H762 PolarHBondContact O-N 3.39Å; L759-H762 VanDerWaalsContact O-N 3.1Å; L759-P766 HydrophobicContact CB-CG 4.31Å; L759-P766 HydrophobicContact CD2-CG 4.12Å; L759-L769 HydrophobicContact CD1-CD2 4Å; L759-L769 HydrophobicContact CD1-CG 4.32Å; L759-W782 HydrophobicContact CB-CH2 4.5Å; L759-W782 VanDerWaalsContact O-CZ2 3.3Å; L759-W782 WeakPolarHBondContact O-CZ2 3.37Å
760	L	88.1	Confident	84.5	Confident	2 Å²	2	53 Å²	53	1%	0.01	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-70.9	-9.6	-179.7	-61.3	177.5	0	0	0	114.2	L757 Q758 H762 W782 V787 C790 L791 V811 I819	L757-L760 HydrophobicContact CD1-CD1 4.12Å; L757-L760 VanDerWaalsContact O-CB 3.29Å; L757-L760 WeakPolarHBondContact O-CB 3.4Å; L757-L760 WeakPolarHBondContact O-CG 3.39Å; L757-L760 PolarHBondContact O-N 2.9Å; L757-L760 VanDerWaalsContact O-N 3.09Å; Q758-L760 PolarHBondContact O-N 3.12Å; Q758-L760 VanDerWaalsContact O-N 3.14Å; L760-H762 VanDerWaalsContact C-N 3.29Å; L760-W782 HydrophobicContact CD2-CE3 4.27Å; L760-W782 HydrophobicContact CD2-CH2 3.77Å; L760-W782 HydrophobicContact CD2-CZ2 4.28Å; L760-W782 HydrophobicContact CD2-CZ3 3.76Å; L760-V787 HydrophobicContact CD2-CB 4.38Å; L760-V787 HydrophobicContact CD2-CG1 4.04Å; L760-V787 HydrophobicContact CD2-CG2 4.29Å; L760-C790 HydrophobicContact CD1-CB 4.2Å; L760-C790 HydrophobicContact CD2-CB 3.86Å; L760-C790 HydrophobicContact CG-CB 3.98Å; L760-L791 HydrophobicContact CD1-CD1 4.41Å; L760-L791 HydrophobicContact CD1-CD2 3.67Å; L760-L791 HydrophobicContact CD1-CG 3.93Å; L760-V811 HydrophobicContact CB-CG1 4.22Å; L760-I819 HydrophobicContact CB-CD1 4.16Å; L760-I819 HydrophobicContact CB-CG2 4.16Å; L760-I819 HydrophobicContact CD1-CG2 4.21Å; L760-I819 HydrophobicContact CD2-CD1 4.25Å; L760-I819 HydrophobicContact CD2-CG2 4.27Å; L760-I819 HydrophobicContact CG-CG2 4.47Å; L760-I819 WeakPolarHBondContact O-CD1 3.37Å
761	V	88.4	Confident	82.9	Confident	55 Å²	55	53.3 Å²	53.3	33%	0.333	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-76.1	-23.8	171.7	-177.7	0	0	0	0	110.7	Q758 L759 V811 E814	Q758-V761 WeakPolarHBondContact O-CB 3.31Å; Q758-V761 PolarHBondContact O-N 3.35Å; Q758-V761 VanDerWaalsContact O-N 3.1Å; L759-V761 PolarHBondContact O-N 3.32Å; V761-V811 HydrophobicContact CG2-CG1 3.96Å; V761-V811 HydrophobicContact CG2-CG2 4.39Å; V761-E814 HydrophobicContact CG1-CB 4.23Å; V761-E814 HydrophobicContact CG2-CB 4.49Å
762	H	85.1	Confident	81.1	Confident	98 Å²	98	52.3 Å²	52.3	45%	0.454	31%	0.314	S	S	.	.	S	Bend	trans	-70.2	144.4	178.9	-67.4	-60.4	0	0	0	112	L759 L760 N764 W782	L759-H762 WeakPolarHBondContact O-CB 3.33Å; L759-H762 PolarHBondContact O-N 3.39Å; L759-H762 VanDerWaalsContact O-N 3.1Å; L760-H762 VanDerWaalsContact C-N 3.29Å; H762-N764 PolarHBondContact O-N 3.44Å; H762-W782 PolarHBondContact O-NE1 3.48Å
763	P	80.1	Confident	79	Confident	92 Å²	92	59.4 Å²	59.4	60%	0.597	35%	0.353	S	S	*	.	S	Bend	trans	-64.2	-30.7	-178.7	25.1	-34	0	0	0	112.8	W782	P763-W782 PolarHBondContact O-NE1 2.95Å
764	N	82.2	Confident	77.1	Confident	71 Å²	71	64.4 Å²	64.4	38%	0.38	37%	0.374	S	S	.	.	S	Bend	trans	-129.6	151.2	178.5	-64.3	-31.1	0	0	0	110.4	H762 P766	H762-N764 PolarHBondContact O-N 3.44Å; N764-P766 WeakPolarHBondContact O-CD 3.25Å
765	P	82.1	Confident	74.8	Confident	15 Å²	15	70.5 Å²	70.5	10%	0.097	41%	0.407	C	S	.	.			trans	-57.8	126	175.1	23.6	-34.9	0	0	0	111.5	L769 F770 A780 W782	P765-L769 HydrophobicContact CB-CD1 3.99Å; P765-F770 HydrophobicContact CB-CE2 3.84Å; P765-F770 HydrophobicContact CB-CZ 3.89Å; P765-F770 HydrophobicContact CG-CE2 3.97Å; P765-F770 HydrophobicContact CG-CZ 3.75Å; P765-A780 WeakPolarHBondContact CD-O 3.2Å; P765-A780 WeakPolarHBondContact CG-O 3.24Å; P765-W782 HydrophobicContact CB-CD2 4.14Å; P765-W782 HydrophobicContact CB-CE3 3.92Å; P765-W782 HydrophobicContact CB-CH2 4.05Å; P765-W782 HydrophobicContact CB-CZ2 4.24Å; P765-W782 HydrophobicContact CB-CZ3 3.88Å; P765-W782 HydrophobicContact CG-CD2 4.43Å
766	P	79.6	Confident	73	Confident	31 Å²	31	69.5 Å²	69.5	20%	0.201	40%	0.404	C	S	.	.			trans	-62	151.2	173.8	-25.5	36.9	0	0	0	112.3	L759 N764 V768 L769	L759-P766 HydrophobicContact CB-CG 4.31Å; L759-P766 HydrophobicContact CD2-CG 4.12Å; N764-P766 WeakPolarHBondContact O-CD 3.25Å; P766-V768 PolarHBondContact O-N 3.01Å; P766-L769 PolarHBondContact O-N 3.04Å; P766-L769 VanDerWaalsContact O-N 3.08Å
767	S	71.6	Confident	71.1	Confident	90 Å²	90	76.3 Å²	76.3	63%	0.629	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-56.2	-26.5	179.6	50.2	0	0	0	0	113.7	L769 F770	S767-L769 PolarHBondContact O-N 3.38Å; S767-F770 PolarHBondContact O-N 3.48Å; S767-F770 VanDerWaalsContact O-O 3.14Å
768	V	70.6	Confident	69.2	Low	106 Å²	106	83.4 Å²	83.4	64%	0.642	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-60.3	-23.7	178.3	-175.7	0	0	0	0	113.1	P766 F770	P766-V768 PolarHBondContact O-N 3.01Å; V768-F770 VanDerWaalsContact C-N 3.26Å; V768-F770 PolarHBondContact O-N 2.95Å
769	L	71.4	Confident	67.5	Low	19 Å²	19	81.7 Å²	81.7	10%	0.099	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-78.3	-12.5	176.9	-64.4	175.6	0	0	0	113	Y756 L759 P765 P766 S767 W782	Y756-L769 HydrophobicContact CD1-CD2 4.19Å; Y756-L769 HydrophobicContact CE1-CD2 3.89Å; L759-L769 HydrophobicContact CD1-CD2 4Å; L759-L769 HydrophobicContact CD1-CG 4.32Å; P765-L769 HydrophobicContact CB-CD1 3.99Å; P766-L769 PolarHBondContact O-N 3.04Å; P766-L769 VanDerWaalsContact O-N 3.08Å; S767-L769 PolarHBondContact O-N 3.38Å; L769-W782 HydrophobicContact CD1-CH2 3.65Å; L769-W782 HydrophobicContact CD1-CZ3 3.62Å
770	F	69.4	Low	66.6	Low	49 Å²	49	82.2 Å²	82.2	22%	0.215	49%	0.493	C	S	.	.	S	Bend	trans	-106.4	127.9	-179.7	-54.5	-80.6	0	0	0	108.9	P765 S767 V768 T776 T786	P765-F770 HydrophobicContact CB-CE2 3.84Å; P765-F770 HydrophobicContact CB-CZ 3.89Å; P765-F770 HydrophobicContact CG-CE2 3.97Å; P765-F770 HydrophobicContact CG-CZ 3.75Å; S767-F770 PolarHBondContact O-N 3.48Å; S767-F770 VanDerWaalsContact O-O 3.14Å; V768-F770 VanDerWaalsContact C-N 3.26Å; V768-F770 PolarHBondContact O-N 2.95Å; F770-T776 HydrophobicContact CB-CG2 3.96Å; F770-T776 HydrophobicContact CD1-CG2 3.79Å; F770-T776 HydrophobicContact CD2-CG2 3.87Å; F770-T776 HydrophobicContact CE1-CG2 4.22Å; F770-T776 HydrophobicContact CE2-CG2 4.28Å; F770-T776 HydrophobicContact CG-CG2 3.59Å; F770-T776 HydrophobicContact CZ-CG2 4.45Å; F770-T786 HydrophobicContact CE1-CG2 4.23Å; F770-T786 HydrophobicContact CZ-CG2 4.39Å
771	G	58.8	Low	66.2	Low	47 Å²	47	86.6 Å²	86.6	49%	0.485	52%	0.521	S	S	.	.			trans	-59	148.8	178.8	0	0	0	0	0	111.8	D773 K774	G771-D773 PolarHBondContact O-N 3.35Å; G771-K774 PolarHBondContact O-N 2.87Å
772	A	51.9	Low	66.2	Low	111 Å²	111	85 Å²	85	92%	0.917	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-19.5	-174.3	0	0	0	0	0	115
773	D	47.3	Very low	66.2	Low	166 Å²	166	83.8 Å²	83.8	89%	0.888	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.1	179.9	-68.2	-27.3	0	0	0	114.4	G771	G771-D773 PolarHBondContact O-N 3.35Å
774	K	52.4	Low	66.5	Low	106 Å²	106	83.2 Å²	83.2	46%	0.461	50%	0.499	S	S	.	.	S	Bend	trans	-104.8	100.4	177.1	-67.6	-178.2	-177.8	169.4	0	108.6	E724 G771 T776	E724-K774 IonicContact OE1-NZ 3.38Å; E724-K774 PolarHBondContact OE1-NZ 2.68Å; E724-K774 IonicContact OE2-NZ 2.84Å; G771-K774 PolarHBondContact O-N 2.87Å; K774-T776 PolarHBondContact O-N 3.31Å; K774-T776 PolarHBondContact O-OG1 2.94Å
775	D	43.7	Very low	66.7	Low	169 Å²	169	83.6 Å²	83.6	90%	0.904	50%	0.498	S	S	*	.			trans	-51.1	89.9	163.2	-76.9	-38.7	0	0	0	108.4	E777	D775-E777 PolarHBondContact O-N 3.33Å
776	T	52.1	Low	66.9	Low	60 Å²	60	83.4 Å²	83.4	37%	0.368	50%	0.496	S	S	.	.			trans	-88.3	104.4	-171.9	-4.7	0	0	0	0	107	F770 K774 V778	F770-T776 HydrophobicContact CB-CG2 3.96Å; F770-T776 HydrophobicContact CD1-CG2 3.79Å; F770-T776 HydrophobicContact CD2-CG2 3.87Å; F770-T776 HydrophobicContact CE1-CG2 4.22Å; F770-T776 HydrophobicContact CE2-CG2 4.28Å; F770-T776 HydrophobicContact CG-CG2 3.59Å; F770-T776 HydrophobicContact CZ-CG2 4.45Å; K774-T776 PolarHBondContact O-N 3.31Å; K774-T776 PolarHBondContact O-OG1 2.94Å; T776-V778 PolarHBondContact O-N 3.28Å
777	E	48.5	Very low	67.3	Low	176 Å²	176	82 Å²	82	82%	0.822	49%	0.487	S	S	*	.			trans	-48.4	133.6	169	-67.7	-176.6	163	0	0	110	D775 A779	D775-E777 PolarHBondContact O-N 3.33Å; E777-A779 PolarHBondContact O-N 3.49Å; E777-A779 VanDerWaalsContact O-N 3.13Å
778	V	52	Low	68.2	Low	150 Å²	150	79.8 Å²	79.8	91%	0.909	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	116.7	-178.5	179.3	0	0	0	0	109.6	T776	T776-V778 PolarHBondContact O-N 3.28Å
779	A	55.3	Low	69	Low	69 Å²	69	75.6 Å²	75.6	57%	0.57	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	56.8	171	0	0	0	0	0	118.6	E777	E777-A779 PolarHBondContact O-N 3.49Å; E777-A779 VanDerWaalsContact O-N 3.13Å
780	A	68.2	Low	69.8	Low	44 Å²	44	74.8 Å²	74.8	36%	0.364	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-68.4	138.2	158	0	0	0	0	0	111	P765	P765-A780 WeakPolarHBondContact CD-O 3.2Å; P765-A780 WeakPolarHBondContact CG-O 3.24Å
781	P	80.4	Confident	70.9	Confident	94 Å²	94	72.6 Å²	72.6	61%	0.61	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-72.5	158.5	174.7	29.8	-34.3	0	0	0	111.9	T783	P781-T783 PolarHBondContact O-N 2.86Å
782	W	86.9	Confident	72.4	Confident	21 Å²	21	72.6 Å²	72.6	8%	0.08	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-56.5	123.9	174.4	-75.5	102.9	0	0	0	111.5	L759 L760 H762 P763 P765 L769 V787 I816 I819	L759-W782 HydrophobicContact CB-CH2 4.5Å; L759-W782 VanDerWaalsContact O-CZ2 3.3Å; L759-W782 WeakPolarHBondContact O-CZ2 3.37Å; L760-W782 HydrophobicContact CD2-CE3 4.27Å; L760-W782 HydrophobicContact CD2-CH2 3.77Å; L760-W782 HydrophobicContact CD2-CZ2 4.28Å; L760-W782 HydrophobicContact CD2-CZ3 3.76Å; H762-W782 PolarHBondContact O-NE1 3.48Å; P763-W782 PolarHBondContact O-NE1 2.95Å; P765-W782 HydrophobicContact CB-CD2 4.14Å; P765-W782 HydrophobicContact CB-CE3 3.92Å; P765-W782 HydrophobicContact CB-CH2 4.05Å; P765-W782 HydrophobicContact CB-CZ2 4.24Å; P765-W782 HydrophobicContact CB-CZ3 3.88Å; P765-W782 HydrophobicContact CG-CD2 4.43Å; L769-W782 HydrophobicContact CD1-CH2 3.65Å; L769-W782 HydrophobicContact CD1-CZ3 3.62Å; W782-V787 HydrophobicContact CB-CG2 4.08Å; W782-V787 HydrophobicContact CD2-CG2 4.13Å; W782-V787 HydrophobicContact CE3-CG2 3.63Å; W782-V787 HydrophobicContact CG-CG2 4.36Å; W782-V787 HydrophobicContact CZ3-CG2 4.41Å; W782-I816 HydrophobicContact CG-CD1 4.41Å; W782-I819 HydrophobicContact CB-CG1 4.47Å; W782-I819 HydrophobicContact CD2-CD1 4.12Å; W782-I819 HydrophobicContact CD2-CG1 4.48Å; W782-I819 HydrophobicContact CG-CD1 4.07Å; W782-I819 HydrophobicContact CG-CG1 4.19Å
783	T	86.6	Confident	74.3	Confident	74 Å²	74	67.7 Å²	67.7	45%	0.454	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-98	156.5	170.5	69.2	0	0	0	0	110.4	P781 E785 T786 V787	P781-T783 PolarHBondContact O-N 2.86Å; T783-E785 PolarHBondContact O-N 2.87Å; T783-T786 PolarHBondContact N-OG1 3.39Å; T783-T786 PolarHBondContact O-N 2.91Å; T783-T786 PolarHBondContact O-OG1 3.1Å; T783-T786 WeakPolarHBondContact OG1-CG2 3.46Å; T783-T786 PolarHBondContact OG1-N 3.18Å; T783-T786 PolarHBondContact OG1-OG1 3.48Å; T783-V787 WeakPolarHBondContact O-CG2 3.18Å; T783-V787 PolarHBondContact O-N 3.4Å
784	E	86.2	Confident	76.5	Confident	80 Å²	80	59.8 Å²	59.8	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-54.9	-35.6	176.8	-175.3	174	166.9	0	0	112	K788 T822 R825	E784-K788 HydrophobicContact CG-CD 4.32Å; E784-K788 VanDerWaalsContact O-CG 3.23Å; E784-K788 WeakPolarHBondContact O-CG 3.26Å; E784-K788 PolarHBondContact O-N 3.49Å; E784-K788 VanDerWaalsContact O-N 3.08Å; E784-K788 VanDerWaalsContact OE1-CE 3.27Å; E784-K788 WeakPolarHBondContact OE1-CE 3.41Å; E784-K788 IonicContact OE1-NZ 3.53Å; E784-K788 PolarHBondContact OE1-NZ 3.3Å; E784-T822 HydrophobicContact CG-CG2 3.9Å; E784-R825 VanDerWaalsContact CD-NH1 3.31Å; E784-R825 IonicContact OE1-NH1 2.73Å; E784-R825 PolarHBondContact OE1-NH1 3.34Å; E784-R825 IonicContact OE2-NH1 3.51Å; E784-R825 PolarHBondContact OE2-NH1 3.32Å
785	E	85.3	Confident	78.4	Confident	78 Å²	78	55.6 Å²	55.6	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-72.3	-45	178.9	-166.3	62.9	-163.8	0	0	112.2	R729 T783 V787 K788 Q789 Y792	R729-E785 IonicContact NH1-OE1 2.8Å; T783-E785 PolarHBondContact O-N 2.87Å; E785-V787 VanDerWaalsContact C-N 3.27Å; E785-V787 PolarHBondContact O-N 3.49Å; E785-K788 WeakPolarHBondContact O-CB 3.46Å; E785-K788 PolarHBondContact O-N 2.81Å; E785-K788 VanDerWaalsContact O-N 3.1Å; E785-Q789 WeakPolarHBondContact O-CG 3.41Å; E785-Q789 PolarHBondContact O-N 2.98Å; E785-Y792 PolarHBondContact OE1-OH 3.04Å
786	T	86.8	Confident	80.7	Confident	11 Å²	11	48 Å²	48	7%	0.067	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-34.1	176.9	49.7	0	0	0	0	112.6	F770 T783 C790	F770-T786 HydrophobicContact CE1-CG2 4.23Å; F770-T786 HydrophobicContact CZ-CG2 4.39Å; T783-T786 PolarHBondContact N-OG1 3.39Å; T783-T786 PolarHBondContact O-N 2.91Å; T783-T786 PolarHBondContact O-OG1 3.1Å; T783-T786 WeakPolarHBondContact OG1-CG2 3.46Å; T783-T786 PolarHBondContact OG1-N 3.18Å; T783-T786 PolarHBondContact OG1-OG1 3.48Å; T786-C790 PolarHBondContact O-N 3.46Å
787	V	88.9	Confident	82.6	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-69.9	-41.7	174.1	175.8	0	0	0	0	110.6	L760 W782 T783 E785 Q789 C790 L791 I819 T822	L760-V787 HydrophobicContact CD2-CB 4.38Å; L760-V787 HydrophobicContact CD2-CG1 4.04Å; L760-V787 HydrophobicContact CD2-CG2 4.29Å; W782-V787 HydrophobicContact CB-CG2 4.08Å; W782-V787 HydrophobicContact CD2-CG2 4.13Å; W782-V787 HydrophobicContact CE3-CG2 3.63Å; W782-V787 HydrophobicContact CG-CG2 4.36Å; W782-V787 HydrophobicContact CZ3-CG2 4.41Å; T783-V787 WeakPolarHBondContact O-CG2 3.18Å; T783-V787 PolarHBondContact O-N 3.4Å; E785-V787 VanDerWaalsContact C-N 3.27Å; E785-V787 PolarHBondContact O-N 3.49Å; V787-Q789 VanDerWaalsContact C-N 3.32Å; V787-Q789 PolarHBondContact O-N 2.71Å; V787-C790 PolarHBondContact O-N 3.04Å; V787-L791 HydrophobicContact CG1-CD1 3.83Å; V787-L791 WeakPolarHBondContact O-CG 3.5Å; V787-L791 PolarHBondContact O-N 3.45Å; V787-I819 HydrophobicContact CG1-CG2 4.05Å; V787-I819 HydrophobicContact CG2-CG1 3.86Å; V787-T822 HydrophobicContact CB-CG2 4.03Å; V787-T822 HydrophobicContact CG1-CG2 3.72Å
788	K	89.2	Confident	84.6	Confident	43 Å²	43	36.8 Å²	36.8	19%	0.187	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-38.6	175.7	-75.7	171.6	-176.1	165.3	0	112.1	E784 E785 C790 L791 Y792 T822 V826	E784-K788 HydrophobicContact CG-CD 4.32Å; E784-K788 VanDerWaalsContact O-CG 3.23Å; E784-K788 WeakPolarHBondContact O-CG 3.26Å; E784-K788 PolarHBondContact O-N 3.49Å; E784-K788 VanDerWaalsContact O-N 3.08Å; E784-K788 VanDerWaalsContact OE1-CE 3.27Å; E784-K788 WeakPolarHBondContact OE1-CE 3.41Å; E784-K788 IonicContact OE1-NZ 3.53Å; E784-K788 PolarHBondContact OE1-NZ 3.3Å; E785-K788 WeakPolarHBondContact O-CB 3.46Å; E785-K788 PolarHBondContact O-N 2.81Å; E785-K788 VanDerWaalsContact O-N 3.1Å; K788-C790 VanDerWaalsContact C-N 3.31Å; K788-C790 PolarHBondContact O-N 3.08Å; K788-L791 CarbonylContact O-C 3.6Å; K788-L791 WeakPolarHBondContact O-CA 2.96Å; K788-L791 PolarHBondContact O-N 3.19Å; K788-Y792 HydrophobicContact CB-CE1 4.06Å; K788-Y792 HydrophobicContact CB-CE2 3.87Å; K788-Y792 WeakPolarHBondContact O-CD2 3.29Å; K788-Y792 PolarHBondContact O-N 3.15Å; K788-T822 HydrophobicContact CG-CG2 4.11Å; K788-V826 HydrophobicContact CG-CG1 4.21Å
789	Q	87.4	Confident	86.5	Confident	18 Å²	18	31.6 Å²	31.6	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-54.7	-44.2	176.1	-75	173.1	-14.7	0	0	112.6	E785 V787 L791 Y792	E785-Q789 WeakPolarHBondContact O-CG 3.41Å; E785-Q789 PolarHBondContact O-N 2.98Å; V787-Q789 VanDerWaalsContact C-N 3.32Å; V787-Q789 PolarHBondContact O-N 2.71Å; Q789-L791 VanDerWaalsContact C-N 3.27Å; Q789-L791 PolarHBondContact O-N 3.21Å; Q789-Y792 HydrophobicContact CG-CE2 4.3Å
790	C	89.1	Confident	88.1	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-27.6	174.5	-63.2	0	0	0	0	113.7	Y756 L760 T786 V787 K788	Y756-C790 WeakPolarHBondContact O-CB 3.27Å; L760-C790 HydrophobicContact CD1-CB 4.2Å; L760-C790 HydrophobicContact CD2-CB 3.86Å; L760-C790 HydrophobicContact CG-CB 3.98Å; T786-C790 PolarHBondContact O-N 3.46Å; V787-C790 PolarHBondContact O-N 3.04Å; K788-C790 VanDerWaalsContact C-N 3.31Å; K788-C790 PolarHBondContact O-N 3.08Å
791	L	91.1	Very high	89.2	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-96.4	-20.5	-172.1	-67.2	173.4	0	0	0	114	L757 L760 V787 K788 Q789 L793 Y794 L795 L808 V823 V826	L757-L791 HydrophobicContact CD1-CD2 3.63Å; L760-L791 HydrophobicContact CD1-CD1 4.41Å; L760-L791 HydrophobicContact CD1-CD2 3.67Å; L760-L791 HydrophobicContact CD1-CG 3.93Å; V787-L791 HydrophobicContact CG1-CD1 3.83Å; V787-L791 WeakPolarHBondContact O-CG 3.5Å; V787-L791 PolarHBondContact O-N 3.45Å; K788-L791 CarbonylContact O-C 3.6Å; K788-L791 WeakPolarHBondContact O-CA 2.96Å; K788-L791 PolarHBondContact O-N 3.19Å; Q789-L791 VanDerWaalsContact C-N 3.27Å; Q789-L791 PolarHBondContact O-N 3.21Å; L791-L793 PolarHBondContact O-N 3.16Å; L791-Y794 PolarHBondContact O-N 3.1Å; L791-L795 HydrophobicContact CB-CD1 3.86Å; L791-L795 HydrophobicContact CB-CG 4.13Å; L791-L795 VanDerWaalsContact O-CB 3.3Å; L791-L795 WeakPolarHBondContact O-CB 3.5Å; L791-L795 VanDerWaalsContact O-CG 3.23Å; L791-L795 WeakPolarHBondContact O-CG 3.4Å; L791-L795 PolarHBondContact O-N 2.86Å; L791-L808 HydrophobicContact CD2-CD1 4.37Å; L791-V823 HydrophobicContact CD1-CG2 3.74Å; L791-V826 HydrophobicContact CD1-CG2 4.08Å
792	Y	91.8	Very high	89.8	Confident	47 Å²	47	29.5 Å²	29.5	18%	0.184	15%	0.148	C	C	.	.	H	α-helix	trans	-56.5	-53.6	-170.9	-75.5	-52.5	0	0	0	113.8	R729 E785 K788 Q789 A796	R729-Y792 VanDerWaalsContact CD-CE2 3.42Å; R729-Y792 HydrophobicContact CG-CD2 4.46Å; R729-Y792 VanDerWaalsContact CZ-CZ 3.44Å; R729-Y792 VanDerWaalsContact NH1-CE2 3.33Å; R729-Y792 PolarHBondContact NH2-OH 3.26Å; E785-Y792 PolarHBondContact OE1-OH 3.04Å; K788-Y792 HydrophobicContact CB-CE1 4.06Å; K788-Y792 HydrophobicContact CB-CE2 3.87Å; K788-Y792 WeakPolarHBondContact O-CD2 3.29Å; K788-Y792 PolarHBondContact O-N 3.15Å; Q789-Y792 HydrophobicContact CG-CE2 4.3Å; Y792-A796 VanDerWaalsContact O-CB 3.24Å; Y792-A796 WeakPolarHBondContact O-CB 3.19Å; Y792-A796 PolarHBondContact O-N 3.33Å
793	L	92.1	Very high	90	Very high	8 Å²	8	34.9 Å²	34.9	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-45.7	178.3	178	62	0	0	0	111.1	L718 L733 I736 F752 A753 L791 L795 A796 L797	L718-L793 HydrophobicContact CD2-CD2 3.62Å; L733-L793 HydrophobicContact CD2-CB 4.15Å; L733-L793 HydrophobicContact CD2-CD1 3.95Å; I736-L793 HydrophobicContact CB-CD1 4.44Å; I736-L793 HydrophobicContact CD1-CD1 4.17Å; I736-L793 HydrophobicContact CG2-CD1 3.72Å; F752-L793 HydrophobicContact CD1-CD2 3.69Å; F752-L793 HydrophobicContact CE1-CD2 4.21Å; A753-L793 HydrophobicContact CB-CD2 3.96Å; A753-L793 HydrophobicContact CB-CG 4.08Å; L791-L793 PolarHBondContact O-N 3.16Å; L793-L795 PolarHBondContact O-N 3.19Å; L793-A796 WeakPolarHBondContact O-CB 3.47Å; L793-A796 PolarHBondContact O-N 3.46Å; L793-A796 VanDerWaalsContact O-N 3.15Å; L793-L797 HydrophobicContact CD1-CD1 4.06Å; L793-L797 HydrophobicContact CD1-CG 4.16Å; L793-L797 HydrophobicContact CG-CD1 4.03Å; L793-L797 HydrophobicContact CG-CG 4.5Å; L793-L797 WeakPolarHBondContact O-CG 3.34Å; L793-L797 PolarHBondContact O-N 2.96Å
794	Y	92.9	Very high	90.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.6	-49	-178.1	-171.9	-85.8	0	0	0	112.3	A753 L754 L757 L791 A796 L797 L798 L804 L808	A753-Y794 HydrophobicContact CB-CD2 4.15Å; L754-Y794 HydrophobicContact CD2-CE2 3.9Å; L757-Y794 HydrophobicContact CB-CD2 4.2Å; L757-Y794 HydrophobicContact CB-CE2 4.45Å; L757-Y794 HydrophobicContact CD1-CD1 4.5Å; L757-Y794 HydrophobicContact CD2-CD2 4.18Å; L757-Y794 HydrophobicContact CD2-CE1 4.36Å; L757-Y794 HydrophobicContact CD2-CE2 3.64Å; L757-Y794 HydrophobicContact CG-CE2 4.49Å; L791-Y794 PolarHBondContact O-N 3.1Å; Y794-A796 VanDerWaalsContact C-N 3.29Å; Y794-A796 PolarHBondContact O-N 3.31Å; Y794-L797 PolarHBondContact O-N 3.27Å; Y794-L798 PolarHBondContact O-N 3.39Å; Y794-L804 HydrophobicContact CE2-CB 4.26Å; Y794-L804 HydrophobicContact CE2-CD2 4.38Å; Y794-L804 VanDerWaalsContact OH-C 3.28Å; Y794-L804 PolarHBondContact OH-O 2.8Å; Y794-L808 HydrophobicContact CE1-CB 3.85Å; Y794-L808 HydrophobicContact CE1-CD1 4.22Å; Y794-L808 HydrophobicContact CE1-CD2 4.41Å; Y794-L808 HydrophobicContact CE1-CG 4.38Å; Y794-L808 PolarHBondContact OH-N 3.3Å; Y794-L808 VanDerWaalsContact OH-N 3.14Å
795	L	92.1	Very high	90.6	Very high	18 Å²	18	28 Å²	28	9%	0.094	14%	0.135	C	C	.	.	H	α-helix	trans	-68.7	-27.6	177.9	-66.4	179.8	0	0	0	112.8	L791 L793 L798 P799 V826 I827 P830	L791-L795 HydrophobicContact CB-CD1 3.86Å; L791-L795 HydrophobicContact CB-CG 4.13Å; L791-L795 VanDerWaalsContact O-CB 3.3Å; L791-L795 WeakPolarHBondContact O-CB 3.5Å; L791-L795 VanDerWaalsContact O-CG 3.23Å; L791-L795 WeakPolarHBondContact O-CG 3.4Å; L791-L795 PolarHBondContact O-N 2.86Å; L793-L795 PolarHBondContact O-N 3.19Å; L795-L798 HydrophobicContact CD2-CD2 4.37Å; L795-P799 WeakPolarHBondContact O-CD 3.34Å; L795-V826 HydrophobicContact CD1-CB 3.84Å; L795-V826 HydrophobicContact CD1-CG2 3.4Å; L795-I827 HydrophobicContact CD2-CD1 3.61Å; L795-P830 HydrophobicContact CB-CG 3.8Å; L795-P830 HydrophobicContact CD2-CG 4.15Å; L795-P830 HydrophobicContact CG-CG 4.38Å
796	A	91.1	Very high	90.9	Very high	10 Å²	10	26.8 Å²	26.8	8%	0.083	13%	0.129	C	C	.	.	H	α-helix	trans	-67.8	-34.3	172.4	0	0	0	0	0	112.7	L733 K737 Y792 L793 Y794	L733-A796 HydrophobicContact CD2-CB 3.95Å; K737-A796 WeakPolarHBondContact CE-O 3.44Å; Y792-A796 VanDerWaalsContact O-CB 3.24Å; Y792-A796 WeakPolarHBondContact O-CB 3.19Å; Y792-A796 PolarHBondContact O-N 3.33Å; L793-A796 WeakPolarHBondContact O-CB 3.47Å; L793-A796 PolarHBondContact O-N 3.46Å; L793-A796 VanDerWaalsContact O-N 3.15Å; Y794-A796 VanDerWaalsContact C-N 3.29Å; Y794-A796 PolarHBondContact O-N 3.31Å
797	L	92.2	Very high	91.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-84.6	-25.6	-179.8	-63.6	174.1	0	0	0	113.2	Y740 V749 A753 L793 Y794 P799 Q800 N801 L804	Y740-L797 HydrophobicContact CD1-CD2 4.3Å; Y740-L797 HydrophobicContact CD2-CD1 4.44Å; Y740-L797 HydrophobicContact CD2-CD2 3.52Å; Y740-L797 HydrophobicContact CE2-CD1 4.18Å; Y740-L797 HydrophobicContact CE2-CD2 3.79Å; Y740-L797 HydrophobicContact CE2-CG 4.45Å; Y740-L797 HydrophobicContact CG-CD2 3.77Å; V749-L797 HydrophobicContact CG1-CD1 3.74Å; V749-L797 HydrophobicContact CG1-CD2 4.36Å; A753-L797 HydrophobicContact CB-CD1 4.04Å; L793-L797 HydrophobicContact CD1-CD1 4.06Å; L793-L797 HydrophobicContact CD1-CG 4.16Å; L793-L797 HydrophobicContact CG-CD1 4.03Å; L793-L797 HydrophobicContact CG-CG 4.5Å; L793-L797 WeakPolarHBondContact O-CG 3.34Å; L793-L797 PolarHBondContact O-N 2.96Å; Y794-L797 PolarHBondContact O-N 3.27Å; L797-P799 VanDerWaalsContact C-CD 3.49Å; L797-Q800 WeakPolarHBondContact O-CA 3.36Å; L797-Q800 WeakPolarHBondContact O-CB 3.22Å; L797-Q800 PolarHBondContact O-N 3.47Å; L797-N801 PolarHBondContact O-N 3.03Å; L797-L804 HydrophobicContact CB-CD1 4.1Å
798	L	91.6	Very high	91.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-40.1	-175.9	-171.4	68.1	0	0	0	114.8	Y794 L795 Q800 N801 H802 L804 I805 I827 P830 I831 M834	Y794-L798 PolarHBondContact O-N 3.39Å; L795-L798 HydrophobicContact CD2-CD2 4.37Å; L798-Q800 VanDerWaalsContact C-N 3.26Å; L798-Q800 PolarHBondContact O-N 2.7Å; L798-N801 CarbonylContact O-C 3.43Å; L798-H802 PolarHBondContact O-CD2 2.99Å; L798-L804 HydrophobicContact CD1-CB 3.89Å; L798-I805 HydrophobicContact CD1-CB 4.05Å; L798-I805 HydrophobicContact CD1-CD1 4.13Å; L798-I805 HydrophobicContact CD2-CD1 3.94Å; L798-I827 HydrophobicContact CD2-CD1 3.82Å; L798-P830 HydrophobicContact CB-CB 4.43Å; L798-P830 HydrophobicContact CD2-CB 3.91Å; L798-I831 HydrophobicContact CD2-CD1 4.46Å; L798-M834 HydrophobicContact CD1-SD 4.29Å; L798-M834 HydrophobicContact CD2-SD 4.11Å; L798-M834 HydrophobicContact CG-SD 3.78Å
799	P	90.5	Very high	91.6	Very high	41 Å²	41	28.8 Å²	28.8	27%	0.266	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.5	174.4	-19.8	33.8	0	0	0	114.8	L795 L797 H802 P830	L795-P799 WeakPolarHBondContact O-CD 3.34Å; L797-P799 VanDerWaalsContact C-CD 3.49Å; P799-H802 PolarHBondContact O-NE2 3.33Å; P799-P830 HydrophobicContact CG-CB 4.41Å
800	Q	89.6	Confident	91.8	Very high	86 Å²	86	30 Å²	30	40%	0.402	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-35.1	178.6	-61.2	-174.7	6.1	0	0	111.7	Y740 L797 L798	Y740-Q800 HydrophobicContact CD1-CB 4.29Å; Y740-Q800 HydrophobicContact CE1-CB 4.01Å; L797-Q800 WeakPolarHBondContact O-CA 3.36Å; L797-Q800 WeakPolarHBondContact O-CB 3.22Å; L797-Q800 PolarHBondContact O-N 3.47Å; L798-Q800 VanDerWaalsContact C-N 3.26Å; L798-Q800 PolarHBondContact O-N 2.7Å
801	N	90.8	Very high	91.9	Very high	31 Å²	31	30.5 Å²	30.5	17%	0.166	15%	0.154	C	C	.	.			trans	-126.4	98.6	174.5	-176.7	-0.8	0	0	0	111.1	Y740 E750 L797 L798 K803 L804	Y740-N801 WeakPolarHBondContact OH-CB 3.35Å; Y740-N801 PolarHBondContact OH-ND2 2.71Å; E750-N801 PolarHBondContact OE1-ND2 3.45Å; L797-N801 PolarHBondContact O-N 3.03Å; L798-N801 CarbonylContact O-C 3.43Å; N801-K803 PolarHBondContact O-N 2.87Å; N801-K803 WeakPolarHBondContact OD1-CB 3.35Å; N801-K803 PolarHBondContact OD1-N 3.24Å; N801-K803 VanDerWaalsContact OD1-N 3.15Å; N801-L804 HydrophobicContact CB-CD1 4.19Å; N801-L804 HydrophobicContact CB-CG 4.32Å; N801-L804 PolarHBondContact O-N 3.37Å
802	H	93	Very high	92	Very high	46 Å²	46	30.7 Å²	30.7	21%	0.213	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.9	-175.7	-61.2	175.3	0	0	0	113.8	L798 P799 L804 I805 M834 S838 E840	L798-H802 PolarHBondContact O-CD2 2.99Å; P799-H802 PolarHBondContact O-NE2 3.33Å; H802-L804 PolarHBondContact O-N 3.14Å; H802-I805 WeakPolarHBondContact O-CG2 3.43Å; H802-I805 PolarHBondContact O-N 3.39Å; H802-M834 HydrophobicContact CB-CE 3.71Å; H802-M834 PolarHBondContact CE1-O 3.2Å; H802-M834 VanDerWaalsContact CE1-O 3.3Å; H802-M834 WeakPolarHBondContact NE2-CA 3.49Å; H802-S838 WeakPolarHBondContact ND1-CB 3.31Å; H802-S838 PolarHBondContact ND1-OG 3.3Å; H802-E840 HydrophobicContact CB-CB 3.97Å; H802-E840 HydrophobicContact CB-CG 4.05Å
803	K	91.8	Very high	92	Very high	135 Å²	135	30.3 Å²	30.3	59%	0.587	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.5	-179.2	-65	-178.4	176.2	-177.4	0	112.5	N801 I805 H806 E840	N801-K803 PolarHBondContact O-N 2.87Å; N801-K803 WeakPolarHBondContact OD1-CB 3.35Å; N801-K803 PolarHBondContact OD1-N 3.24Å; N801-K803 VanDerWaalsContact OD1-N 3.15Å; K803-I805 PolarHBondContact O-N 2.81Å; K803-I805 VanDerWaalsContact O-N 3.14Å; K803-H806 PolarHBondContact O-CD2 2.89Å; K803-H806 PolarHBondContact O-N 3.16Å; K803-E840 HydrophobicContact CG-CG 3.92Å
804	L	91.8	Very high	92	Very high	8 Å²	8	36.2 Å²	36.2	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-57.1	-30.5	179.6	-64.9	175.7	0	0	0	111.3	L754 Y794 L797 L798 N801 H802 H806 E807 L808	L754-L804 HydrophobicContact CD2-CD2 4.41Å; Y794-L804 HydrophobicContact CE2-CB 4.26Å; Y794-L804 HydrophobicContact CE2-CD2 4.38Å; Y794-L804 VanDerWaalsContact OH-C 3.28Å; Y794-L804 PolarHBondContact OH-O 2.8Å; L797-L804 HydrophobicContact CB-CD1 4.1Å; L798-L804 HydrophobicContact CD1-CB 3.89Å; N801-L804 HydrophobicContact CB-CD1 4.19Å; N801-L804 HydrophobicContact CB-CG 4.32Å; N801-L804 PolarHBondContact O-N 3.37Å; H802-L804 PolarHBondContact O-N 3.14Å; L804-H806 PolarHBondContact O-N 3.45Å; L804-E807 WeakPolarHBondContact O-CB 3.43Å; L804-E807 PolarHBondContact O-N 2.97Å; L804-L808 PolarHBondContact O-N 3.28Å
805	I	92.9	Very high	91.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-52.5	-30.8	-177.4	-161.8	69.5	0	0	0	114.4	L798 H802 K803 L808 A809 I831 M834 E840 L844	L798-I805 HydrophobicContact CD1-CB 4.05Å; L798-I805 HydrophobicContact CD1-CD1 4.13Å; L798-I805 HydrophobicContact CD2-CD1 3.94Å; H802-I805 WeakPolarHBondContact O-CG2 3.43Å; H802-I805 PolarHBondContact O-N 3.39Å; K803-I805 PolarHBondContact O-N 2.81Å; K803-I805 VanDerWaalsContact O-N 3.14Å; I805-L808 HydrophobicContact CD1-CD2 4.2Å; I805-L808 PolarHBondContact O-N 3.45Å; I805-A809 PolarHBondContact O-N 2.85Å; I805-I831 HydrophobicContact CD1-CD1 3.66Å; I805-M834 HydrophobicContact CB-CE 4.34Å; I805-E840 HydrophobicContact CG2-CB 4.46Å; I805-L844 HydrophobicContact CG1-CD2 3.65Å; I805-L844 HydrophobicContact CG2-CD2 4.43Å
806	H	92.9	Very high	91.8	Very high	54 Å²	54	38.7 Å²	38.7	25%	0.25	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-39	178.7	-59	-61.5	0	0	0	112.2	K803 L804 A809 A810 E840	K803-H806 PolarHBondContact O-CD2 2.89Å; K803-H806 PolarHBondContact O-N 3.16Å; L804-H806 PolarHBondContact O-N 3.45Å; H806-A809 WeakPolarHBondContact O-CB 3.34Å; H806-A809 PolarHBondContact O-N 3.29Å; H806-A810 PolarHBondContact O-N 2.75Å; H806-E840 IonicContact CD2-OE2 2.85Å; H806-E840 PolarHBondContact CE1-O 3.43Å; H806-E840 IonicContact CE1-OE2 2.69Å; H806-E840 IonicContact NE2-OE2 3.21Å; H806-E840 PolarHBondContact NE2-OE2 3.45Å
807	E	92.3	Very high	91.6	Very high	94 Å²	94	40.8 Å²	40.8	44%	0.439	22%	0.215	S	C	.	.	H	α-helix	trans	-66.4	-39.8	174.7	-63.5	-59.2	148.7	0	0	111	L754 L757 L804 A809 A810 V811	L754-E807 HydrophobicContact CD2-CB 3.9Å; L754-E807 HydrophobicContact CD2-CG 3.92Å; L757-E807 HydrophobicContact CD2-CB 4.48Å; L804-E807 WeakPolarHBondContact O-CB 3.43Å; L804-E807 PolarHBondContact O-N 2.97Å; E807-A809 VanDerWaalsContact C-N 3.3Å; E807-A809 PolarHBondContact O-N 3.43Å; E807-A810 PolarHBondContact O-N 2.92Å; E807-V811 WeakPolarHBondContact O-CG2 3.33Å; E807-V811 PolarHBondContact O-N 2.94Å
808	L	93.7	Very high	91.4	Very high	3 Å²	3	45 Å²	45	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-42.1	172.8	-177.2	65.1	0	0	0	111.3	L757 L791 Y794 L804 I805 Y812 V823 I827	L757-L808 HydrophobicContact CD1-CD1 3.72Å; L791-L808 HydrophobicContact CD2-CD1 4.37Å; Y794-L808 HydrophobicContact CE1-CB 3.85Å; Y794-L808 HydrophobicContact CE1-CD1 4.22Å; Y794-L808 HydrophobicContact CE1-CD2 4.41Å; Y794-L808 HydrophobicContact CE1-CG 4.38Å; Y794-L808 PolarHBondContact OH-N 3.3Å; Y794-L808 VanDerWaalsContact OH-N 3.14Å; L804-L808 PolarHBondContact O-N 3.28Å; I805-L808 HydrophobicContact CD1-CD2 4.2Å; I805-L808 PolarHBondContact O-N 3.45Å; L808-Y812 WeakPolarHBondContact O-CB 3.48Å; L808-Y812 PolarHBondContact O-N 3.49Å; L808-V823 HydrophobicContact CD1-CG1 4.39Å; L808-I827 HydrophobicContact CD2-CD1 3.45Å; L808-I827 VanDerWaalsContact CD2-CD1 3.45Å; L808-I827 HydrophobicContact CD2-CG1 4.35Å
809	A	92	Very high	91.4	Very high	1 Å²	1	45 Å²	45	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-40.5	177.9	0	0	0	0	0	111.6	I805 H806 E807 Y812 T813 L844 P849 L855	I805-A809 PolarHBondContact O-N 2.85Å; H806-A809 WeakPolarHBondContact O-CB 3.34Å; H806-A809 PolarHBondContact O-N 3.29Å; E807-A809 VanDerWaalsContact C-N 3.3Å; E807-A809 PolarHBondContact O-N 3.43Å; A809-Y812 PolarHBondContact O-N 3.32Å; A809-T813 WeakPolarHBondContact O-CG2 3.37Å; A809-T813 PolarHBondContact O-N 3.37Å; A809-T813 VanDerWaalsContact O-N 3.09Å; A809-L844 HydrophobicContact CB-CD1 3.63Å; A809-P849 HydrophobicContact CB-CG 3.95Å; A809-L855 HydrophobicContact CB-CD2 4.28Å
810	A	92	Very high	91.4	Very high	42 Å²	42	45.6 Å²	45.6	35%	0.347	24%	0.236	S	C	.	.	H	α-helix	trans	-60.4	-54.7	175	0	0	0	0	0	111.4	H806 E807 Y812 T813 E814	H806-A810 PolarHBondContact O-N 2.75Å; E807-A810 PolarHBondContact O-N 2.92Å; A810-Y812 VanDerWaalsContact C-N 3.28Å; A810-Y812 PolarHBondContact O-N 2.95Å; A810-T813 PolarHBondContact O-N 3.12Å; A810-T813 PolarHBondContact O-OG1 3.02Å; A810-E814 PolarHBondContact O-N 2.89Å
811	V	91.8	Very high	91.5	Very high	14 Å²	14	47.9 Å²	47.9	9%	0.085	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-37.7	177.9	173.2	0	0	0	0	111.4	L757 L760 V761 E807 T813 E814 A815	L757-V811 HydrophobicContact CD1-CG1 4.4Å; L757-V811 HydrophobicContact CD2-CB 4.23Å; L757-V811 HydrophobicContact CD2-CG2 3.85Å; L757-V811 HydrophobicContact CG-CB 4.21Å; L757-V811 HydrophobicContact CG-CG1 4.16Å; L757-V811 HydrophobicContact CG-CG2 4Å; L760-V811 HydrophobicContact CB-CG1 4.22Å; V761-V811 HydrophobicContact CG2-CG1 3.96Å; V761-V811 HydrophobicContact CG2-CG2 4.39Å; E807-V811 WeakPolarHBondContact O-CG2 3.33Å; E807-V811 PolarHBondContact O-N 2.94Å; V811-T813 VanDerWaalsContact C-N 3.28Å; V811-T813 PolarHBondContact O-N 3.19Å; V811-E814 PolarHBondContact O-N 3.14Å; V811-A815 WeakPolarHBondContact O-CB 3.46Å; V811-A815 PolarHBondContact O-N 3.18Å
812	Y	93.6	Very high	91.6	Very high	6 Å²	6	46.8 Å²	46.8	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-36.7	176.1	-178.8	-90.3	0	0	0	111.9	L808 A809 A810 E814 A815 K820 V823 L824 G851 A852 T854 L855	L808-Y812 WeakPolarHBondContact O-CB 3.48Å; L808-Y812 PolarHBondContact O-N 3.49Å; A809-Y812 PolarHBondContact O-N 3.32Å; A810-Y812 VanDerWaalsContact C-N 3.28Å; A810-Y812 PolarHBondContact O-N 2.95Å; Y812-E814 VanDerWaalsContact C-N 3.31Å; Y812-E814 PolarHBondContact O-N 2.87Å; Y812-A815 PolarHBondContact O-N 2.97Å; Y812-K820 HydrophobicContact CD2-CB 4.42Å; Y812-K820 HydrophobicContact CD2-CG 4Å; Y812-K820 HydrophobicContact CE1-CD 4.44Å; Y812-K820 HydrophobicContact CE1-CG 4.31Å; Y812-K820 HydrophobicContact CE2-CB 3.66Å; Y812-K820 HydrophobicContact CE2-CG 3.62Å; Y812-K820 WeakPolarHBondContact O-CE 3.45Å; Y812-K820 PolarHBondContact O-NZ 2.85Å; Y812-V823 HydrophobicContact CD2-CB 4.22Å; Y812-V823 HydrophobicContact CD2-CG1 3.96Å; Y812-V823 HydrophobicContact CE2-CB 4.38Å; Y812-V823 HydrophobicContact CE2-CG1 4.34Å; Y812-L824 HydrophobicContact CE2-CD2 4.32Å; Y812-L824 HydrophobicContact CE2-CG 4.22Å; Y812-G851 WeakPolarHBondContact CE1-O 3.24Å; Y812-A852 HydrophobicContact CD1-CB 4.39Å; Y812-T854 PolarHBondContact OH-OG1 3.44Å; Y812-L855 HydrophobicContact CD1-CB 4.01Å; Y812-L855 HydrophobicContact CD1-CD2 4.28Å; Y812-L855 HydrophobicContact CD2-CD1 4.48Å; Y812-L855 HydrophobicContact CD2-CD2 4.42Å; Y812-L855 HydrophobicContact CE1-CB 3.88Å; Y812-L855 HydrophobicContact CE2-CB 4.38Å; Y812-L855 HydrophobicContact CG-CB 4.33Å; Y812-L855 HydrophobicContact CG-CD2 4Å
813	T	92.3	Very high	91.6	Very high	40 Å²	40	44.8 Å²	44.8	25%	0.245	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-38.7	178.2	58.9	0	0	0	0	112.3	A809 A810 V811 K820 P849 K850 A852	A809-T813 WeakPolarHBondContact O-CG2 3.37Å; A809-T813 PolarHBondContact O-N 3.37Å; A809-T813 VanDerWaalsContact O-N 3.09Å; A810-T813 PolarHBondContact O-N 3.12Å; A810-T813 PolarHBondContact O-OG1 3.02Å; V811-T813 VanDerWaalsContact C-N 3.28Å; V811-T813 PolarHBondContact O-N 3.19Å; T813-K820 PolarHBondContact O-NZ 2.99Å; T813-P849 HydrophobicContact CG2-CB 4.2Å; T813-P849 HydrophobicContact CG2-CG 4.45Å; T813-K850 VanDerWaalsContact CG2-O 3.29Å; T813-K850 WeakPolarHBondContact CG2-O 3.2Å; T813-A852 HydrophobicContact CG2-CB 4.06Å
814	E	90.8	Very high	91.6	Very high	131 Å²	131	40.2 Å²	40.2	61%	0.612	21%	0.209	S	C	*	.	H	α-helix	trans	-83	-20.6	-177.8	-60.9	-175.1	-174.9	0	0	113.4	V761 A810 V811 Y812	V761-E814 HydrophobicContact CG1-CB 4.23Å; V761-E814 HydrophobicContact CG2-CB 4.49Å; A810-E814 PolarHBondContact O-N 2.89Å; V811-E814 PolarHBondContact O-N 3.14Å; Y812-E814 VanDerWaalsContact C-N 3.31Å; Y812-E814 PolarHBondContact O-N 2.87Å
815	A	90.4	Very high	91.6	Very high	6 Å²	6	46.7 Å²	46.7	5%	0.05	23%	0.232	C	C	.	.	S	Bend	trans	-67	151.8	-177	0	0	0	0	0	114.5	V811 Y812 I819 K820	V811-A815 WeakPolarHBondContact O-CB 3.46Å; V811-A815 PolarHBondContact O-N 3.18Å; Y812-A815 PolarHBondContact O-N 2.97Å; A815-I819 HydrophobicContact CB-CB 4.13Å; A815-I819 HydrophobicContact CB-CG2 3.86Å; A815-K820 HydrophobicContact CB-CG 4.28Å; A815-K820 WeakPolarHBondContact O-CE 3.17Å; A815-K820 PolarHBondContact O-NZ 3.39Å
816	I	90.1	Very high	91.5	Very high	65 Å²	65	48.5 Å²	48.5	33%	0.333	24%	0.244	S	C	.	.			trans	-70.9	163.2	173.8	63.4	167.9	0	0	0	112.4	W782 D818 I819 K820	W782-I816 HydrophobicContact CG-CD1 4.41Å; I816-D818 VanDerWaalsContact C-N 3.33Å; I816-D818 PolarHBondContact O-N 3.34Å; I816-I819 HydrophobicContact CD1-CD1 4.17Å; I816-I819 HydrophobicContact CD1-CG1 4.15Å; I816-I819 HydrophobicContact CG1-CB 4.14Å; I816-I819 HydrophobicContact CG1-CD1 3.58Å; I816-I819 HydrophobicContact CG1-CG1 3.59Å; I816-I819 PolarHBondContact O-N 2.85Å; I816-K820 WeakPolarHBondContact O-CG 3.47Å; I816-K820 PolarHBondContact O-N 3.17Å
817	A	88.4	Confident	91.5	Very high	53 Å²	53	46 Å²	46	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-37.2	-173	0	0	0	0	0	114.2	K820 R821	A817-K820 PolarHBondContact O-N 3.49Å; A817-R821 WeakPolarHBondContact O-CG 3.49Å; A817-R821 PolarHBondContact O-N 3.47Å
818	D	87.4	Confident	91.4	Very high	88 Å²	88	43.9 Å²	43.9	47%	0.471	22%	0.222	S	C	.	.	H	α-helix	trans	-70.7	-37	-179.4	-64.8	-41	0	0	0	112.7	I816 R821 T822	I816-D818 VanDerWaalsContact C-N 3.33Å; I816-D818 PolarHBondContact O-N 3.34Å; D818-R821 PolarHBondContact O-N 3.41Å; D818-R821 IonicContact OD1-CZ 2.82Å; D818-R821 IonicContact OD1-NH1 3.28Å; D818-R821 PolarHBondContact OD1-NH1 3.26Å; D818-T822 PolarHBondContact O-N 3.32Å; D818-T822 VanDerWaalsContact O-N 3.13Å; D818-T822 PolarHBondContact O-OG1 3.31Å
819	I	90.8	Very high	91.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-48.1	172.1	-61.7	177.6	0	0	0	109.5	L760 W782 V787 A815 I816 R821 T822 V823	L760-I819 HydrophobicContact CB-CD1 4.16Å; L760-I819 HydrophobicContact CB-CG2 4.16Å; L760-I819 HydrophobicContact CD1-CG2 4.21Å; L760-I819 HydrophobicContact CD2-CD1 4.25Å; L760-I819 HydrophobicContact CD2-CG2 4.27Å; L760-I819 HydrophobicContact CG-CG2 4.47Å; L760-I819 WeakPolarHBondContact O-CD1 3.37Å; W782-I819 HydrophobicContact CB-CG1 4.47Å; W782-I819 HydrophobicContact CD2-CD1 4.12Å; W782-I819 HydrophobicContact CD2-CG1 4.48Å; W782-I819 HydrophobicContact CG-CD1 4.07Å; W782-I819 HydrophobicContact CG-CG1 4.19Å; V787-I819 HydrophobicContact CG1-CG2 4.05Å; V787-I819 HydrophobicContact CG2-CG1 3.86Å; A815-I819 HydrophobicContact CB-CB 4.13Å; A815-I819 HydrophobicContact CB-CG2 3.86Å; I816-I819 HydrophobicContact CD1-CD1 4.17Å; I816-I819 HydrophobicContact CD1-CG1 4.15Å; I816-I819 HydrophobicContact CG1-CB 4.14Å; I816-I819 HydrophobicContact CG1-CD1 3.58Å; I816-I819 HydrophobicContact CG1-CG1 3.59Å; I816-I819 PolarHBondContact O-N 2.85Å; I819-R821 VanDerWaalsContact C-N 3.31Å; I819-R821 PolarHBondContact O-N 3.33Å; I819-T822 PolarHBondContact O-N 3.04Å; I819-V823 HydrophobicContact CG2-CG2 4.19Å; I819-V823 WeakPolarHBondContact O-CG2 3.41Å; I819-V823 PolarHBondContact O-N 3.46Å
820	K	91.6	Very high	91.1	Very high	53 Å²	53	52.2 Å²	52.2	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-53.7	-47	176.9	-73.4	173.6	166.3	149.8	0	111.8	Y812 T813 A815 I816 A817 T822 V823 L824	Y812-K820 HydrophobicContact CD2-CB 4.42Å; Y812-K820 HydrophobicContact CD2-CG 4Å; Y812-K820 HydrophobicContact CE1-CD 4.44Å; Y812-K820 HydrophobicContact CE1-CG 4.31Å; Y812-K820 HydrophobicContact CE2-CB 3.66Å; Y812-K820 HydrophobicContact CE2-CG 3.62Å; Y812-K820 WeakPolarHBondContact O-CE 3.45Å; Y812-K820 PolarHBondContact O-NZ 2.85Å; T813-K820 PolarHBondContact O-NZ 2.99Å; A815-K820 HydrophobicContact CB-CG 4.28Å; A815-K820 WeakPolarHBondContact O-CE 3.17Å; A815-K820 PolarHBondContact O-NZ 3.39Å; I816-K820 WeakPolarHBondContact O-CG 3.47Å; I816-K820 PolarHBondContact O-N 3.17Å; A817-K820 PolarHBondContact O-N 3.49Å; K820-T822 VanDerWaalsContact C-N 3.33Å; K820-T822 PolarHBondContact O-N 3.43Å; K820-V823 PolarHBondContact O-N 2.98Å; K820-L824 VanDerWaalsContact O-CG 3.29Å; K820-L824 WeakPolarHBondContact O-CG 3.48Å; K820-L824 PolarHBondContact O-N 2.98Å
821	R	91.6	Very high	91.1	Very high	134 Å²	134	50.2 Å²	50.2	51%	0.506	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-43.2	176.7	-73.1	173.3	-171.4	118.1	2.7	112.2	A817 D818 I819 R825	A817-R821 WeakPolarHBondContact O-CG 3.49Å; A817-R821 PolarHBondContact O-N 3.47Å; D818-R821 PolarHBondContact O-N 3.41Å; D818-R821 IonicContact OD1-CZ 2.82Å; D818-R821 IonicContact OD1-NH1 3.28Å; D818-R821 PolarHBondContact OD1-NH1 3.26Å; I819-R821 VanDerWaalsContact C-N 3.31Å; I819-R821 PolarHBondContact O-N 3.33Å; R821-R825 WeakPolarHBondContact O-CG 3.44Å; R821-R825 PolarHBondContact O-N 3Å
822	T	91.8	Very high	90.9	Very high	8 Å²	8	53.7 Å²	53.7	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-66.8	-47.2	179.6	-56.2	0	0	0	0	111.1	E784 V787 K788 D818 I819 K820 L824 R825 V826	E784-T822 HydrophobicContact CG-CG2 3.9Å; V787-T822 HydrophobicContact CB-CG2 4.03Å; V787-T822 HydrophobicContact CG1-CG2 3.72Å; K788-T822 HydrophobicContact CG-CG2 4.11Å; D818-T822 PolarHBondContact O-N 3.32Å; D818-T822 VanDerWaalsContact O-N 3.13Å; D818-T822 PolarHBondContact O-OG1 3.31Å; I819-T822 PolarHBondContact O-N 3.04Å; K820-T822 VanDerWaalsContact C-N 3.33Å; K820-T822 PolarHBondContact O-N 3.43Å; T822-L824 VanDerWaalsContact C-N 3.32Å; T822-L824 PolarHBondContact O-N 2.83Å; T822-R825 WeakPolarHBondContact O-CB 3.39Å; T822-R825 PolarHBondContact O-N 3.16Å; T822-V826 WeakPolarHBondContact O-CG2 3.49Å; T822-V826 PolarHBondContact O-N 3.13Å
823	V	93.2	Very high	90.5	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-53.6	-48.3	175.9	173.1	0	0	0	0	110.9	L791 L808 Y812 I819 K820 R825 V826 I827 L855	L791-V823 HydrophobicContact CD1-CG2 3.74Å; L808-V823 HydrophobicContact CD1-CG1 4.39Å; Y812-V823 HydrophobicContact CD2-CB 4.22Å; Y812-V823 HydrophobicContact CD2-CG1 3.96Å; Y812-V823 HydrophobicContact CE2-CB 4.38Å; Y812-V823 HydrophobicContact CE2-CG1 4.34Å; I819-V823 HydrophobicContact CG2-CG2 4.19Å; I819-V823 WeakPolarHBondContact O-CG2 3.41Å; I819-V823 PolarHBondContact O-N 3.46Å; K820-V823 PolarHBondContact O-N 2.98Å; V823-R825 PolarHBondContact O-N 3.33Å; V823-V826 WeakPolarHBondContact O-CG2 3.23Å; V823-V826 PolarHBondContact O-N 2.72Å; V823-I827 VanDerWaalsContact O-CB 3.29Å; V823-I827 WeakPolarHBondContact O-CB 3.31Å; V823-I827 WeakPolarHBondContact O-CG2 3.33Å; V823-I827 PolarHBondContact O-N 3.31Å; V823-L855 HydrophobicContact CG1-CD1 4.16Å
824	L	92.2	Very high	90.3	Very high	39 Å²	39	54.5 Å²	54.5	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-26.9	179.9	-68.6	175.3	0	0	0	114	Y812 K820 T822 L855 R858	Y812-L824 HydrophobicContact CE2-CD2 4.32Å; Y812-L824 HydrophobicContact CE2-CG 4.22Å; K820-L824 VanDerWaalsContact O-CG 3.29Å; K820-L824 WeakPolarHBondContact O-CG 3.48Å; K820-L824 PolarHBondContact O-N 2.98Å; T822-L824 VanDerWaalsContact C-N 3.32Å; T822-L824 PolarHBondContact O-N 2.83Å; L824-L855 HydrophobicContact CD2-CB 4.39Å; L824-L855 HydrophobicContact CD2-CD1 4.15Å; L824-R858 HydrophobicContact CD2-CB 3.76Å; L824-R858 HydrophobicContact CD2-CG 4.14Å; L824-R858 PolarHBondContact O-NE 2.9Å
825	R	91.5	Very high	90	Very high	143 Å²	143	49.5 Å²	49.5	54%	0.54	26%	0.256	S	S	.	.	H	α-helix	trans	-77.7	-38	176.6	-69.4	177.3	-169	167.6	4	112.4	E784 R821 T822 V823	E784-R825 VanDerWaalsContact CD-NH1 3.31Å; E784-R825 IonicContact OE1-NH1 2.73Å; E784-R825 PolarHBondContact OE1-NH1 3.34Å; E784-R825 IonicContact OE2-NH1 3.51Å; E784-R825 PolarHBondContact OE2-NH1 3.32Å; R821-R825 WeakPolarHBondContact O-CG 3.44Å; R821-R825 PolarHBondContact O-N 3Å; T822-R825 WeakPolarHBondContact O-CB 3.39Å; T822-R825 PolarHBondContact O-N 3.16Å; V823-R825 PolarHBondContact O-N 3.33Å
826	V	91.7	Very high	89.6	Confident	39 Å²	39	50.2 Å²	50.2	24%	0.236	26%	0.258	C	S	.	.	H	α-helix	trans	-91.7	-18.4	-172.7	-61.6	0	0	0	0	114	K788 L791 L795 T822 V823 E828 P830	K788-V826 HydrophobicContact CG-CG1 4.21Å; L791-V826 HydrophobicContact CD1-CG2 4.08Å; L795-V826 HydrophobicContact CD1-CB 3.84Å; L795-V826 HydrophobicContact CD1-CG2 3.4Å; T822-V826 WeakPolarHBondContact O-CG2 3.49Å; T822-V826 PolarHBondContact O-N 3.13Å; V823-V826 WeakPolarHBondContact O-CG2 3.23Å; V823-V826 PolarHBondContact O-N 2.72Å; V826-E828 VanDerWaalsContact C-N 3.31Å; V826-E828 PolarHBondContact O-N 3.07Å; V826-P830 VanDerWaalsContact O-CD 3.28Å; V826-P830 WeakPolarHBondContact O-CD 3.27Å
827	I	92.3	Very high	89.2	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-72.3	-18.4	-174.1	-161.3	55.8	0	0	0	114.3	L795 L798 L808 V823 Q829 P830 I831 L855 R858	L795-I827 HydrophobicContact CD2-CD1 3.61Å; L798-I827 HydrophobicContact CD2-CD1 3.82Å; L808-I827 HydrophobicContact CD2-CD1 3.45Å; L808-I827 VanDerWaalsContact CD2-CD1 3.45Å; L808-I827 HydrophobicContact CD2-CG1 4.35Å; V823-I827 VanDerWaalsContact O-CB 3.29Å; V823-I827 WeakPolarHBondContact O-CB 3.31Å; V823-I827 WeakPolarHBondContact O-CG2 3.33Å; V823-I827 PolarHBondContact O-N 3.31Å; I827-Q829 PolarHBondContact O-N 3.47Å; I827-P830 WeakPolarHBondContact O-CD 3.27Å; I827-I831 HydrophobicContact CD1-CD1 4.37Å; I827-I831 HydrophobicContact CD1-CG1 4.11Å; I827-I831 HydrophobicContact CG1-CD1 4.25Å; I827-I831 HydrophobicContact CG1-CG1 3.7Å; I827-I831 WeakPolarHBondContact O-CB 3.5Å; I827-I831 WeakPolarHBondContact O-CG1 3.46Å; I827-I831 PolarHBondContact O-N 3.37Å; I827-I831 VanDerWaalsContact O-N 3.17Å; I827-L855 HydrophobicContact CG1-CD1 4.26Å; I827-L855 HydrophobicContact CG2-CD1 4.46Å; I827-R858 HydrophobicContact CG2-CG 3.98Å
828	E	89.4	Confident	89.3	Confident	51 Å²	51	50.6 Å²	50.6	24%	0.238	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-49.3	-173.5	178.5	179.9	155.4	0	0	113.3	V826 R832 R858	V826-E828 VanDerWaalsContact C-N 3.31Å; V826-E828 PolarHBondContact O-N 3.07Å; E828-R832 WeakPolarHBondContact O-CG 3.46Å; E828-R832 PolarHBondContact O-N 3.16Å; E828-R832 IonicContact OE1-CZ 3.63Å; E828-R832 IonicContact OE1-NH1 2.81Å; E828-R832 PolarHBondContact OE1-NH1 3.34Å; E828-R832 IonicContact OE1-NH2 3.72Å; E828-R832 PolarHBondContact OE1-NH2 2.83Å; E828-R858 IonicContact OE2-CZ 3.56Å; E828-R858 IonicContact OE2-NH2 2.73Å; E828-R858 PolarHBondContact OE2-NH2 2.92Å
829	Q	89.3	Confident	89.3	Confident	166 Å²	166	50.8 Å²	50.8	78%	0.776	26%	0.26	S	S	*	.	H	α-helix	trans	-68	-46.7	-176.9	177.3	-174.7	4.3	0	0	112.6	I827 I831 R832 G833	I827-Q829 PolarHBondContact O-N 3.47Å; Q829-I831 PolarHBondContact O-N 2.92Å; Q829-R832 PolarHBondContact O-N 3.5Å; Q829-G833 PolarHBondContact O-N 2.92Å
830	P	91.2	Very high	89.3	Confident	12 Å²	12	52.9 Å²	52.9	8%	0.078	27%	0.269	C	S	.	.	H	α-helix	trans	-57.3	-43.6	174.2	-28	35.2	0	0	0	114	L795 L798 P799 V826 I827 R832 G833 M834	L795-P830 HydrophobicContact CB-CG 3.8Å; L795-P830 HydrophobicContact CD2-CG 4.15Å; L795-P830 HydrophobicContact CG-CG 4.38Å; L798-P830 HydrophobicContact CB-CB 4.43Å; L798-P830 HydrophobicContact CD2-CB 3.91Å; P799-P830 HydrophobicContact CG-CB 4.41Å; V826-P830 VanDerWaalsContact O-CD 3.28Å; V826-P830 WeakPolarHBondContact O-CD 3.27Å; I827-P830 WeakPolarHBondContact O-CD 3.27Å; P830-R832 PolarHBondContact O-N 3.41Å; P830-G833 WeakPolarHBondContact O-CA 3.42Å; P830-G833 PolarHBondContact O-N 3.48Å; P830-M834 PolarHBondContact O-N 3.48Å
831	I	91.2	Very high	89.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-40.3	-179.3	-68.7	-68.2	0	0	0	111.6	L798 I805 I827 Q829 G833 M834 G835 L841 C859 L863	L798-I831 HydrophobicContact CD2-CD1 4.46Å; I805-I831 HydrophobicContact CD1-CD1 3.66Å; I827-I831 HydrophobicContact CD1-CD1 4.37Å; I827-I831 HydrophobicContact CD1-CG1 4.11Å; I827-I831 HydrophobicContact CG1-CD1 4.25Å; I827-I831 HydrophobicContact CG1-CG1 3.7Å; I827-I831 WeakPolarHBondContact O-CB 3.5Å; I827-I831 WeakPolarHBondContact O-CG1 3.46Å; I827-I831 PolarHBondContact O-N 3.37Å; I827-I831 VanDerWaalsContact O-N 3.17Å; Q829-I831 PolarHBondContact O-N 2.92Å; I831-G833 PolarHBondContact O-N 3.38Å; I831-M834 HydrophobicContact CD1-SD 3.8Å; I831-M834 PolarHBondContact O-N 3.37Å; I831-M834 VanDerWaalsContact O-N 3.15Å; I831-G835 PolarHBondContact O-N 2.89Å; I831-L841 HydrophobicContact CD1-CD1 4.2Å; I831-C859 HydrophobicContact CD1-CB 4.37Å; I831-C859 VanDerWaalsContact CD1-SG 3.6Å; I831-C859 HydrophobicContact CG1-CB 4.46Å; I831-C859 HydrophobicContact CG2-CB 4.17Å; I831-L863 HydrophobicContact CG2-CD1 3.89Å; I831-L863 HydrophobicContact CG2-CD2 3.73Å; I831-L863 HydrophobicContact CG2-CG 3.6Å
832	R	88.8	Confident	89	Confident	88 Å²	88	44.3 Å²	44.3	33%	0.332	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-33.9	172.9	-74.7	-177.5	179.9	143.1	1.4	112.1	E828 Q829 P830 G835 S862 D865	E828-R832 WeakPolarHBondContact O-CG 3.46Å; E828-R832 PolarHBondContact O-N 3.16Å; E828-R832 IonicContact OE1-CZ 3.63Å; E828-R832 IonicContact OE1-NH1 2.81Å; E828-R832 PolarHBondContact OE1-NH1 3.34Å; E828-R832 IonicContact OE1-NH2 3.72Å; E828-R832 PolarHBondContact OE1-NH2 2.83Å; Q829-R832 PolarHBondContact O-N 3.5Å; P830-R832 PolarHBondContact O-N 3.41Å; R832-G835 PolarHBondContact O-N 2.87Å; R832-S862 WeakPolarHBondContact CG-O 3.21Å; R832-S862 PolarHBondContact NE-O 3.23Å; R832-D865 IonicContact NH2-OD2 3.99Å; R832-D865 PolarHBondContact NH2-OD2 3.15Å
833	G	85.6	Confident	89	Confident	50 Å²	50	47.3 Å²	47.3	52%	0.515	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-31.5	174.9	0	0	0	0	0	114.3	Q829 P830 I831	Q829-G833 PolarHBondContact O-N 2.92Å; P830-G833 WeakPolarHBondContact O-CA 3.42Å; P830-G833 PolarHBondContact O-N 3.48Å; I831-G833 PolarHBondContact O-N 3.38Å
834	M	87.4	Confident	88.8	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.059	25%	0.251	C	S	.	.	H	α-helix	trans	-72.3	-31.1	177.1	-62.8	171.6	64.1	0	0	113	L798 H802 I805 P830 I831 L841	L798-M834 HydrophobicContact CD1-SD 4.29Å; L798-M834 HydrophobicContact CD2-SD 4.11Å; L798-M834 HydrophobicContact CG-SD 3.78Å; H802-M834 HydrophobicContact CB-CE 3.71Å; H802-M834 PolarHBondContact CE1-O 3.2Å; H802-M834 VanDerWaalsContact CE1-O 3.3Å; H802-M834 WeakPolarHBondContact NE2-CA 3.49Å; I805-M834 HydrophobicContact CB-CE 4.34Å; P830-M834 PolarHBondContact O-N 3.48Å; I831-M834 HydrophobicContact CD1-SD 3.8Å; I831-M834 PolarHBondContact O-N 3.37Å; I831-M834 VanDerWaalsContact O-N 3.15Å; M834-L841 HydrophobicContact CE-CB 4.28Å; M834-L841 HydrophobicContact CE-CD1 4.45Å
835	G	83.8	Confident	88.6	Confident	27 Å²	27	45.6 Å²	45.6	28%	0.278	24%	0.243	S	C	.	.			trans	76.9	162.4	-176.9	0	0	0	0	0	114.6	I831 R832 N837	I831-G835 PolarHBondContact O-N 2.89Å; R832-G835 PolarHBondContact O-N 2.87Å; G835-N837 VanDerWaalsContact C-N 3.29Å; G835-N837 PolarHBondContact O-N 3.26Å
836	M	82.9	Confident	88.3	Confident	21 Å²	21	42.2 Å²	42.2	10%	0.103	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.2	-171.5	-46.6	-179	71.6	0	0	114	L863 T864 V867 P869 L873	M836-L863 HydrophobicContact CE-CB 4.11Å; M836-L863 HydrophobicContact CG-CB 4.03Å; M836-L863 HydrophobicContact CG-CD2 3.98Å; M836-L863 HydrophobicContact CG-CG 4.48Å; M836-T864 HydrophobicContact CE-CG2 3.62Å; M836-V867 HydrophobicContact SD-CB 4.12Å; M836-V867 HydrophobicContact SD-CG1 3.92Å; M836-P869 HydrophobicContact CE-CB 4.46Å; M836-L873 HydrophobicContact CE-CD2 3.83Å
837	N	82.1	Confident	88.1	Confident	122 Å²	122	45 Å²	45	65%	0.652	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	9	-177.1	-60.1	-21.3	0	0	0	112.4	G835	G835-N837 VanDerWaalsContact C-N 3.29Å; G835-N837 PolarHBondContact O-N 3.26Å
838	S	88.7	Confident	87.8	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.028	25%	0.247	C	C	.	.			trans	-65.7	123.2	178.2	172.3	0	0	0	0	110.7	H802 E840 L841 L842	H802-S838 WeakPolarHBondContact ND1-CB 3.31Å; H802-S838 PolarHBondContact ND1-OG 3.3Å; S838-E840 VanDerWaalsContact C-N 3.32Å; S838-E840 PolarHBondContact O-N 3.4Å; S838-L841 PolarHBondContact O-N 3.1Å; S838-L842 WeakPolarHBondContact O-CG 3.42Å; S838-L842 PolarHBondContact O-N 3.27Å; S838-L842 VanDerWaalsContact O-N 3.12Å
839	P	88.6	Confident	87.7	Confident	92 Å²	92	44.6 Å²	44.6	60%	0.597	25%	0.248	S	C	*	.	H	α-helix	trans	-65.4	-35.8	-177.8	25.7	-33.8	0	0	0	112.4	L842 L843	P839-L842 PolarHBondContact O-N 3.06Å; P839-L843 WeakPolarHBondContact O-CB 3.19Å; P839-L843 PolarHBondContact O-N 2.81Å
840	E	90.9	Very high	87.3	Confident	44 Å²	44	44.8 Å²	44.8	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-69.2	-35.5	179.5	-61.9	-61.4	166.8	0	0	112.1	H802 K803 I805 H806 S838 L843 L844	H802-E840 HydrophobicContact CB-CB 3.97Å; H802-E840 HydrophobicContact CB-CG 4.05Å; K803-E840 HydrophobicContact CG-CG 3.92Å; I805-E840 HydrophobicContact CG2-CB 4.46Å; H806-E840 IonicContact CD2-OE2 2.85Å; H806-E840 PolarHBondContact CE1-O 3.43Å; H806-E840 IonicContact CE1-OE2 2.69Å; H806-E840 IonicContact NE2-OE2 3.21Å; H806-E840 PolarHBondContact NE2-OE2 3.45Å; S838-E840 VanDerWaalsContact C-N 3.32Å; S838-E840 PolarHBondContact O-N 3.4Å; E840-L843 WeakPolarHBondContact O-CB 3.47Å; E840-L843 PolarHBondContact O-N 2.91Å; E840-L844 PolarHBondContact O-N 3.17Å
841	L	89.3	Confident	87	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-69	-41.1	175	-173.8	79.1	0	0	0	111.2	I831 M834 S838 L843 L844 V845 L863	I831-L841 HydrophobicContact CD1-CD1 4.2Å; M834-L841 HydrophobicContact CE-CB 4.28Å; M834-L841 HydrophobicContact CE-CD1 4.45Å; S838-L841 PolarHBondContact O-N 3.1Å; L841-L843 VanDerWaalsContact C-N 3.29Å; L841-L843 PolarHBondContact O-N 3.32Å; L841-L844 WeakPolarHBondContact O-CB 3.36Å; L841-L844 PolarHBondContact O-N 3.07Å; L841-V845 WeakPolarHBondContact O-CG2 3.38Å; L841-V845 PolarHBondContact O-N 3.21Å; L841-L863 HydrophobicContact CD2-CD1 3.26Å
842	L	88.4	Confident	86.9	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-38.1	173.8	-67.4	173.8	0	0	0	111.4	S838 P839 V845 E846 E872 L873 R876	S838-L842 WeakPolarHBondContact O-CG 3.42Å; S838-L842 PolarHBondContact O-N 3.27Å; S838-L842 VanDerWaalsContact O-N 3.12Å; P839-L842 PolarHBondContact O-N 3.06Å; L842-V845 PolarHBondContact O-N 3.21Å; L842-E846 PolarHBondContact O-N 2.93Å; L842-E872 HydrophobicContact CD1-CB 4.4Å; L842-L873 HydrophobicContact CD2-CB 4.11Å; L842-L873 HydrophobicContact CD2-CD1 3.7Å; L842-R876 HydrophobicContact CD2-CG 4.42Å
843	L	89.9	Confident	86.8	Confident	70 Å²	70	43.9 Å²	43.9	37%	0.366	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-41	173.9	-170.7	75.4	0	0	0	111.6	P839 E840 L841 V845 E846 N847	P839-L843 WeakPolarHBondContact O-CB 3.19Å; P839-L843 PolarHBondContact O-N 2.81Å; E840-L843 WeakPolarHBondContact O-CB 3.47Å; E840-L843 PolarHBondContact O-N 2.91Å; L841-L843 VanDerWaalsContact C-N 3.29Å; L841-L843 PolarHBondContact O-N 3.32Å; L843-V845 VanDerWaalsContact C-N 3.34Å; L843-V845 PolarHBondContact O-N 2.66Å; L843-E846 PolarHBondContact O-N 3.44Å; L843-N847 WeakPolarHBondContact O-CB 3.45Å; L843-N847 PolarHBondContact O-N 3.45Å
844	L	89.1	Confident	86.9	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-39.5	175.6	-179.7	69.8	0	0	0	112	I805 A809 E840 L841 N847 C848 V856	I805-L844 HydrophobicContact CG1-CD2 3.65Å; I805-L844 HydrophobicContact CG2-CD2 4.43Å; A809-L844 HydrophobicContact CB-CD1 3.63Å; E840-L844 PolarHBondContact O-N 3.17Å; L841-L844 WeakPolarHBondContact O-CB 3.36Å; L841-L844 PolarHBondContact O-N 3.07Å; L844-N847 CarbonylContact O-C 3.41Å; L844-C848 WeakPolarHBondContact O-CA 3.44Å; L844-C848 PolarHBondContact O-N 3.33Å; L844-V856 HydrophobicContact CD2-CG2 4.4Å; L844-V856 HydrophobicContact CG-CG2 4.27Å
845	V	87.9	Confident	87	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-42.7	176	174.5	0	0	0	0	110.6	L841 L842 L843 V856 L860 L873 R876 V877 L880	L841-V845 WeakPolarHBondContact O-CG2 3.38Å; L841-V845 PolarHBondContact O-N 3.21Å; L842-V845 PolarHBondContact O-N 3.21Å; L843-V845 VanDerWaalsContact C-N 3.34Å; L843-V845 PolarHBondContact O-N 2.66Å; V845-V856 HydrophobicContact CG2-CG1 4.08Å; V845-L860 HydrophobicContact CG2-CD2 4.21Å; V845-L873 HydrophobicContact CG2-CD1 4.45Å; V845-R876 HydrophobicContact CG1-CB 4.12Å; V845-V877 HydrophobicContact CG1-CG2 3.8Å; V845-L880 HydrophobicContact CG1-CD2 4.38Å; V845-L880 WeakPolarHBondContact O-CD2 3.45Å
846	E	86.8	Confident	87.3	Confident	73 Å²	73	43.4 Å²	43.4	34%	0.341	24%	0.236	S	C	.	.	H	α-helix	trans	-65.9	-44.9	177.9	-174.5	170.2	-167.4	0	0	112.2	L842 L843 R876	L842-E846 PolarHBondContact O-N 2.93Å; L843-E846 PolarHBondContact O-N 3.44Å; E846-R876 IonicContact OE2-CZ 3.74Å; E846-R876 IonicContact OE2-NE 3.54Å; E846-R876 IonicContact OE2-NH1 3.78Å; E846-R876 PolarHBondContact OE2-NH1 3.46Å
847	N	86.4	Confident	87.5	Confident	98 Å²	98	43.8 Å²	43.8	52%	0.524	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	44.7	-175.7	-66.7	-36.3	0	0	0	112.5	L843 L844 P849	L843-N847 WeakPolarHBondContact O-CB 3.45Å; L843-N847 PolarHBondContact O-N 3.45Å; L844-N847 CarbonylContact O-C 3.41Å; N847-P849 WeakPolarHBondContact O-CD 3.42Å; N847-P849 VanDerWaalsContact O-N 3.16Å
848	C	86.1	Confident	87.9	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.007	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-56.7	117.2	-176.3	179.1	0	0	0	0	112.3	L844 V856 L880 R884	L844-C848 WeakPolarHBondContact O-CA 3.44Å; L844-C848 PolarHBondContact O-N 3.33Å; C848-V856 HydrophobicContact CB-CG2 4.43Å; C848-L880 HydrophobicContact CB-CD1 4.04Å; C848-L880 HydrophobicContact CB-CD2 4.4Å; C848-R884 PolarHBondContact O-NH1 2.97Å; C848-R884 PolarHBondContact O-NH2 3.49Å
849	P	86.6	Confident	87.9	Confident	41 Å²	41	42.3 Å²	42.3	27%	0.266	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-63.9	148.9	176.9	20.6	-25.2	0	0	0	111.3	A809 T813 N847 G851 A852	A809-P849 HydrophobicContact CB-CG 3.95Å; T813-P849 HydrophobicContact CG2-CB 4.2Å; T813-P849 HydrophobicContact CG2-CG 4.45Å; N847-P849 WeakPolarHBondContact O-CD 3.42Å; N847-P849 VanDerWaalsContact O-N 3.16Å; P849-G851 PolarHBondContact O-N 3.11Å; P849-A852 HydrophobicContact CG-CB 3.7Å; P849-A852 PolarHBondContact O-N 3.35Å; P849-A852 VanDerWaalsContact O-N 3.16Å
850	K	82.7	Confident	87.9	Confident	169 Å²	169	38 Å²	38	74%	0.735	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	125.8	179.9	-63.7	-174.9	-179.5	175.9	0	108.6	T813 R884	T813-K850 VanDerWaalsContact CG2-O 3.29Å; T813-K850 WeakPolarHBondContact CG2-O 3.2Å; K850-R884 VanDerWaalsContact CG-NH2 3.34Å
851	G	83.8	Confident	87.7	Confident	33 Å²	33	37.9 Å²	37.9	34%	0.34	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.5	-10	-175.5	0	0	0	0	0	114.8	Y812 P849 E853	Y812-G851 WeakPolarHBondContact CE1-O 3.24Å; P849-G851 PolarHBondContact O-N 3.11Å; G851-E853 WeakPolarHBondContact CA-OE2 3.27Å; G851-E853 VanDerWaalsContact N-CD 3.34Å; G851-E853 PolarHBondContact N-OE1 3.43Å; G851-E853 VanDerWaalsContact N-OE1 3.1Å; G851-E853 PolarHBondContact N-OE2 3.32Å
852	A	88.4	Confident	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.			trans	-96.8	8.5	177	0	0	0	0	0	113.8	Y812 T813 P849 T854 L855 V856	Y812-A852 HydrophobicContact CD1-CB 4.39Å; T813-A852 HydrophobicContact CG2-CB 4.06Å; P849-A852 HydrophobicContact CG-CB 3.7Å; P849-A852 PolarHBondContact O-N 3.35Å; P849-A852 VanDerWaalsContact O-N 3.16Å; A852-T854 VanDerWaalsContact C-N 3.27Å; A852-T854 PolarHBondContact O-N 3.34Å; A852-L855 WeakPolarHBondContact O-CB 3.26Å; A852-L855 PolarHBondContact O-N 2.95Å; A852-V856 PolarHBondContact O-N 2.84Å
853	E	86.8	Confident	87.5	Confident	49 Å²	49	38.2 Å²	38.2	23%	0.229	20%	0.198	C	C	.	.	H	α-helix	trans	-54.8	-43.5	-176.5	-68	85.3	-175.1	0	0	112.4	G851 V856 T857 L885 F890	G851-E853 WeakPolarHBondContact CA-OE2 3.27Å; G851-E853 VanDerWaalsContact N-CD 3.34Å; G851-E853 PolarHBondContact N-OE1 3.43Å; G851-E853 VanDerWaalsContact N-OE1 3.1Å; G851-E853 PolarHBondContact N-OE2 3.32Å; E853-V856 PolarHBondContact O-N 3.42Å; E853-T857 WeakPolarHBondContact O-CB 3.3Å; E853-T857 PolarHBondContact O-N 3.4Å; E853-T857 PolarHBondContact O-OG1 3.33Å; E853-L885 HydrophobicContact CB-CD1 4.44Å; E853-L885 HydrophobicContact CG-CD1 3.31Å; E853-L885 HydrophobicContact CG-CD2 4.37Å; E853-L885 HydrophobicContact CG-CG 4.47Å; E853-F890 HydrophobicContact CB-CE2 4.28Å; E853-F890 HydrophobicContact CB-CZ 3.68Å; E853-F890 HydrophobicContact CG-CZ 4.13Å
854	T	88.6	Confident	87.2	Confident	77 Å²	77	35.1 Å²	35.1	47%	0.472	18%	0.183	S	C	.	.	H	α-helix	trans	-69.1	-33.1	179.9	47.8	0	0	0	0	112.6	Y812 A852 R858	Y812-T854 PolarHBondContact OH-OG1 3.44Å; A852-T854 VanDerWaalsContact C-N 3.27Å; A852-T854 PolarHBondContact O-N 3.34Å; T854-R858 WeakPolarHBondContact O-CB 3.28Å; T854-R858 PolarHBondContact O-N 3.04Å; T854-R858 VanDerWaalsContact O-N 3.11Å
855	L	90.4	Very high	86.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.4	-50.7	173.8	-179.2	66.3	0	0	0	110.6	A809 Y812 V823 L824 I827 A852 T857 R858 C859	A809-L855 HydrophobicContact CB-CD2 4.28Å; Y812-L855 HydrophobicContact CD1-CB 4.01Å; Y812-L855 HydrophobicContact CD1-CD2 4.28Å; Y812-L855 HydrophobicContact CD2-CD1 4.48Å; Y812-L855 HydrophobicContact CD2-CD2 4.42Å; Y812-L855 HydrophobicContact CE1-CB 3.88Å; Y812-L855 HydrophobicContact CE2-CB 4.38Å; Y812-L855 HydrophobicContact CG-CB 4.33Å; Y812-L855 HydrophobicContact CG-CD2 4Å; V823-L855 HydrophobicContact CG1-CD1 4.16Å; L824-L855 HydrophobicContact CD2-CB 4.39Å; L824-L855 HydrophobicContact CD2-CD1 4.15Å; I827-L855 HydrophobicContact CG1-CD1 4.26Å; I827-L855 HydrophobicContact CG2-CD1 4.46Å; A852-L855 WeakPolarHBondContact O-CB 3.26Å; A852-L855 PolarHBondContact O-N 2.95Å; L855-T857 VanDerWaalsContact C-N 3.32Å; L855-T857 PolarHBondContact O-N 2.95Å; L855-R858 PolarHBondContact O-N 2.87Å; L855-R858 VanDerWaalsContact O-N 3.12Å; L855-C859 PolarHBondContact O-N 3.34Å; L855-C859 PolarHBondContact O-SG 3.32Å
856	V	89.2	Confident	86.1	Confident	2 Å²	2	45 Å²	45	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-44.2	177.5	175.4	0	0	0	0	111	L844 V845 C848 A852 E853 R858 C859 L860 F890	L844-V856 HydrophobicContact CD2-CG2 4.4Å; L844-V856 HydrophobicContact CG-CG2 4.27Å; V845-V856 HydrophobicContact CG2-CG1 4.08Å; C848-V856 HydrophobicContact CB-CG2 4.43Å; A852-V856 PolarHBondContact O-N 2.84Å; E853-V856 PolarHBondContact O-N 3.42Å; V856-R858 VanDerWaalsContact C-N 3.31Å; V856-R858 PolarHBondContact O-N 3.24Å; V856-C859 PolarHBondContact O-N 3.23Å; V856-L860 HydrophobicContact CG1-CD1 4.13Å; V856-L860 HydrophobicContact CG1-CG 4.35Å; V856-L860 WeakPolarHBondContact O-CG 3.19Å; V856-L860 PolarHBondContact O-N 3.06Å; V856-F890 HydrophobicContact CG1-CE1 4.33Å
857	T	87.2	Confident	85.5	Confident	29 Å²	29	45.2 Å²	45.2	18%	0.178	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-43.5	176.1	-58.3	0	0	0	0	111.6	E853 L855 L860 H861 F890	E853-T857 WeakPolarHBondContact O-CB 3.3Å; E853-T857 PolarHBondContact O-N 3.4Å; E853-T857 PolarHBondContact O-OG1 3.33Å; L855-T857 VanDerWaalsContact C-N 3.32Å; L855-T857 PolarHBondContact O-N 2.95Å; T857-L860 PolarHBondContact O-N 3.47Å; T857-H861 PolarHBondContact O-CD2 3.45Å; T857-H861 VanDerWaalsContact O-CD2 3.3Å; T857-H861 PolarHBondContact O-N 3Å; T857-F890 WeakPolarHBondContact OG1-CE1 3.41Å; T857-F890 WeakPolarHBondContact OG1-CZ 3.17Å
858	R	89.7	Confident	85.1	Confident	91 Å²	91	44.1 Å²	44.1	34%	0.343	23%	0.232	S	C	.	.	H	α-helix	trans	-66.1	-40	177	-175.9	62	176.9	174.1	6.7	112.4	L824 I827 E828 T854 L855 V856 H861 S862	L824-R858 HydrophobicContact CD2-CB 3.76Å; L824-R858 HydrophobicContact CD2-CG 4.14Å; L824-R858 PolarHBondContact O-NE 2.9Å; I827-R858 HydrophobicContact CG2-CG 3.98Å; E828-R858 IonicContact OE2-CZ 3.56Å; E828-R858 IonicContact OE2-NH2 2.73Å; E828-R858 PolarHBondContact OE2-NH2 2.92Å; T854-R858 WeakPolarHBondContact O-CB 3.28Å; T854-R858 PolarHBondContact O-N 3.04Å; T854-R858 VanDerWaalsContact O-N 3.11Å; L855-R858 PolarHBondContact O-N 2.87Å; L855-R858 VanDerWaalsContact O-N 3.12Å; V856-R858 VanDerWaalsContact C-N 3.31Å; V856-R858 PolarHBondContact O-N 3.24Å; R858-H861 PolarHBondContact O-N 3.15Å; R858-S862 WeakPolarHBondContact O-CB 3.47Å; R858-S862 PolarHBondContact O-N 3.32Å; R858-S862 PolarHBondContact O-OG 2.85Å
859	C	89.3	Confident	85	Confident	4 Å²	4	45 Å²	45	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-46.7	175	-65.5	0	0	0	0	111.3	I831 L855 V856 H861 S862 L863	I831-C859 HydrophobicContact CD1-CB 4.37Å; I831-C859 VanDerWaalsContact CD1-SG 3.6Å; I831-C859 HydrophobicContact CG1-CB 4.46Å; I831-C859 HydrophobicContact CG2-CB 4.17Å; L855-C859 PolarHBondContact O-N 3.34Å; L855-C859 PolarHBondContact O-SG 3.32Å; V856-C859 PolarHBondContact O-N 3.23Å; C859-H861 PolarHBondContact O-N 2.71Å; C859-S862 PolarHBondContact O-N 3.04Å; C859-L863 WeakPolarHBondContact O-CD1 3.36Å; C859-L863 VanDerWaalsContact O-CG 3.26Å; C859-L863 WeakPolarHBondContact O-CG 3.47Å; C859-L863 PolarHBondContact O-N 3.37Å; C859-L863 VanDerWaalsContact O-N 3.09Å
860	L	87.8	Confident	84.9	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-45.8	178.3	-68.6	174.5	0	0	0	112.2	V845 V856 T857 S862 L863 T864 L873 V877 F890 P893	V845-L860 HydrophobicContact CG2-CD2 4.21Å; V856-L860 HydrophobicContact CG1-CD1 4.13Å; V856-L860 HydrophobicContact CG1-CG 4.35Å; V856-L860 WeakPolarHBondContact O-CG 3.19Å; V856-L860 PolarHBondContact O-N 3.06Å; T857-L860 PolarHBondContact O-N 3.47Å; L860-S862 VanDerWaalsContact C-N 3.34Å; L860-S862 PolarHBondContact O-N 3.02Å; L860-L863 PolarHBondContact O-N 2.92Å; L860-T864 WeakPolarHBondContact O-CB 3.46Å; L860-T864 WeakPolarHBondContact O-CG2 3.2Å; L860-T864 PolarHBondContact O-N 3.42Å; L860-T864 PolarHBondContact O-OG1 2.87Å; L860-L873 HydrophobicContact CD2-CD1 3.68Å; L860-L873 HydrophobicContact CD2-CD2 4.18Å; L860-L873 HydrophobicContact CD2-CG 4.16Å; L860-V877 HydrophobicContact CD1-CG1 4.49Å; L860-V877 HydrophobicContact CD1-CG2 3.81Å; L860-V877 HydrophobicContact CD2-CG2 3.78Å; L860-V877 HydrophobicContact CG-CG2 4.48Å; L860-F890 HydrophobicContact CD1-CD1 4.45Å; L860-P893 HydrophobicContact CB-CB 3.74Å; L860-P893 HydrophobicContact CB-CG 3.81Å
861	H	86.9	Confident	84.9	Confident	41 Å²	41	41.1 Å²	41.1	19%	0.19	23%	0.231	C	C	.	.	H	α-helix	trans	-59.3	-45.7	173.7	-86.9	-73.2	0	0	0	111.5	T857 R858 C859 L863 T864 D865 E920 R924	T857-H861 PolarHBondContact O-CD2 3.45Å; T857-H861 VanDerWaalsContact O-CD2 3.3Å; T857-H861 PolarHBondContact O-N 3Å; R858-H861 PolarHBondContact O-N 3.15Å; C859-H861 PolarHBondContact O-N 2.71Å; H861-L863 PolarHBondContact O-N 2.89Å; H861-T864 PolarHBondContact O-N 2.81Å; H861-D865 WeakPolarHBondContact O-CB 3.18Å; H861-D865 PolarHBondContact O-N 3.47Å; H861-D865 VanDerWaalsContact O-N 3.1Å; H861-E920 IonicContact CE1-OE1 3.52Å; H861-R924 PolarHBondContact ND1-NH2 3.38Å
862	S	87.8	Confident	85	Confident	5 Å²	5	45 Å²	45	4%	0.035	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-33.6	-177.9	-57.4	0	0	0	0	113.2	R832 R858 C859 L860	R832-S862 WeakPolarHBondContact CG-O 3.21Å; R832-S862 PolarHBondContact NE-O 3.23Å; R858-S862 WeakPolarHBondContact O-CB 3.47Å; R858-S862 PolarHBondContact O-N 3.32Å; R858-S862 PolarHBondContact O-OG 2.85Å; C859-S862 PolarHBondContact O-N 3.04Å; L860-S862 VanDerWaalsContact C-N 3.34Å; L860-S862 PolarHBondContact O-N 3.02Å
863	L	85.7	Confident	84.9	Confident	9 Å²	9	45 Å²	45	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-81.3	-37.1	-179.4	-70.5	165	0	0	0	113.4	I831 M836 L841 C859 L860 H861	I831-L863 HydrophobicContact CG2-CD1 3.89Å; I831-L863 HydrophobicContact CG2-CD2 3.73Å; I831-L863 HydrophobicContact CG2-CG 3.6Å; M836-L863 HydrophobicContact CE-CB 4.11Å; M836-L863 HydrophobicContact CG-CB 4.03Å; M836-L863 HydrophobicContact CG-CD2 3.98Å; M836-L863 HydrophobicContact CG-CG 4.48Å; L841-L863 HydrophobicContact CD2-CD1 3.26Å; C859-L863 WeakPolarHBondContact O-CD1 3.36Å; C859-L863 VanDerWaalsContact O-CG 3.26Å; C859-L863 WeakPolarHBondContact O-CG 3.47Å; C859-L863 PolarHBondContact O-N 3.37Å; C859-L863 VanDerWaalsContact O-N 3.09Å; L860-L863 PolarHBondContact O-N 2.92Å; H861-L863 PolarHBondContact O-N 2.89Å
864	T	83.6	Confident	84.9	Confident	6 Å²	6	43 Å²	43	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-97.9	5.1	-173.1	59.8	0	0	0	0	113.7	M836 L860 H861 V867 P869 L873 P893 R924	M836-T864 HydrophobicContact CE-CG2 3.62Å; L860-T864 WeakPolarHBondContact O-CB 3.46Å; L860-T864 WeakPolarHBondContact O-CG2 3.2Å; L860-T864 PolarHBondContact O-N 3.42Å; L860-T864 PolarHBondContact O-OG1 2.87Å; H861-T864 PolarHBondContact O-N 2.81Å; T864-V867 CarbonylContact C-O 3.59Å; T864-V867 WeakPolarHBondContact CA-O 3.28Å; T864-P869 HydrophobicContact CG2-CB 4.01Å; T864-L873 HydrophobicContact CG2-CD2 4.29Å; T864-P893 WeakPolarHBondContact CB-O 3.43Å; T864-P893 HydrophobicContact CG2-CB 4.34Å; T864-P893 WeakPolarHBondContact CG2-O 3.46Å; T864-P893 WeakPolarHBondContact OG1-CB 3.42Å; T864-P893 PolarHBondContact OG1-O 3.39Å; T864-P893 VanDerWaalsContact OG1-O 3.13Å; T864-R924 PolarHBondContact OG1-NH1 3.33Å
865	D	80.3	Confident	84.8	Confident	62 Å²	62	45.1 Å²	45.1	33%	0.332	23%	0.234	S	C	.	.	S	Bend	trans	-69.9	-41.1	-176	-161	33.4	0	0	0	112.8	R832 H861 R924	R832-D865 IonicContact NH2-OD2 3.99Å; R832-D865 PolarHBondContact NH2-OD2 3.15Å; H861-D865 WeakPolarHBondContact O-CB 3.18Å; H861-D865 PolarHBondContact O-N 3.47Å; H861-D865 VanDerWaalsContact O-N 3.1Å; D865-R924 IonicContact OD1-NH2 3.88Å
866	K	73.9	Confident	84.5	Confident	153 Å²	153	48.5 Å²	48.5	67%	0.665	25%	0.246	S	C	*	.	S	Bend	trans	-117.6	-9	-174.9	-60.5	-172.3	179.4	-173.8	0	114.1
867	V	75.4	Confident	84.4	Confident	77 Å²	77	48.4 Å²	48.4	47%	0.467	25%	0.246	S	C	.	.	S	Bend	trans	-134.8	136.9	-171.7	-176.7	0	0	0	0	108.2	M836 T864	M836-V867 HydrophobicContact SD-CB 4.12Å; M836-V867 HydrophobicContact SD-CG1 3.92Å; T864-V867 CarbonylContact C-O 3.59Å; T864-V867 WeakPolarHBondContact CA-O 3.28Å
868	P	77	Confident	84.2	Confident	75 Å²	75	49.9 Å²	49.9	49%	0.487	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-61.7	146.4	176.8	25.3	-34.6	0	0	0	111.9
869	P	83.4	Confident	84	Confident	19 Å²	19	47.9 Å²	47.9	12%	0.123	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.5	139.6	-179.2	28.4	-35.4	0	0	0	112.5	M836 T864 V874 V894	M836-P869 HydrophobicContact CE-CB 4.46Å; T864-P869 HydrophobicContact CG2-CB 4.01Å; P869-V874 HydrophobicContact CB-CG2 3.92Å; P869-V874 HydrophobicContact CG-CG2 4.17Å; P869-V894 HydrophobicContact CB-CB 4.46Å; P869-V894 HydrophobicContact CB-CG1 4.23Å
870	S	85.3	Confident	83.7	Confident	18 Å²	18	48 Å²	48	13%	0.126	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-72.8	148	174.2	68.2	0	0	0	0	111.2	E872 L873 V874	S870-E872 VanDerWaalsContact C-N 3.26Å; S870-E872 PolarHBondContact O-N 3.26Å; S870-L873 WeakPolarHBondContact O-CB 3.34Å; S870-L873 PolarHBondContact O-N 2.83Å; S870-L873 VanDerWaalsContact O-N 3.14Å; S870-L873 VanDerWaalsContact OG-CB 3.3Å; S870-L873 WeakPolarHBondContact OG-CB 3.5Å; S870-L873 PolarHBondContact OG-N 3.1Å; S870-V874 WeakPolarHBondContact O-CG2 3.44Å; S870-V874 PolarHBondContact O-N 3.36Å
871	P	83.5	Confident	83.5	Confident	111 Å²	111	49.3 Å²	49.3	72%	0.721	25%	0.249	S	C	*	.	H	α-helix	trans	-62.3	-32.9	-176.9	24	-34.2	0	0	0	113	K875	P871-K875 PolarHBondContact O-N 3.43Å
872	E	84.9	Confident	83.3	Confident	116 Å²	116	53.5 Å²	53.5	54%	0.542	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.4	-65.5	-172.8	168.3	0	0	112.1	L842 S870 K875 R876	L842-E872 HydrophobicContact CD1-CB 4.4Å; S870-E872 VanDerWaalsContact C-N 3.26Å; S870-E872 PolarHBondContact O-N 3.26Å; E872-K875 PolarHBondContact O-N 3.16Å; E872-R876 WeakPolarHBondContact O-CG 3.14Å; E872-R876 PolarHBondContact O-N 3.19Å; E872-R876 VanDerWaalsContact O-N 3.08Å
873	L	86.4	Confident	82.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-45.4	176.1	-176.5	66.3	0	0	0	111	M836 L842 V845 L860 T864 S870 K875 R876 V877	M836-L873 HydrophobicContact CE-CD2 3.83Å; L842-L873 HydrophobicContact CD2-CB 4.11Å; L842-L873 HydrophobicContact CD2-CD1 3.7Å; V845-L873 HydrophobicContact CG2-CD1 4.45Å; L860-L873 HydrophobicContact CD2-CD1 3.68Å; L860-L873 HydrophobicContact CD2-CD2 4.18Å; L860-L873 HydrophobicContact CD2-CG 4.16Å; T864-L873 HydrophobicContact CG2-CD2 4.29Å; S870-L873 WeakPolarHBondContact O-CB 3.34Å; S870-L873 PolarHBondContact O-N 2.83Å; S870-L873 VanDerWaalsContact O-N 3.14Å; S870-L873 VanDerWaalsContact OG-CB 3.3Å; S870-L873 WeakPolarHBondContact OG-CB 3.5Å; S870-L873 PolarHBondContact OG-N 3.1Å; L873-K875 VanDerWaalsContact C-N 3.3Å; L873-K875 PolarHBondContact O-N 3.01Å; L873-R876 PolarHBondContact O-N 2.88Å; L873-V877 HydrophobicContact CD1-CG2 4.4Å; L873-V877 HydrophobicContact CG-CG2 4.46Å; L873-V877 WeakPolarHBondContact O-CG2 3.48Å; L873-V877 PolarHBondContact O-N 2.98Å
874	V	86.4	Confident	82.2	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.03	32%	0.317	C	S	.	.	H	α-helix	trans	-57.1	-45.6	176.6	177.7	0	0	0	0	110.6	P869 S870 V877 R878 V894 L898	P869-V874 HydrophobicContact CB-CG2 3.92Å; P869-V874 HydrophobicContact CG-CG2 4.17Å; S870-V874 WeakPolarHBondContact O-CG2 3.44Å; S870-V874 PolarHBondContact O-N 3.36Å; V874-V877 PolarHBondContact O-N 2.99Å; V874-R878 VanDerWaalsContact O-CB 3.3Å; V874-R878 WeakPolarHBondContact O-CB 3.47Å; V874-R878 PolarHBondContact O-N 3.27Å; V874-V894 HydrophobicContact CG2-CB 4.28Å; V874-L898 HydrophobicContact CG1-CD2 3.71Å; V874-L898 HydrophobicContact CG1-CG 4.45Å
875	K	86.1	Confident	81.3	Confident	123 Å²	123	67.2 Å²	67.2	54%	0.535	33%	0.326	S	S	.	.	H	α-helix	trans	-59.8	-47.2	177.8	-175.8	-178.7	176.7	-177.9	0	112.2	P871 E872 L873 R878 D879	P871-K875 PolarHBondContact O-N 3.43Å; E872-K875 PolarHBondContact O-N 3.16Å; L873-K875 VanDerWaalsContact C-N 3.3Å; L873-K875 PolarHBondContact O-N 3.01Å; K875-R878 WeakPolarHBondContact O-CB 3.01Å; K875-R878 PolarHBondContact O-N 3.22Å; K875-D879 PolarHBondContact O-N 2.76Å
876	R	85.3	Confident	80.9	Confident	71 Å²	71	68.8 Å²	68.8	27%	0.268	34%	0.34	S	S	.	.	H	α-helix	trans	-67.9	-38.9	-179.4	-61.9	-63.7	177	84.6	11.7	112.5	L842 V845 E846 E872 L873 D879 L880	L842-R876 HydrophobicContact CD2-CG 4.42Å; V845-R876 HydrophobicContact CG1-CB 4.12Å; E846-R876 IonicContact OE2-CZ 3.74Å; E846-R876 IonicContact OE2-NE 3.54Å; E846-R876 IonicContact OE2-NH1 3.78Å; E846-R876 PolarHBondContact OE2-NH1 3.46Å; E872-R876 WeakPolarHBondContact O-CG 3.14Å; E872-R876 PolarHBondContact O-N 3.19Å; E872-R876 VanDerWaalsContact O-N 3.08Å; L873-R876 PolarHBondContact O-N 2.88Å; R876-D879 PolarHBondContact O-N 3.38Å; R876-L880 WeakPolarHBondContact O-CB 3.2Å; R876-L880 PolarHBondContact O-N 3.45Å
877	V	86.2	Confident	81.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-39.4	174.6	175.4	0	0	0	0	111.2	V845 L860 L873 V874 L880 Y881 F890 L891 V894	V845-V877 HydrophobicContact CG1-CG2 3.8Å; L860-V877 HydrophobicContact CD1-CG1 4.49Å; L860-V877 HydrophobicContact CD1-CG2 3.81Å; L860-V877 HydrophobicContact CD2-CG2 3.78Å; L860-V877 HydrophobicContact CG-CG2 4.48Å; L873-V877 HydrophobicContact CD1-CG2 4.4Å; L873-V877 HydrophobicContact CG-CG2 4.46Å; L873-V877 WeakPolarHBondContact O-CG2 3.48Å; L873-V877 PolarHBondContact O-N 2.98Å; V874-V877 PolarHBondContact O-N 2.99Å; V877-L880 PolarHBondContact O-N 3.4Å; V877-Y881 PolarHBondContact O-N 3.29Å; V877-F890 WeakPolarHBondContact CG1-O 3.36Å; V877-L891 HydrophobicContact CG1-CD2 4.34Å; V877-V894 HydrophobicContact CB-CG1 4.38Å; V877-V894 HydrophobicContact CB-CG2 4.24Å; V877-V894 HydrophobicContact CG1-CG1 4.47Å; V877-V894 HydrophobicContact CG1-CG2 3.73Å; V877-V894 HydrophobicContact CG2-CG1 4.1Å
878	R	84.2	Confident	81.3	Confident	60 Å²	60	61.5 Å²	61.5	23%	0.226	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-48.5	173.6	-178.6	-167.4	-68.6	161.7	-5.6	111.1	V874 K875 L880 Y881 H882 E902	V874-R878 VanDerWaalsContact O-CB 3.3Å; V874-R878 WeakPolarHBondContact O-CB 3.47Å; V874-R878 PolarHBondContact O-N 3.27Å; K875-R878 WeakPolarHBondContact O-CB 3.01Å; K875-R878 PolarHBondContact O-N 3.22Å; R878-L880 VanDerWaalsContact C-N 3.31Å; R878-L880 PolarHBondContact O-N 3.44Å; R878-Y881 PolarHBondContact O-N 3.42Å; R878-H882 PolarHBondContact O-N 3.49Å; R878-H882 VanDerWaalsContact O-N 3.14Å; R878-H882 PolarHBondContact O-ND1 3.15Å; R878-E902 IonicContact CZ-OE1 3.11Å; R878-E902 IonicContact CZ-OE2 2.75Å; R878-E902 IonicContact NE-OE1 2.81Å; R878-E902 PolarHBondContact NE-OE1 3.04Å; R878-E902 IonicContact NE-OE2 3.07Å; R878-E902 VanDerWaalsContact NH2-CD 3.29Å; R878-E902 IonicContact NH2-OE1 2.75Å; R878-E902 PolarHBondContact NH2-OE1 3.43Å; R878-E902 VanDerWaalsContact NH2-OE1 3.11Å; R878-E902 IonicContact NH2-OE2 3.62Å; R878-E902 PolarHBondContact NH2-OE2 3.45Å
879	D	84.4	Confident	81.4	Confident	48 Å²	48	64.3 Å²	64.3	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-40.6	178.4	-73.4	-16	0	0	0	111.4	K875 R876 H882 K883	K875-D879 PolarHBondContact O-N 2.76Å; R876-D879 PolarHBondContact O-N 3.38Å; D879-H882 PolarHBondContact O-N 2.98Å; D879-K883 HydrophobicContact CB-CD 4.48Å; D879-K883 VanDerWaalsContact O-CB 3.22Å; D879-K883 WeakPolarHBondContact O-CB 3.32Å; D879-K883 VanDerWaalsContact O-CG 3.23Å; D879-K883 WeakPolarHBondContact O-CG 3.4Å; D879-K883 PolarHBondContact O-N 3.29Å
880	L	83.7	Confident	81.3	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-45.7	176.6	-177.1	66.9	0	0	0	112.4	V845 C848 R876 V877 R878 H882 K883 R884 L885 F890	V845-L880 HydrophobicContact CG1-CD2 4.38Å; V845-L880 WeakPolarHBondContact O-CD2 3.45Å; C848-L880 HydrophobicContact CB-CD1 4.04Å; C848-L880 HydrophobicContact CB-CD2 4.4Å; R876-L880 WeakPolarHBondContact O-CB 3.2Å; R876-L880 PolarHBondContact O-N 3.45Å; V877-L880 PolarHBondContact O-N 3.4Å; R878-L880 VanDerWaalsContact C-N 3.31Å; R878-L880 PolarHBondContact O-N 3.44Å; L880-H882 VanDerWaalsContact C-N 3.34Å; L880-H882 PolarHBondContact O-N 3.13Å; L880-K883 PolarHBondContact O-N 3.02Å; L880-R884 HydrophobicContact CD1-CB 4.19Å; L880-R884 PolarHBondContact O-N 3.32Å; L880-L885 PolarHBondContact O-N 3.31Å; L880-F890 HydrophobicContact CD2-CD1 4.3Å; L880-F890 HydrophobicContact CD2-CE1 4.2Å
881	Y	83.8	Confident	81.1	Confident	29 Å²	29	63.4 Å²	63.4	11%	0.114	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-40.1	179.6	175.1	-101.9	0	0	0	112.2	V877 R878 L885 P886 L891 K909	V877-Y881 PolarHBondContact O-N 3.29Å; R878-Y881 PolarHBondContact O-N 3.42Å; Y881-L885 WeakPolarHBondContact CA-O 3.35Å; Y881-L885 WeakPolarHBondContact CD2-O 3.35Å; Y881-L885 CarbonylContact O-C 3.47Å; Y881-P886 VanDerWaalsContact CE2-C 3.43Å; Y881-L891 HydrophobicContact CD1-CD1 4.08Å; Y881-L891 HydrophobicContact CD2-CD1 4.19Å; Y881-L891 HydrophobicContact CD2-CG 4.19Å; Y881-L891 HydrophobicContact CE1-CD1 3.98Å; Y881-L891 HydrophobicContact CE2-CD1 4.1Å; Y881-L891 HydrophobicContact CE2-CG 4.49Å; Y881-L891 HydrophobicContact CG-CD1 4.18Å; Y881-L891 HydrophobicContact CG-CD2 4.23Å; Y881-L891 HydrophobicContact CG-CG 4.24Å; Y881-K909 PolarHBondContact OH-NZ 2.51Å
882	H	81.6	Confident	81.1	Confident	130 Å²	130	58.3 Å²	58.3	60%	0.602	27%	0.265	S	S	*	.	H	α-helix	trans	-79	-36.1	179.7	-68.7	91.7	0	0	0	113.4	R878 D879 L880	R878-H882 PolarHBondContact O-N 3.49Å; R878-H882 VanDerWaalsContact O-N 3.14Å; R878-H882 PolarHBondContact O-ND1 3.15Å; D879-H882 PolarHBondContact O-N 2.98Å; L880-H882 VanDerWaalsContact C-N 3.34Å; L880-H882 PolarHBondContact O-N 3.13Å
883	K	78.1	Confident	81.1	Confident	157 Å²	157	53 Å²	53	68%	0.683	24%	0.241	S	C	*	.	H	α-helix	trans	-84.8	-34.2	-173.4	-70.6	174.7	-178.1	172.1	0	114.1	D879 L880	D879-K883 HydrophobicContact CB-CD 4.48Å; D879-K883 VanDerWaalsContact O-CB 3.22Å; D879-K883 WeakPolarHBondContact O-CB 3.32Å; D879-K883 VanDerWaalsContact O-CG 3.23Å; D879-K883 WeakPolarHBondContact O-CG 3.4Å; D879-K883 PolarHBondContact O-N 3.29Å; L880-K883 PolarHBondContact O-N 3.02Å
884	R	72	Confident	81	Confident	107 Å²	107	53 Å²	53	40%	0.404	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	-37.2	-162	-156	172.7	175.4	172.9	-8.6	115.2	C848 K850 L880	C848-R884 PolarHBondContact O-NH1 2.97Å; C848-R884 PolarHBondContact O-NH2 3.49Å; K850-R884 VanDerWaalsContact CG-NH2 3.34Å; L880-R884 HydrophobicContact CD1-CB 4.19Å; L880-R884 PolarHBondContact O-N 3.32Å
885	L	66.3	Low	80.8	Confident	44 Å²	44	52.7 Å²	52.7	23%	0.23	24%	0.239	C	C	.	.			trans	-144.6	101.4	-171.6	-69.8	164.5	0	0	0	112	E853 L880 Y881 D887 F890	E853-L885 HydrophobicContact CB-CD1 4.44Å; E853-L885 HydrophobicContact CG-CD1 3.31Å; E853-L885 HydrophobicContact CG-CD2 4.37Å; E853-L885 HydrophobicContact CG-CG 4.47Å; L880-L885 PolarHBondContact O-N 3.31Å; Y881-L885 WeakPolarHBondContact CA-O 3.35Å; Y881-L885 WeakPolarHBondContact CD2-O 3.35Å; Y881-L885 CarbonylContact O-C 3.47Å; L885-D887 PolarHBondContact O-N 3.06Å; L885-F890 HydrophobicContact CD1-CE2 4.28Å; L885-F890 HydrophobicContact CD1-CZ 4.15Å
886	P	70.4	Confident	80.5	Confident	95 Å²	95	48.2 Å²	48.2	62%	0.617	22%	0.221	S	C	*	.			trans	-81.1	30.9	179.7	34.6	-36.3	0	0	0	113.5	Y881 V888	Y881-P886 VanDerWaalsContact CE2-C 3.43Å; P886-V888 PolarHBondContact O-N 3.36Å
887	D	78.3	Confident	80	Confident	68 Å²	68	46.5 Å²	46.5	36%	0.364	23%	0.225	S	C	.	.			trans	-80.4	117.4	172.4	-174.8	-7.2	0	0	0	109.6	L885 R889 F890	L885-D887 PolarHBondContact O-N 3.06Å; D887-R889 PolarHBondContact O-N 3.24Å; D887-R889 VanDerWaalsContact O-N 3.13Å; D887-R889 WeakPolarHBondContact OD1-CB 3.37Å; D887-R889 WeakPolarHBondContact OD1-CG 3.34Å; D887-R889 PolarHBondContact OD1-N 2.9Å; D887-F890 HydrophobicContact CB-CD2 4.14Å; D887-F890 HydrophobicContact CB-CE2 4.5Å; D887-F890 PolarHBondContact O-N 3.48Å
888	V	78.9	Confident	79.8	Confident	8 Å²	8	47 Å²	47	5%	0.048	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-64.2	-18.1	-176.3	77.3	0	0	0	0	112.9	P886 F890 L891 A906 K909 L910 L913	P886-V888 PolarHBondContact O-N 3.36Å; V888-F890 PolarHBondContact O-N 3.4Å; V888-L891 PolarHBondContact O-N 2.84Å; V888-L891 VanDerWaalsContact O-N 3.12Å; V888-A906 HydrophobicContact CG2-CB 4.29Å; V888-K909 HydrophobicContact CB-CB 4.04Å; V888-K909 HydrophobicContact CG1-CB 4.15Å; V888-K909 HydrophobicContact CG2-CB 3.91Å; V888-L910 HydrophobicContact CB-CD2 4.45Å; V888-L910 HydrophobicContact CG1-CD2 4.17Å; V888-L910 HydrophobicContact CG2-CD2 3.61Å; V888-L910 HydrophobicContact CG2-CG 3.66Å; V888-L913 HydrophobicContact CG1-CD1 4Å; V888-L913 HydrophobicContact CG1-CD2 4.18Å; V888-L913 HydrophobicContact CG1-CG 4.27Å
889	R	80.3	Confident	79.7	Confident	134 Å²	134	49.7 Å²	49.7	51%	0.506	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-62.3	-28.4	177.7	-66.9	173.9	-177.3	179.4	2.5	113.2	D887 L891 I892 L913	D887-R889 PolarHBondContact O-N 3.24Å; D887-R889 VanDerWaalsContact O-N 3.13Å; D887-R889 WeakPolarHBondContact OD1-CB 3.37Å; D887-R889 WeakPolarHBondContact OD1-CG 3.34Å; D887-R889 PolarHBondContact OD1-N 2.9Å; R889-L891 PolarHBondContact O-N 2.99Å; R889-I892 HydrophobicContact CB-CD1 4.32Å; R889-I892 HydrophobicContact CG-CD1 4.34Å; R889-I892 WeakPolarHBondContact O-CB 3.49Å; R889-I892 WeakPolarHBondContact O-CG1 3.47Å; R889-I892 PolarHBondContact O-N 3.08Å; R889-L913 HydrophobicContact CG-CD1 4.22Å; R889-L913 HydrophobicContact CG-CD2 4.17Å
890	F	80.9	Confident	79.4	Confident	9 Å²	9	51.7 Å²	51.7	4%	0.039	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-66	-23.6	175.9	-83.9	-90.1	0	0	0	113.8	E853 V856 T857 L860 V877 L880 L885 D887 V888 P893	E853-F890 HydrophobicContact CB-CE2 4.28Å; E853-F890 HydrophobicContact CB-CZ 3.68Å; E853-F890 HydrophobicContact CG-CZ 4.13Å; V856-F890 HydrophobicContact CG1-CE1 4.33Å; T857-F890 WeakPolarHBondContact OG1-CE1 3.41Å; T857-F890 WeakPolarHBondContact OG1-CZ 3.17Å; L860-F890 HydrophobicContact CD1-CD1 4.45Å; V877-F890 WeakPolarHBondContact CG1-O 3.36Å; L880-F890 HydrophobicContact CD2-CD1 4.3Å; L880-F890 HydrophobicContact CD2-CE1 4.2Å; L885-F890 HydrophobicContact CD1-CE2 4.28Å; L885-F890 HydrophobicContact CD1-CZ 4.15Å; D887-F890 HydrophobicContact CB-CD2 4.14Å; D887-F890 HydrophobicContact CB-CE2 4.5Å; D887-F890 PolarHBondContact O-N 3.48Å; V888-F890 PolarHBondContact O-N 3.4Å; F890-P893 WeakPolarHBondContact O-CD 2.69Å
891	L	82.1	Confident	79.1	Confident	10 Å²	10	59 Å²	59	5%	0.052	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-82.7	-20.4	179.4	-63.6	177.6	0	0	0	112.1	V877 Y881 V888 R889 V894 L895 L898 A906	V877-L891 HydrophobicContact CG1-CD2 4.34Å; Y881-L891 HydrophobicContact CD1-CD1 4.08Å; Y881-L891 HydrophobicContact CD2-CD1 4.19Å; Y881-L891 HydrophobicContact CD2-CG 4.19Å; Y881-L891 HydrophobicContact CE1-CD1 3.98Å; Y881-L891 HydrophobicContact CE2-CD1 4.1Å; Y881-L891 HydrophobicContact CE2-CG 4.49Å; Y881-L891 HydrophobicContact CG-CD1 4.18Å; Y881-L891 HydrophobicContact CG-CD2 4.23Å; Y881-L891 HydrophobicContact CG-CG 4.24Å; V888-L891 PolarHBondContact O-N 2.84Å; V888-L891 VanDerWaalsContact O-N 3.12Å; R889-L891 PolarHBondContact O-N 2.99Å; L891-V894 HydrophobicContact CD2-CG2 4.43Å; L891-V894 CarbonylContact O-C 3.59Å; L891-V894 WeakPolarHBondContact O-CG2 3.19Å; L891-V894 PolarHBondContact O-N 2.84Å; L891-V894 VanDerWaalsContact O-N 3.07Å; L891-L895 HydrophobicContact CB-CD2 4.46Å; L891-L895 VanDerWaalsContact O-CG 3.31Å; L891-L895 WeakPolarHBondContact O-CG 3.38Å; L891-L895 PolarHBondContact O-N 3.44Å; L891-L895 VanDerWaalsContact O-N 3.08Å; L891-L898 HydrophobicContact CB-CD1 4.37Å; L891-L898 HydrophobicContact CD2-CD1 4.32Å; L891-A906 HydrophobicContact CD1-CB 4.17Å
892	I	83.5	Confident	78.9	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55	-46.9	-176.7	-58.6	174.8	0	0	0	112.5	R889 V894 L895 L910 L913 V917 V921	R889-I892 HydrophobicContact CB-CD1 4.32Å; R889-I892 HydrophobicContact CG-CD1 4.34Å; R889-I892 WeakPolarHBondContact O-CB 3.49Å; R889-I892 WeakPolarHBondContact O-CG1 3.47Å; R889-I892 PolarHBondContact O-N 3.08Å; I892-V894 VanDerWaalsContact C-N 3.28Å; I892-V894 PolarHBondContact O-N 3.43Å; I892-L895 HydrophobicContact CG2-CD1 4.49Å; I892-L895 WeakPolarHBondContact O-CG 3.49Å; I892-L910 HydrophobicContact CD1-CD2 4.45Å; I892-L910 HydrophobicContact CG1-CD2 3.9Å; I892-L913 HydrophobicContact CD1-CD1 3.92Å; I892-V917 HydrophobicContact CD1-CG1 3.64Å; I892-V921 HydrophobicContact CD1-CG2 4.07Å; I892-V921 HydrophobicContact CG1-CG2 3.98Å; I892-V921 HydrophobicContact CG2-CG2 4.11Å
893	P	83.3	Confident	78.9	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.019	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59.3	-34.8	177.1	-27.4	37.2	0	0	0	114.4	L860 T864 F890 R924	L860-P893 HydrophobicContact CB-CB 3.74Å; L860-P893 HydrophobicContact CB-CG 3.81Å; T864-P893 WeakPolarHBondContact CB-O 3.43Å; T864-P893 HydrophobicContact CG2-CB 4.34Å; T864-P893 WeakPolarHBondContact CG2-O 3.46Å; T864-P893 WeakPolarHBondContact OG1-CB 3.42Å; T864-P893 PolarHBondContact OG1-O 3.39Å; T864-P893 VanDerWaalsContact OG1-O 3.13Å; F890-P893 WeakPolarHBondContact O-CD 2.69Å; P893-R924 PolarHBondContact O-NH1 2.79Å
894	V	84.3	Confident	78.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-104.4	6.8	-170.3	-65.3	0	0	0	0	114.1	P869 V874 V877 L891 I892 N896 G897	P869-V894 HydrophobicContact CB-CB 4.46Å; P869-V894 HydrophobicContact CB-CG1 4.23Å; V874-V894 HydrophobicContact CG2-CB 4.28Å; V877-V894 HydrophobicContact CB-CG1 4.38Å; V877-V894 HydrophobicContact CB-CG2 4.24Å; V877-V894 HydrophobicContact CG1-CG1 4.47Å; V877-V894 HydrophobicContact CG1-CG2 3.73Å; V877-V894 HydrophobicContact CG2-CG1 4.1Å; L891-V894 HydrophobicContact CD2-CG2 4.43Å; L891-V894 CarbonylContact O-C 3.59Å; L891-V894 WeakPolarHBondContact O-CG2 3.19Å; L891-V894 PolarHBondContact O-N 2.84Å; L891-V894 VanDerWaalsContact O-N 3.07Å; I892-V894 VanDerWaalsContact C-N 3.28Å; I892-V894 PolarHBondContact O-N 3.43Å; V894-N896 PolarHBondContact O-N 3.04Å; V894-N896 VanDerWaalsContact O-N 3.1Å; V894-G897 PolarHBondContact O-N 3.37Å
895	L	82.9	Confident	79.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-51	-39.8	-174.5	-73.2	174.7	0	0	0	113.8	L891 I892 G897 L898 L910 V921 L925	L891-L895 HydrophobicContact CB-CD2 4.46Å; L891-L895 VanDerWaalsContact O-CG 3.31Å; L891-L895 WeakPolarHBondContact O-CG 3.38Å; L891-L895 PolarHBondContact O-N 3.44Å; L891-L895 VanDerWaalsContact O-N 3.08Å; I892-L895 HydrophobicContact CG2-CD1 4.49Å; I892-L895 WeakPolarHBondContact O-CG 3.49Å; L895-G897 PolarHBondContact O-N 3.14Å; L895-L898 HydrophobicContact CD2-CD1 4.13Å; L895-L898 PolarHBondContact O-N 3.07Å; L895-L910 HydrophobicContact CD2-CD1 4.05Å; L895-V921 HydrophobicContact CD1-CB 4.39Å; L895-V921 HydrophobicContact CD1-CG1 3.86Å; L895-V921 HydrophobicContact CD1-CG2 4.29Å; L895-L925 HydrophobicContact CB-CD2 4.13Å; L895-L925 HydrophobicContact CD1-CD2 4.45Å; L895-L925 HydrophobicContact CD1-CG 4.32Å
896	N	79.6	Confident	80	Confident	28 Å²	28	49.5 Å²	49.5	15%	0.15	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-71.3	-13	-176.6	-66	2.4	0	0	0	113.5	V894 R924	V894-N896 PolarHBondContact O-N 3.04Å; V894-N896 VanDerWaalsContact O-N 3.1Å; N896-R924 PolarHBondContact ND2-O 3.33Å; N896-R924 PolarHBondContact OD1-O 2.98Å
897	G	75.8	Confident	80.4	Confident	35 Å²	35	45 Å²	45	36%	0.361	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-103.5	-2.7	176.1	0	0	0	0	0	114.6	V894 L895	V894-G897 PolarHBondContact O-N 3.37Å; L895-G897 PolarHBondContact O-N 3.14Å
898	L	82.2	Confident	80.5	Confident	11 Å²	11	43 Å²	43	6%	0.058	21%	0.208	C	C	.	.	S	Bend	trans	-82.1	155.4	179.8	-68.1	174.9	0	0	0	112.1	V874 L891 L895 V903 P939	V874-L898 HydrophobicContact CG1-CD2 3.71Å; V874-L898 HydrophobicContact CG1-CG 4.45Å; L891-L898 HydrophobicContact CB-CD1 4.37Å; L891-L898 HydrophobicContact CD2-CD1 4.32Å; L895-L898 HydrophobicContact CD2-CD1 4.13Å; L895-L898 PolarHBondContact O-N 3.07Å; L898-V903 HydrophobicContact CB-CG2 3.8Å; L898-P939 WeakPolarHBondContact O-CB 3.26Å
899	E	81.1	Confident	80.5	Confident	117 Å²	117	47.6 Å²	47.6	55%	0.547	23%	0.227	S	C	.	.			trans	-75.2	149.7	176	-65.8	176.9	-158.5	0	0	111.5	K901 E902 V903	E899-K901 PolarHBondContact O-N 3.12Å; E899-K901 VanDerWaalsContact O-N 3.1Å; E899-E902 HydrophobicContact CB-CG 4.14Å; E899-E902 PolarHBondContact N-OE2 3.1Å; E899-E902 WeakPolarHBondContact O-CB 3.47Å; E899-E902 PolarHBondContact O-N 3.29Å; E899-V903 PolarHBondContact O-N 3.04Å; E899-V903 VanDerWaalsContact O-N 3.08Å
900	K	78.1	Confident	80.5	Confident	90 Å²	90	41.2 Å²	41.2	39%	0.391	20%	0.203	S	C	.	.	H	α-helix	trans	-48.5	-42.3	179.5	178.4	168.4	178.3	171.7	0	113.8	E902 I904 L940 E944	K900-E902 VanDerWaalsContact C-N 3.34Å; K900-E902 PolarHBondContact O-N 3.12Å; K900-I904 HydrophobicContact CG-CD1 4.03Å; K900-I904 WeakPolarHBondContact O-CD1 3.33Å; K900-I904 VanDerWaalsContact O-CG1 3.28Å; K900-I904 WeakPolarHBondContact O-CG1 3.5Å; K900-I904 PolarHBondContact O-N 3.1Å; K900-L940 HydrophobicContact CD-CD2 4.21Å; K900-L940 HydrophobicContact CG-CD2 3.84Å; K900-E944 WeakPolarHBondContact CE-OE2 3.3Å; K900-E944 IonicContact NZ-OE1 2.95Å; K900-E944 PolarHBondContact NZ-OE1 3.16Å; K900-E944 IonicContact NZ-OE2 2.77Å; K900-E944 PolarHBondContact NZ-OE2 2.98Å
901	K	78.1	Confident	80.5	Confident	160 Å²	160	41.3 Å²	41.3	70%	0.696	20%	0.204	S	C	*	.	H	α-helix	trans	-64.9	-37.6	179.4	-68.8	179.7	-179.8	175.4	0	112.3	E899 Q905	E899-K901 PolarHBondContact O-N 3.12Å; E899-K901 VanDerWaalsContact O-N 3.1Å; K901-Q905 WeakPolarHBondContact O-CG 3.43Å; K901-Q905 PolarHBondContact O-N 3.07Å
902	E	80	Confident	80.3	Confident	43 Å²	43	46.9 Å²	46.9	20%	0.201	23%	0.227	C	C	.	.	H	α-helix	trans	-73.4	-40.8	-178.2	-57.1	180	122.2	0	0	111.1	R878 E899 K900 I904 Q905 A906	R878-E902 IonicContact CZ-OE1 3.11Å; R878-E902 IonicContact CZ-OE2 2.75Å; R878-E902 IonicContact NE-OE1 2.81Å; R878-E902 PolarHBondContact NE-OE1 3.04Å; R878-E902 IonicContact NE-OE2 3.07Å; R878-E902 VanDerWaalsContact NH2-CD 3.29Å; R878-E902 IonicContact NH2-OE1 2.75Å; R878-E902 PolarHBondContact NH2-OE1 3.43Å; R878-E902 VanDerWaalsContact NH2-OE1 3.11Å; R878-E902 IonicContact NH2-OE2 3.62Å; R878-E902 PolarHBondContact NH2-OE2 3.45Å; E899-E902 HydrophobicContact CB-CG 4.14Å; E899-E902 PolarHBondContact N-OE2 3.1Å; E899-E902 WeakPolarHBondContact O-CB 3.47Å; E899-E902 PolarHBondContact O-N 3.29Å; K900-E902 VanDerWaalsContact C-N 3.34Å; K900-E902 PolarHBondContact O-N 3.12Å; E902-I904 VanDerWaalsContact C-N 3.35Å; E902-I904 PolarHBondContact O-N 2.94Å; E902-Q905 PolarHBondContact O-N 3.47Å; E902-A906 PolarHBondContact O-N 3.05Å
903	V	80.3	Confident	80.2	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-45.5	176	179.4	0	0	0	0	110.6	L898 E899 Q905 A906 L907 L925 P939 L940	L898-V903 HydrophobicContact CB-CG2 3.8Å; E899-V903 PolarHBondContact O-N 3.04Å; E899-V903 VanDerWaalsContact O-N 3.08Å; V903-Q905 VanDerWaalsContact C-N 3.3Å; V903-Q905 PolarHBondContact O-N 3.08Å; V903-A906 PolarHBondContact O-N 3.14Å; V903-L907 WeakPolarHBondContact O-CB 3.37Å; V903-L907 PolarHBondContact O-N 3.28Å; V903-L925 HydrophobicContact CG1-CD1 4.43Å; V903-L925 HydrophobicContact CG1-CD2 3.76Å; V903-P939 HydrophobicContact CG2-CB 4.41Å; V903-P939 HydrophobicContact CG2-CG 4.19Å; V903-L940 HydrophobicContact CB-CD1 4.29Å; V903-L940 HydrophobicContact CG1-CD1 3.54Å; V903-L940 HydrophobicContact CG1-CG 4.47Å
904	I	79.5	Confident	80	Confident	69 Å²	69	52.2 Å²	52.2	35%	0.354	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-36.6	177.8	-66.2	167.1	0	0	0	111.5	K900 E902 P908 A948	K900-I904 HydrophobicContact CG-CD1 4.03Å; K900-I904 WeakPolarHBondContact O-CD1 3.33Å; K900-I904 VanDerWaalsContact O-CG1 3.28Å; K900-I904 WeakPolarHBondContact O-CG1 3.5Å; K900-I904 PolarHBondContact O-N 3.1Å; E902-I904 VanDerWaalsContact C-N 3.35Å; E902-I904 PolarHBondContact O-N 2.94Å; I904-P908 WeakPolarHBondContact O-CD 3.5Å; I904-A948 HydrophobicContact CG1-CB 4.26Å
905	Q	79.6	Confident	79.5	Confident	149 Å²	149	54.5 Å²	54.5	70%	0.696	27%	0.271	S	S	*	.	H	α-helix	trans	-70.1	-34	176.2	-72.4	176.5	14.1	0	0	113.2	K901 E902 V903	K901-Q905 WeakPolarHBondContact O-CG 3.43Å; K901-Q905 PolarHBondContact O-N 3.07Å; E902-Q905 PolarHBondContact O-N 3.47Å; V903-Q905 VanDerWaalsContact C-N 3.3Å; V903-Q905 PolarHBondContact O-N 3.08Å
906	A	80.1	Confident	79.1	Confident	6 Å²	6	61 Å²	61	5%	0.05	30%	0.304	C	S	.	.	H	α-helix	trans	-82.3	-24.1	178.6	0	0	0	0	0	113.4	V888 L891 E902 V903 K909 L910	V888-A906 HydrophobicContact CG2-CB 4.29Å; L891-A906 HydrophobicContact CD1-CB 4.17Å; E902-A906 PolarHBondContact O-N 3.05Å; V903-A906 PolarHBondContact O-N 3.14Å; A906-K909 WeakPolarHBondContact O-CB 3.19Å; A906-K909 PolarHBondContact O-N 3Å; A906-L910 HydrophobicContact CB-CD1 4.3Å; A906-L910 PolarHBondContact O-N 2.91Å
907	L	79.3	Confident	79	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-52.5	-44.7	-174.7	-172.1	65.1	0	0	0	114.3	V903 K909 L910 I911 L945 A948 L949 I952	V903-L907 WeakPolarHBondContact O-CB 3.37Å; V903-L907 PolarHBondContact O-N 3.28Å; L907-K909 PolarHBondContact O-N 3.23Å; L907-L910 PolarHBondContact O-N 3.25Å; L907-L910 VanDerWaalsContact O-N 3.16Å; L907-I911 HydrophobicContact CD1-CD1 4.01Å; L907-I911 HydrophobicContact CD1-CG1 4.31Å; L907-I911 HydrophobicContact CG-CD1 3.8Å; L907-I911 WeakPolarHBondContact O-CD1 3.35Å; L907-I911 WeakPolarHBondContact O-CG1 3.31Å; L907-I911 PolarHBondContact O-N 2.83Å; L907-I911 VanDerWaalsContact O-N 3.14Å; L907-L945 HydrophobicContact CD1-CD1 4.21Å; L907-L945 HydrophobicContact CD2-CD1 4.25Å; L907-A948 HydrophobicContact CD2-CB 3.85Å; L907-L949 HydrophobicContact CD2-CD2 4.13Å; L907-L949 HydrophobicContact CD2-CG 4.42Å; L907-L949 HydrophobicContact CG-CD2 4.38Å; L907-I952 HydrophobicContact CD2-CD1 4.3Å; L907-I952 HydrophobicContact CG-CD1 4.27Å
908	P	79.9	Confident	79.3	Confident	26 Å²	26	60.3 Å²	60.3	17%	0.169	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-27.8	177.8	-22.8	34.2	0	0	0	113.9	I904 K912 I952	I904-P908 WeakPolarHBondContact O-CD 3.5Å; P908-K912 WeakPolarHBondContact O-CG 3.35Å; P908-I952 HydrophobicContact CB-CG2 4.16Å; P908-I952 HydrophobicContact CG-CD1 4.25Å; P908-I952 HydrophobicContact CG-CG1 4.38Å; P908-I952 HydrophobicContact CG-CG2 4.13Å
909	K	80	Confident	79	Confident	104 Å²	104	64.8 Å²	64.8	45%	0.452	31%	0.313	S	S	.	.	H	α-helix	trans	-82.2	-35.2	176.1	-64.8	-177.3	-178.4	-177	0	111.5	Y881 V888 A906 L907 K912	Y881-K909 PolarHBondContact OH-NZ 2.51Å; V888-K909 HydrophobicContact CB-CB 4.04Å; V888-K909 HydrophobicContact CG1-CB 4.15Å; V888-K909 HydrophobicContact CG2-CB 3.91Å; A906-K909 WeakPolarHBondContact O-CB 3.19Å; A906-K909 PolarHBondContact O-N 3Å; L907-K909 PolarHBondContact O-N 3.23Å; K909-K912 PolarHBondContact O-N 3.35Å
910	L	80.6	Confident	78.9	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-39	178.2	-72.6	167.9	0	0	0	112.5	V888 I892 L895 A906 L907 K912 L913 V921	V888-L910 HydrophobicContact CB-CD2 4.45Å; V888-L910 HydrophobicContact CG1-CD2 4.17Å; V888-L910 HydrophobicContact CG2-CD2 3.61Å; V888-L910 HydrophobicContact CG2-CG 3.66Å; I892-L910 HydrophobicContact CD1-CD2 4.45Å; I892-L910 HydrophobicContact CG1-CD2 3.9Å; L895-L910 HydrophobicContact CD2-CD1 4.05Å; A906-L910 HydrophobicContact CB-CD1 4.3Å; A906-L910 PolarHBondContact O-N 2.91Å; L907-L910 PolarHBondContact O-N 3.25Å; L907-L910 VanDerWaalsContact O-N 3.16Å; L910-K912 VanDerWaalsContact C-N 3.27Å; L910-K912 PolarHBondContact O-N 3.06Å; L910-L913 HydrophobicContact CD2-CD1 4.16Å; L910-L913 VanDerWaalsContact O-CB 3.23Å; L910-L913 WeakPolarHBondContact O-CB 3.31Å; L910-L913 VanDerWaalsContact O-CG 3.27Å; L910-L913 WeakPolarHBondContact O-CG 3.37Å; L910-L913 PolarHBondContact O-N 3.15Å; L910-V921 HydrophobicContact CB-CG1 4.36Å; L910-V921 HydrophobicContact CD1-CG1 4.06Å; L910-V921 HydrophobicContact CD2-CG2 4.15Å
911	I	79.5	Confident	78.9	Confident	10 Å²	10	58 Å²	58	5%	0.051	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.7	-178	-62.5	156.7	0	0	0	112.5	L907 L913 L949 I952 S961	L907-I911 HydrophobicContact CD1-CD1 4.01Å; L907-I911 HydrophobicContact CD1-CG1 4.31Å; L907-I911 HydrophobicContact CG-CD1 3.8Å; L907-I911 WeakPolarHBondContact O-CD1 3.35Å; L907-I911 WeakPolarHBondContact O-CG1 3.31Å; L907-I911 PolarHBondContact O-N 2.83Å; L907-I911 VanDerWaalsContact O-N 3.14Å; I911-L913 PolarHBondContact O-N 3.43Å; I911-L949 HydrophobicContact CD1-CD2 3.18Å; I911-L949 HydrophobicContact CG1-CD2 4.18Å; I911-I952 HydrophobicContact CD1-CD1 3.58Å; I911-S961 VanDerWaalsContact CG2-O 3.31Å; I911-S961 WeakPolarHBondContact CG2-O 3.34Å
912	K	78.8	Confident	78.9	Confident	127 Å²	127	50.8 Å²	50.8	55%	0.552	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6	173.7	-68.4	-178.1	-177.9	-171.9	0	113.3	P908 K909 L910 K956	P908-K912 WeakPolarHBondContact O-CG 3.35Å; K909-K912 PolarHBondContact O-N 3.35Å; L910-K912 VanDerWaalsContact C-N 3.27Å; L910-K912 PolarHBondContact O-N 3.06Å; K912-K956 WeakPolarHBondContact CE-O 3.39Å; K912-K956 PolarHBondContact NZ-O 3.17Å
913	L	81.4	Confident	78.8	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.141	25%	0.25	C	S	.	.	S	Bend	trans	-75.2	174.6	177	-60.9	177.9	0	0	0	111.6	V888 R889 I892 L910 I911 V917 V918	V888-L913 HydrophobicContact CG1-CD1 4Å; V888-L913 HydrophobicContact CG1-CD2 4.18Å; V888-L913 HydrophobicContact CG1-CG 4.27Å; R889-L913 HydrophobicContact CG-CD1 4.22Å; R889-L913 HydrophobicContact CG-CD2 4.17Å; I892-L913 HydrophobicContact CD1-CD1 3.92Å; L910-L913 HydrophobicContact CD2-CD1 4.16Å; L910-L913 VanDerWaalsContact O-CB 3.23Å; L910-L913 WeakPolarHBondContact O-CB 3.31Å; L910-L913 VanDerWaalsContact O-CG 3.27Å; L910-L913 WeakPolarHBondContact O-CG 3.37Å; L910-L913 PolarHBondContact O-N 3.15Å; I911-L913 PolarHBondContact O-N 3.43Å; L913-V917 HydrophobicContact CB-CB 4.39Å; L913-V917 HydrophobicContact CB-CG1 4.35Å; L913-V917 HydrophobicContact CD1-CG1 3.93Å; L913-V918 HydrophobicContact CB-CG2 4.23Å
914	N	78.8	Confident	78.6	Confident	93 Å²	93	51 Å²	51	50%	0.497	25%	0.253	S	S	.	.			trans	-58.7	136.1	177.2	-176	-36.5	0	0	0	110.4	I916 V917 V918	N914-I916 PolarHBondContact O-N 3.4Å; N914-I916 PolarHBondContact OD1-N 3.12Å; N914-V917 HydrophobicContact CB-CG2 4.19Å; N914-V917 WeakPolarHBondContact O-CA 3.3Å; N914-V917 WeakPolarHBondContact O-CB 3.48Å; N914-V917 PolarHBondContact O-N 2.76Å; N914-V918 PolarHBondContact O-N 3.16Å
915	P	74.3	Confident	78.4	Confident	48 Å²	48	47.8 Å²	47.8	31%	0.312	24%	0.236	S	C	.	.	H	α-helix	trans	-46.5	-34.9	179.8	-31.4	33.3	0	0	0	116	V918 K919 K964	P915-V918 PolarHBondContact O-N 3.01Å; P915-K919 PolarHBondContact O-N 3.08Å; P915-K964 HydrophobicContact CG-CD 4.19Å; P915-K964 VanDerWaalsContact CG-CE 3.49Å
916	I	75	Confident	78	Confident	136 Å²	136	42.8 Å²	42.8	70%	0.697	21%	0.214	S	C	*	.	H	α-helix	trans	-66	-43.2	177.6	-61.1	171.1	0	0	0	110.7	N914 K919 E920	N914-I916 PolarHBondContact O-N 3.4Å; N914-I916 PolarHBondContact OD1-N 3.12Å; I916-K919 PolarHBondContact O-N 3.14Å; I916-E920 PolarHBondContact O-N 3.33Å
917	V	77.8	Confident	77.2	Confident	42 Å²	42	43.7 Å²	43.7	26%	0.255	22%	0.224	S	C	.	.	H	α-helix	trans	-69.5	-38.2	177.7	-177.2	0	0	0	0	110.4	I892 L913 N914 K919 E920 V921	I892-V917 HydrophobicContact CD1-CG1 3.64Å; L913-V917 HydrophobicContact CB-CB 4.39Å; L913-V917 HydrophobicContact CB-CG1 4.35Å; L913-V917 HydrophobicContact CD1-CG1 3.93Å; N914-V917 HydrophobicContact CB-CG2 4.19Å; N914-V917 WeakPolarHBondContact O-CA 3.3Å; N914-V917 WeakPolarHBondContact O-CB 3.48Å; N914-V917 PolarHBondContact O-N 2.76Å; V917-K919 VanDerWaalsContact C-N 3.33Å; V917-K919 PolarHBondContact O-N 3.43Å; V917-E920 WeakPolarHBondContact O-CB 2.95Å; V917-E920 PolarHBondContact O-N 3.34Å; V917-E920 VanDerWaalsContact O-N 3.16Å; V917-V921 VanDerWaalsContact O-CG2 3.31Å; V917-V921 WeakPolarHBondContact O-CG2 3.35Å; V917-V921 PolarHBondContact O-N 3.41Å
918	V	80.2	Confident	76.2	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-41.9	175.6	174.8	0	0	0	0	111.2	L913 N914 P915 E920 V921 F922 L968	L913-V918 HydrophobicContact CB-CG2 4.23Å; N914-V918 PolarHBondContact O-N 3.16Å; P915-V918 PolarHBondContact O-N 3.01Å; V918-E920 VanDerWaalsContact C-N 3.34Å; V918-E920 PolarHBondContact O-N 3.05Å; V918-V921 WeakPolarHBondContact O-CB 3.5Å; V918-V921 PolarHBondContact O-N 3.42Å; V918-F922 HydrophobicContact CG1-CD2 3.75Å; V918-F922 HydrophobicContact CG1-CE2 3.32Å; V918-F922 HydrophobicContact CG1-CZ 4.13Å; V918-F922 WeakPolarHBondContact O-CD2 3.36Å; V918-F922 PolarHBondContact O-N 3.06Å; V918-L968 HydrophobicContact CG1-CD1 4.2Å
919	K	77.8	Confident	74.9	Confident	105 Å²	105	50 Å²	50	46%	0.457	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-42.3	173.2	-172.2	-179.3	179.9	-179.2	0	111.9	P915 I916 V917 F922 N923	P915-K919 PolarHBondContact O-N 3.08Å; I916-K919 PolarHBondContact O-N 3.14Å; V917-K919 VanDerWaalsContact C-N 3.33Å; V917-K919 PolarHBondContact O-N 3.43Å; K919-F922 PolarHBondContact O-N 2.84Å; K919-N923 WeakPolarHBondContact O-CB 3.49Å; K919-N923 VanDerWaalsContact O-CG 3.25Å; K919-N923 PolarHBondContact O-N 3.45Å; K919-N923 PolarHBondContact O-OD1 2.91Å
920	E	77.4	Confident	73.6	Confident	61 Å²	61	47.7 Å²	47.7	29%	0.285	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-43.2	176.1	-168.4	-170.4	157.4	0	0	112.1	H861 I916 V917 V918 F922 N923 R924	H861-E920 IonicContact CE1-OE1 3.52Å; I916-E920 PolarHBondContact O-N 3.33Å; V917-E920 WeakPolarHBondContact O-CB 2.95Å; V917-E920 PolarHBondContact O-N 3.34Å; V917-E920 VanDerWaalsContact O-N 3.16Å; V918-E920 VanDerWaalsContact C-N 3.34Å; V918-E920 PolarHBondContact O-N 3.05Å; E920-F922 PolarHBondContact O-N 3.33Å; E920-N923 PolarHBondContact O-N 3.35Å; E920-R924 PolarHBondContact O-N 3.47Å; E920-R924 IonicContact OE1-CZ 3.81Å; E920-R924 IonicContact OE1-NE 2.78Å; E920-R924 PolarHBondContact OE1-NE 3.36Å; E920-R924 IonicContact OE1-NH2 2.64Å
921	V	79.6	Confident	71.8	Confident	3 Å²	3	51 Å²	51	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-47.6	175.7	167.1	0	0	0	0	110.7	I892 L895 L910 V917 V918 R924 L925	I892-V921 HydrophobicContact CD1-CG2 4.07Å; I892-V921 HydrophobicContact CG1-CG2 3.98Å; I892-V921 HydrophobicContact CG2-CG2 4.11Å; L895-V921 HydrophobicContact CD1-CB 4.39Å; L895-V921 HydrophobicContact CD1-CG1 3.86Å; L895-V921 HydrophobicContact CD1-CG2 4.29Å; L910-V921 HydrophobicContact CB-CG1 4.36Å; L910-V921 HydrophobicContact CD1-CG1 4.06Å; L910-V921 HydrophobicContact CD2-CG2 4.15Å; V917-V921 VanDerWaalsContact O-CG2 3.31Å; V917-V921 WeakPolarHBondContact O-CG2 3.35Å; V917-V921 PolarHBondContact O-N 3.41Å; V918-V921 WeakPolarHBondContact O-CB 3.5Å; V918-V921 PolarHBondContact O-N 3.42Å; V921-R924 PolarHBondContact O-N 3.45Å; V921-L925 HydrophobicContact CG1-CD1 3.9Å; V921-L925 HydrophobicContact CG1-CG 4.46Å; V921-L925 WeakPolarHBondContact O-CB 3.12Å; V921-L925 VanDerWaalsContact O-CG 3.3Å; V921-L925 WeakPolarHBondContact O-CG 3.47Å; V921-L925 PolarHBondContact O-N 2.78Å
922	F	78.4	Confident	70.2	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-42.1	175.9	-70.6	-48.4	0	0	0	112.3	V918 K919 E920 R924 L925 L926 L945 L949	V918-F922 HydrophobicContact CG1-CD2 3.75Å; V918-F922 HydrophobicContact CG1-CE2 3.32Å; V918-F922 HydrophobicContact CG1-CZ 4.13Å; V918-F922 WeakPolarHBondContact O-CD2 3.36Å; V918-F922 PolarHBondContact O-N 3.06Å; K919-F922 PolarHBondContact O-N 2.84Å; E920-F922 PolarHBondContact O-N 3.33Å; F922-R924 VanDerWaalsContact C-N 3.31Å; F922-R924 PolarHBondContact O-N 3.14Å; F922-L925 PolarHBondContact O-N 3.13Å; F922-L926 VanDerWaalsContact O-CB 3.26Å; F922-L926 WeakPolarHBondContact O-CB 3.39Å; F922-L926 WeakPolarHBondContact O-CG 3.38Å; F922-L926 PolarHBondContact O-N 2.7Å; F922-L945 HydrophobicContact CD1-CD1 4.43Å; F922-L945 HydrophobicContact CD1-CD2 3.68Å; F922-L945 HydrophobicContact CD1-CG 4.49Å; F922-L945 HydrophobicContact CE1-CD1 4.12Å; F922-L945 HydrophobicContact CE1-CD2 3.94Å; F922-L945 HydrophobicContact CE1-CG 4.3Å; F922-L949 HydrophobicContact CE1-CD1 4.25Å; F922-L949 HydrophobicContact CZ-CD1 4.19Å; F922-L949 HydrophobicContact CZ-CD2 4.3Å
923	N	76	Confident	68.5	Low	34 Å²	34	57.8 Å²	57.8	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-37.6	177.5	-74.9	-5.2	0	0	0	112.7	K919 E920 G927 T928 Q929	K919-N923 WeakPolarHBondContact O-CB 3.49Å; K919-N923 VanDerWaalsContact O-CG 3.25Å; K919-N923 PolarHBondContact O-N 3.45Å; K919-N923 PolarHBondContact O-OD1 2.91Å; E920-N923 PolarHBondContact O-N 3.35Å; N923-G927 PolarHBondContact O-N 2.64Å; N923-T928 VanDerWaalsContact CA-OG1 3.24Å; N923-T928 WeakPolarHBondContact CA-OG1 3.39Å; N923-T928 WeakPolarHBondContact CB-OG1 3.37Å; N923-T928 PolarHBondContact O-N 3Å; N923-T928 VanDerWaalsContact O-N 3.1Å; N923-T928 PolarHBondContact O-OG1 2.98Å; N923-Q929 HydrophobicContact CB-CG 4.08Å
924	R	75.9	Confident	66.5	Low	14 Å²	14	63.6 Å²	63.6	5%	0.053	37%	0.365	C	S	.	.	H	α-helix	trans	-68.1	-50.5	174.5	-76.8	-177.1	178.5	-113.6	-7	111	H861 T864 D865 P893 N896 E920 V921 F922 L926 G927 Q929	H861-R924 PolarHBondContact ND1-NH2 3.38Å; T864-R924 PolarHBondContact OG1-NH1 3.33Å; D865-R924 IonicContact OD1-NH2 3.88Å; P893-R924 PolarHBondContact O-NH1 2.79Å; N896-R924 PolarHBondContact ND2-O 3.33Å; N896-R924 PolarHBondContact OD1-O 2.98Å; E920-R924 PolarHBondContact O-N 3.47Å; E920-R924 IonicContact OE1-CZ 3.81Å; E920-R924 IonicContact OE1-NE 2.78Å; E920-R924 PolarHBondContact OE1-NE 3.36Å; E920-R924 IonicContact OE1-NH2 2.64Å; V921-R924 PolarHBondContact O-N 3.45Å; F922-R924 VanDerWaalsContact C-N 3.31Å; F922-R924 PolarHBondContact O-N 3.14Å; R924-L926 VanDerWaalsContact C-N 3.26Å; R924-L926 PolarHBondContact O-N 3.44Å; R924-G927 PolarHBondContact O-N 2.99Å; R924-Q929 HydrophobicContact CG-CG 4.43Å
925	L	75.6	Confident	64.9	Low	1 Å²	1	65.3 Å²	65.3	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-59.7	-34.1	177.4	-73.2	174	0	0	0	112.6	L895 V903 V921 F922 G927 S938 P939 L945	L895-L925 HydrophobicContact CB-CD2 4.13Å; L895-L925 HydrophobicContact CD1-CD2 4.45Å; L895-L925 HydrophobicContact CD1-CG 4.32Å; V903-L925 HydrophobicContact CG1-CD1 4.43Å; V903-L925 HydrophobicContact CG1-CD2 3.76Å; V921-L925 HydrophobicContact CG1-CD1 3.9Å; V921-L925 HydrophobicContact CG1-CG 4.46Å; V921-L925 WeakPolarHBondContact O-CB 3.12Å; V921-L925 VanDerWaalsContact O-CG 3.3Å; V921-L925 WeakPolarHBondContact O-CG 3.47Å; V921-L925 PolarHBondContact O-N 2.78Å; F922-L925 PolarHBondContact O-N 3.13Å; L925-G927 VanDerWaalsContact C-N 3.33Å; L925-S938 WeakPolarHBondContact O-CB 3.44Å; L925-S938 PolarHBondContact O-OG 3.39Å; L925-P939 HydrophobicContact CD2-CG 4.28Å; L925-L945 HydrophobicContact CD1-CD1 4.35Å
926	L	71.3	Confident	63.7	Low	45 Å²	45	64.6 Å²	64.6	24%	0.236	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.4	179.6	-63.6	171.1	0	0	0	113.2	F922 R924 T928 P942 L945	F922-L926 VanDerWaalsContact O-CB 3.26Å; F922-L926 WeakPolarHBondContact O-CB 3.39Å; F922-L926 WeakPolarHBondContact O-CG 3.38Å; F922-L926 PolarHBondContact O-N 2.7Å; R924-L926 VanDerWaalsContact C-N 3.26Å; R924-L926 PolarHBondContact O-N 3.44Å; L926-T928 HydrophobicContact CB-CG2 4.04Å; L926-T928 PolarHBondContact O-N 3.22Å; L926-P942 HydrophobicContact CD2-CB 4.18Å; L926-P942 HydrophobicContact CD2-CG 3.96Å; L926-L945 HydrophobicContact CD2-CD2 4.05Å; L926-L945 HydrophobicContact CG-CD2 4.35Å
927	G	64	Low	62.8	Low	24 Å²	24	65.9 Å²	65.9	25%	0.247	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	0.4	177.9	0	0	0	0	0	115.7	N923 R924 L925 Q929 H930	N923-G927 PolarHBondContact O-N 2.64Å; R924-G927 PolarHBondContact O-N 2.99Å; L925-G927 VanDerWaalsContact C-N 3.33Å; G927-Q929 PolarHBondContact O-N 2.9Å; G927-H930 PolarHBondContact O-N 3.35Å
928	T	58.4	Low	62.2	Low	77 Å²	77	66 Å²	66	47%	0.472	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-5.5	-172.3	58	0	0	0	0	116.3	N923 L926	N923-T928 VanDerWaalsContact CA-OG1 3.24Å; N923-T928 WeakPolarHBondContact CA-OG1 3.39Å; N923-T928 WeakPolarHBondContact CB-OG1 3.37Å; N923-T928 PolarHBondContact O-N 3Å; N923-T928 VanDerWaalsContact O-N 3.1Å; N923-T928 PolarHBondContact O-OG1 2.98Å; L926-T928 HydrophobicContact CB-CG2 4.04Å; L926-T928 PolarHBondContact O-N 3.22Å
929	Q	52.7	Low	61.4	Low	84 Å²	84	67 Å²	67	39%	0.393	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-18.3	-178.2	-65.5	-109.2	16.3	0	0	113.6	N923 R924 G927	N923-Q929 HydrophobicContact CB-CG 4.08Å; R924-Q929 HydrophobicContact CG-CG 4.43Å; G927-Q929 PolarHBondContact O-N 2.9Å
930	H	52.8	Low	61.1	Low	55 Å²	55	62.2 Å²	62.2	26%	0.255	38%	0.379	S	S	.	.	S	Bend	trans	-98.5	111.7	-177.5	-59.3	84.3	0	0	0	109.2	G927	G927-H930 PolarHBondContact O-N 3.35Å
931	G	43	Very low	60.9	Low	70 Å²	70	63 Å²	63	72%	0.722	39%	0.385	S	S	*	.			trans	-52.5	150.3	177.1	0	0	0	0	0	112.9	G933	G931-G933 PolarHBondContact O-N 3.45Å
932	E	44.6	Very low	60.4	Low	207 Å²	207	67 Å²	67	97%	0.967	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-25.2	116.1	-176	-62.9	176.2	160.9	0	0	115.1
933	G	42.9	Very low	59.9	Low	72 Å²	72	68.2 Å²	68.2	74%	0.742	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	148.9	-37.8	160.3	0	0	0	0	0	116.8	G931	G931-G933 PolarHBondContact O-N 3.45Å
934	N	40.3	Very low	59.9	Low	149 Å²	149	69.5 Å²	69.5	80%	0.797	43%	0.431	S	S	*	.			trans	-127.3	104.9	-177.4	-85.7	-0.5	0	0	0	111	A936	N934-A936 VanDerWaalsContact C-N 3.3Å; N934-A936 PolarHBondContact O-N 2.95Å
935	S	45.9	Very low	59.9	Low	129 Å²	129	69.4 Å²	69.4	90%	0.902	43%	0.431	S	S	*	.			trans	-57.7	91.2	166	-69.1	0	0	0	0	110	L937	S935-L937 PolarHBondContact O-N 3.26Å
936	A	47.7	Very low	59.6	Low	33 Å²	33	73.5 Å²	73.5	27%	0.273	45%	0.453	S	S	.	.			trans	-60.7	127.9	163.8	0	0	0	0	0	107.8	N934 S938	N934-A936 VanDerWaalsContact C-N 3.3Å; N934-A936 PolarHBondContact O-N 2.95Å; A936-S938 PolarHBondContact O-N 3.08Å
937	L	56.6	Low	59.9	Low	164 Å²	164	76.2 Å²	76.2	86%	0.859	47%	0.466	S	S	*	.			trans	-52.1	96.2	177.9	-75.3	144.9	0	0	0	110.1	S935	S935-L937 PolarHBondContact O-N 3.26Å
938	S	64.3	Low	60.2	Low	45 Å²	45	75.7 Å²	75.7	32%	0.315	46%	0.459	S	S	.	.			trans	-73.5	136	170	164.9	0	0	0	0	109.4	L925 A936 L940	L925-S938 WeakPolarHBondContact O-CB 3.44Å; L925-S938 PolarHBondContact O-OG 3.39Å; A936-S938 PolarHBondContact O-N 3.08Å; S938-L940 PolarHBondContact O-N 3.19Å; S938-L940 PolarHBondContact OG-N 3.32Å; S938-L940 PolarHBondContact OG-O 2.89Å
939	P	65.2	Low	60.9	Low	25 Å²	25	72.1 Å²	72.1	16%	0.162	44%	0.438	C	S	.	.	S	Bend	trans	-71.6	-12.3	178.2	29	-35.4	0	0	0	114	L898 V903 L925	L898-P939 WeakPolarHBondContact O-CB 3.26Å; V903-P939 HydrophobicContact CG2-CB 4.41Å; V903-P939 HydrophobicContact CG2-CG 4.19Å; L925-P939 HydrophobicContact CD2-CG 4.28Å
940	L	70.8	Confident	61.8	Low	6 Å²	6	75 Å²	75	3%	0.031	45%	0.45	C	S	.	.	S	Bend	trans	-141.7	132.7	-177.5	-73.2	173	0	0	0	111.7	K900 V903 S938 E944 L945	K900-L940 HydrophobicContact CD-CD2 4.21Å; K900-L940 HydrophobicContact CG-CD2 3.84Å; V903-L940 HydrophobicContact CB-CD1 4.29Å; V903-L940 HydrophobicContact CG1-CD1 3.54Å; V903-L940 HydrophobicContact CG1-CG 4.47Å; S938-L940 PolarHBondContact O-N 3.19Å; S938-L940 PolarHBondContact OG-N 3.32Å; S938-L940 PolarHBondContact OG-O 2.89Å; L940-E944 HydrophobicContact CD2-CB 4.16Å; L940-L945 HydrophobicContact CD1-CD1 4.18Å
941	N	72.3	Confident	62.7	Low	78 Å²	78	78 Å²	78	42%	0.417	47%	0.469	S	S	.	.			trans	-80	160	169.7	83	40.7	0	0	0	111.4	G943 E944 L945	N941-G943 VanDerWaalsContact C-N 3.27Å; N941-G943 PolarHBondContact O-N 3.01Å; N941-G943 WeakPolarHBondContact OD1-CA 3.46Å; N941-G943 PolarHBondContact OD1-N 3.37Å; N941-E944 WeakPolarHBondContact ND2-CG 3.05Å; N941-E944 PolarHBondContact O-N 3.05Å; N941-E944 VanDerWaalsContact O-N 3.14Å; N941-E944 WeakPolarHBondContact OD1-CG 3.48Å; N941-E944 PolarHBondContact OD1-N 3.35Å; N941-L945 PolarHBondContact O-N 2.89Å
942	P	70.3	Confident	64.2	Low	87 Å²	87	75.6 Å²	75.6	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-55.1	-36.9	-179.3	-24.4	31	0	0	0	114.5	L926 L946	L926-P942 HydrophobicContact CD2-CB 4.18Å; L926-P942 HydrophobicContact CD2-CG 3.96Å; P942-L946 WeakPolarHBondContact O-CG 3.44Å; P942-L946 PolarHBondContact O-N 3.31Å
943	G	68.3	Low	64.9	Low	34 Å²	34	69.7 Å²	69.7	35%	0.351	41%	0.414	S	S	.	.	H	α-helix	trans	-71.4	-39.3	177.3	0	0	0	0	0	113.3	N941 L945 L946 I947	N941-G943 VanDerWaalsContact C-N 3.27Å; N941-G943 PolarHBondContact O-N 3.01Å; N941-G943 WeakPolarHBondContact OD1-CA 3.46Å; N941-G943 PolarHBondContact OD1-N 3.37Å; G943-L945 VanDerWaalsContact C-N 3.34Å; G943-L946 PolarHBondContact O-N 3.24Å; G943-I947 WeakPolarHBondContact O-CD1 3.5Å; G943-I947 VanDerWaalsContact O-CG1 3.24Å; G943-I947 WeakPolarHBondContact O-CG1 3.44Å; G943-I947 PolarHBondContact O-N 3.26Å
944	E	75.1	Confident	65.6	Low	61 Å²	61	70.2 Å²	70.2	29%	0.285	41%	0.406	S	S	.	.	H	α-helix	trans	-67.8	-34.8	176.2	-72.5	179.4	167.2	0	0	112.2	K900 L940 N941 A948	K900-E944 WeakPolarHBondContact CE-OE2 3.3Å; K900-E944 IonicContact NZ-OE1 2.95Å; K900-E944 PolarHBondContact NZ-OE1 3.16Å; K900-E944 IonicContact NZ-OE2 2.77Å; K900-E944 PolarHBondContact NZ-OE2 2.98Å; L940-E944 HydrophobicContact CD2-CB 4.16Å; N941-E944 WeakPolarHBondContact ND2-CG 3.05Å; N941-E944 PolarHBondContact O-N 3.05Å; N941-E944 VanDerWaalsContact O-N 3.14Å; N941-E944 WeakPolarHBondContact OD1-CG 3.48Å; N941-E944 PolarHBondContact OD1-N 3.35Å; E944-A948 VanDerWaalsContact O-CB 3.26Å; E944-A948 WeakPolarHBondContact O-CB 3.42Å; E944-A948 PolarHBondContact O-N 3Å
945	L	75.8	Confident	66.4	Low	11 Å²	11	69.1 Å²	69.1	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-65	-45.1	173.5	-178.9	64.5	0	0	0	111.3	L907 F922 L925 L926 L940 N941 G943 A948 L949	L907-L945 HydrophobicContact CD1-CD1 4.21Å; L907-L945 HydrophobicContact CD2-CD1 4.25Å; F922-L945 HydrophobicContact CD1-CD1 4.43Å; F922-L945 HydrophobicContact CD1-CD2 3.68Å; F922-L945 HydrophobicContact CD1-CG 4.49Å; F922-L945 HydrophobicContact CE1-CD1 4.12Å; F922-L945 HydrophobicContact CE1-CD2 3.94Å; F922-L945 HydrophobicContact CE1-CG 4.3Å; L925-L945 HydrophobicContact CD1-CD1 4.35Å; L926-L945 HydrophobicContact CD2-CD2 4.05Å; L926-L945 HydrophobicContact CG-CD2 4.35Å; L940-L945 HydrophobicContact CD1-CD1 4.18Å; N941-L945 PolarHBondContact O-N 2.89Å; G943-L945 VanDerWaalsContact C-N 3.34Å; L945-A948 PolarHBondContact O-N 3.48Å; L945-L949 HydrophobicContact CG-CD1 4.36Å; L945-L949 VanDerWaalsContact O-CG 3.26Å; L945-L949 WeakPolarHBondContact O-CG 3.22Å; L945-L949 PolarHBondContact O-N 3.22Å
946	L	70.2	Confident	66.9	Low	88 Å²	88	69.5 Å²	69.5	46%	0.461	39%	0.39	S	S	.	.	H	α-helix	trans	-61.9	-43.1	175.6	-72.5	168.6	0	0	0	111.8	P942 G943 A948 L949 H950	P942-L946 WeakPolarHBondContact O-CG 3.44Å; P942-L946 PolarHBondContact O-N 3.31Å; G943-L946 PolarHBondContact O-N 3.24Å; L946-A948 VanDerWaalsContact C-N 3.34Å; L946-A948 PolarHBondContact O-N 3.36Å; L946-L949 PolarHBondContact O-N 2.98Å; L946-H950 WeakPolarHBondContact O-CB 3.43Å; L946-H950 PolarHBondContact O-N 2.75Å
947	I	76.5	Confident	67.2	Low	102 Å²	102	68 Å²	68	52%	0.523	38%	0.378	S	S	.	.	H	α-helix	trans	-62.1	-43.1	174.5	-67.2	163.7	0	0	0	110.8	G943 L949 H950 N951	G943-I947 WeakPolarHBondContact O-CD1 3.5Å; G943-I947 VanDerWaalsContact O-CG1 3.24Å; G943-I947 WeakPolarHBondContact O-CG1 3.44Å; G943-I947 PolarHBondContact O-N 3.26Å; I947-L949 VanDerWaalsContact C-N 3.34Å; I947-L949 PolarHBondContact O-N 3.14Å; I947-H950 PolarHBondContact O-N 3.22Å; I947-N951 WeakPolarHBondContact CG2-ND2 3.35Å; I947-N951 WeakPolarHBondContact O-CB 3.39Å; I947-N951 VanDerWaalsContact O-CG 3.3Å; I947-N951 PolarHBondContact O-N 3.32Å; I947-N951 PolarHBondContact O-ND2 2.88Å; I947-N951 VanDerWaalsContact O-ND2 3.15Å
948	A	70.9	Confident	67.2	Low	12 Å²	12	66.2 Å²	66.2	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-36.6	178.3	0	0	0	0	0	112.3	I904 L907 E944 L945 L946 I952	I904-A948 HydrophobicContact CG1-CB 4.26Å; L907-A948 HydrophobicContact CD2-CB 3.85Å; E944-A948 VanDerWaalsContact O-CB 3.26Å; E944-A948 WeakPolarHBondContact O-CB 3.42Å; E944-A948 PolarHBondContact O-N 3Å; L945-A948 PolarHBondContact O-N 3.48Å; L946-A948 VanDerWaalsContact C-N 3.34Å; L946-A948 PolarHBondContact O-N 3.36Å; A948-I952 VanDerWaalsContact O-CG1 3.22Å; A948-I952 WeakPolarHBondContact O-CG1 3.26Å
949	L	73.4	Confident	66.7	Low	3 Å²	3	70.4 Å²	70.4	2%	0.016	39%	0.386	C	S	.	.	H	α-helix	trans	-66.1	-42.7	174.1	-72.5	171.3	0	0	0	112.1	L907 I911 F922 L945 L946 I947 N951 I952	L907-L949 HydrophobicContact CD2-CD2 4.13Å; L907-L949 HydrophobicContact CD2-CG 4.42Å; L907-L949 HydrophobicContact CG-CD2 4.38Å; I911-L949 HydrophobicContact CD1-CD2 3.18Å; I911-L949 HydrophobicContact CG1-CD2 4.18Å; F922-L949 HydrophobicContact CE1-CD1 4.25Å; F922-L949 HydrophobicContact CZ-CD1 4.19Å; F922-L949 HydrophobicContact CZ-CD2 4.3Å; L945-L949 HydrophobicContact CG-CD1 4.36Å; L945-L949 VanDerWaalsContact O-CG 3.26Å; L945-L949 WeakPolarHBondContact O-CG 3.22Å; L945-L949 PolarHBondContact O-N 3.22Å; L946-L949 PolarHBondContact O-N 2.98Å; I947-L949 VanDerWaalsContact C-N 3.34Å; I947-L949 PolarHBondContact O-N 3.14Å; L949-N951 VanDerWaalsContact C-N 3.34Å; L949-I952 HydrophobicContact CD2-CD1 4.2Å; L949-I952 WeakPolarHBondContact O-CG1 3.48Å; L949-I952 PolarHBondContact O-N 3.38Å
950	H	70.9	Confident	66.2	Low	143 Å²	143	77.8 Å²	77.8	66%	0.662	42%	0.415	S	S	*	.	H	α-helix	trans	-69.3	-31.7	-179.8	-164.9	78.7	0	0	0	112.8	L946 I947 I952	L946-H950 WeakPolarHBondContact O-CB 3.43Å; L946-H950 PolarHBondContact O-N 2.75Å; I947-H950 PolarHBondContact O-N 3.22Å; H950-I952 VanDerWaalsContact C-N 3.29Å; H950-I952 PolarHBondContact O-N 3.17Å
951	N	72.1	Confident	65.6	Low	120 Å²	120	79.2 Å²	79.2	64%	0.642	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	3.9	178	-70.6	-31	0	0	0	113.9	I947 L949 D953	I947-N951 WeakPolarHBondContact CG2-ND2 3.35Å; I947-N951 WeakPolarHBondContact O-CB 3.39Å; I947-N951 VanDerWaalsContact O-CG 3.3Å; I947-N951 PolarHBondContact O-N 3.32Å; I947-N951 PolarHBondContact O-ND2 2.88Å; I947-N951 VanDerWaalsContact O-ND2 3.15Å; L949-N951 VanDerWaalsContact C-N 3.34Å; N951-D953 PolarHBondContact O-N 2.93Å
952	I	73.1	Confident	64.9	Low	19 Å²	19	76.7 Å²	76.7	10%	0.097	41%	0.412	C	S	.	.	S	Bend	trans	-70.9	118.1	174.2	-59.2	-178.9	0	0	0	108.7	L907 P908 I911 A948 L949 H950 S954 C957	L907-I952 HydrophobicContact CD2-CD1 4.3Å; L907-I952 HydrophobicContact CG-CD1 4.27Å; P908-I952 HydrophobicContact CB-CG2 4.16Å; P908-I952 HydrophobicContact CG-CD1 4.25Å; P908-I952 HydrophobicContact CG-CG1 4.38Å; P908-I952 HydrophobicContact CG-CG2 4.13Å; I911-I952 HydrophobicContact CD1-CD1 3.58Å; A948-I952 VanDerWaalsContact O-CG1 3.22Å; A948-I952 WeakPolarHBondContact O-CG1 3.26Å; L949-I952 HydrophobicContact CD2-CD1 4.2Å; L949-I952 WeakPolarHBondContact O-CG1 3.48Å; L949-I952 PolarHBondContact O-N 3.38Å; H950-I952 VanDerWaalsContact C-N 3.29Å; H950-I952 PolarHBondContact O-N 3.17Å; I952-S954 PolarHBondContact O-N 3.49Å; I952-C957 HydrophobicContact CG2-CB 4.06Å
953	D	60.8	Low	64.2	Low	82 Å²	82	77.2 Å²	77.2	44%	0.439	41%	0.409	S	S	.	.			trans	-54	123.4	177.4	-167.7	-3.8	0	0	0	111.7	N951 V955 K956	N951-D953 PolarHBondContact O-N 2.93Å; D953-V955 PolarHBondContact O-N 2.89Å; D953-K956 HydrophobicContact CB-CD 4.29Å; D953-K956 HydrophobicContact CB-CG 4.43Å; D953-K956 PolarHBondContact O-N 3.01Å
954	S	57.3	Low	63.6	Low	83 Å²	83	81.3 Å²	81.3	58%	0.58	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.4	-175.9	62.6	0	0	0	0	114.3	I952	I952-S954 PolarHBondContact O-N 3.49Å
955	V	56.8	Low	62.5	Low	127 Å²	127	78.6 Å²	78.6	77%	0.77	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-22.6	175.4	-173.6	0	0	0	0	112.1	D953	D953-V955 PolarHBondContact O-N 2.89Å
956	K	55.7	Low	61.4	Low	136 Å²	136	82.1 Å²	82.1	59%	0.591	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-17.3	-175.1	-67.7	177.8	-174.7	167.3	0	113.5	K912 D953	K912-K956 WeakPolarHBondContact CE-O 3.39Å; K912-K956 PolarHBondContact NZ-O 3.17Å; D953-K956 HydrophobicContact CB-CD 4.29Å; D953-K956 HydrophobicContact CB-CG 4.43Å; D953-K956 PolarHBondContact O-N 3.01Å
957	C	54.3	Low	60.3	Low	3 Å²	3	81.9 Å²	81.9	2%	0.02	43%	0.433	C	S	.	.	S	Bend	trans	-151.8	132.9	-180	-152.9	0	0	0	0	111.6	I952 I962	I952-C957 HydrophobicContact CG2-CB 4.06Å; C957-I962 HydrophobicContact CB-CD1 4.39Å; C957-I962 HydrophobicContact CB-CG1 4.43Å
958	D	56.5	Low	58.9	Low	125 Å²	125	79.3 Å²	79.3	67%	0.668	42%	0.42	S	S	*	.			trans	-62	137.4	-179.2	-71.9	-16.5	0	0	0	111.7	K960 S961 I962	D958-K960 PolarHBondContact O-N 3.27Å; D958-S961 WeakPolarHBondContact O-CB 3.47Å; D958-S961 PolarHBondContact O-N 3.28Å; D958-I962 PolarHBondContact O-N 3.34Å
959	M	54.7	Low	57.6	Low	134 Å²	134	82.4 Å²	82.4	66%	0.66	44%	0.438	S	S	*	.	H	α-helix	trans	-54.9	-29.7	-177.9	-157.3	174.1	-82.5	0	0	112.9	S961 I962 I963	M959-S961 VanDerWaalsContact C-N 3.35Å; M959-S961 PolarHBondContact O-N 3.45Å; M959-I962 PolarHBondContact O-N 3.22Å; M959-I963 HydrophobicContact CG-CD1 4.16Å; M959-I963 WeakPolarHBondContact O-CB 3.22Å; M959-I963 WeakPolarHBondContact O-CD1 3.34Å; M959-I963 WeakPolarHBondContact O-CG1 3.24Å; M959-I963 PolarHBondContact O-N 3.23Å
960	K	54.8	Low	55.8	Low	180 Å²	180	85.5 Å²	85.5	78%	0.783	46%	0.459	S	S	*	.	H	α-helix	trans	-63.7	-34.4	173.3	-76.3	-177.8	178.2	176	0	113.6	D958 K964	D958-K960 PolarHBondContact O-N 3.27Å; K960-K964 VanDerWaalsContact O-CB 3.27Å; K960-K964 WeakPolarHBondContact O-CB 3.42Å; K960-K964 PolarHBondContact O-N 3.48Å; K960-K964 VanDerWaalsContact O-N 3.16Å
961	S	57.1	Low	54	Low	36 Å²	36	88.4 Å²	88.4	25%	0.252	47%	0.472	S	S	.	.	H	α-helix	trans	-77.1	-34	-179.8	-56	0	0	0	0	111.4	I911 D958 M959 G965	I911-S961 VanDerWaalsContact CG2-O 3.31Å; I911-S961 WeakPolarHBondContact CG2-O 3.34Å; D958-S961 WeakPolarHBondContact O-CB 3.47Å; D958-S961 PolarHBondContact O-N 3.28Å; M959-S961 VanDerWaalsContact C-N 3.35Å; M959-S961 PolarHBondContact O-N 3.45Å; S961-G965 PolarHBondContact O-N 3.08Å; S961-G965 VanDerWaalsContact O-N 3.1Å
962	I	57.5	Low	52	Low	24 Å²	24	87.6 Å²	87.6	12%	0.123	48%	0.476	C	S	.	.	H	α-helix	trans	-68	-49.5	175.1	-60.8	172.3	0	0	0	110.3	C957 D958 M959 K964 G965 E966	C957-I962 HydrophobicContact CB-CD1 4.39Å; C957-I962 HydrophobicContact CB-CG1 4.43Å; D958-I962 PolarHBondContact O-N 3.34Å; M959-I962 PolarHBondContact O-N 3.22Å; I962-K964 VanDerWaalsContact C-N 3.27Å; I962-K964 PolarHBondContact O-N 3.2Å; I962-G965 WeakPolarHBondContact O-CA 3.23Å; I962-G965 PolarHBondContact O-N 3.48Å; I962-E966 PolarHBondContact O-N 2.92Å
963	I	55.8	Low	49.8	Very low	99 Å²	99	92.2 Å²	92.2	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-60.1	-37.7	177	-66.9	164.7	0	0	0	111.4	M959 G965 A967	M959-I963 HydrophobicContact CG-CD1 4.16Å; M959-I963 WeakPolarHBondContact O-CB 3.22Å; M959-I963 WeakPolarHBondContact O-CD1 3.34Å; M959-I963 WeakPolarHBondContact O-CG1 3.24Å; M959-I963 PolarHBondContact O-N 3.23Å; I963-G965 VanDerWaalsContact C-N 3.34Å; I963-A967 WeakPolarHBondContact O-CB 3.26Å; I963-A967 PolarHBondContact O-N 3.03Å; I963-A967 VanDerWaalsContact O-N 3.16Å
964	K	56.8	Low	48.2	Very low	119 Å²	119	92.2 Å²	92.2	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-29.8	177.2	-159.3	171	-170.9	174.9	0	112.5	P915 K960 I962 L968	P915-K964 HydrophobicContact CG-CD 4.19Å; P915-K964 VanDerWaalsContact CG-CE 3.49Å; K960-K964 VanDerWaalsContact O-CB 3.27Å; K960-K964 WeakPolarHBondContact O-CB 3.42Å; K960-K964 PolarHBondContact O-N 3.48Å; K960-K964 VanDerWaalsContact O-N 3.16Å; I962-K964 VanDerWaalsContact C-N 3.27Å; I962-K964 PolarHBondContact O-N 3.2Å; K964-L968 WeakPolarHBondContact O-CD1 3.37Å; K964-L968 VanDerWaalsContact O-CG 3.27Å; K964-L968 WeakPolarHBondContact O-CG 3.46Å
965	G	52	Low	46.7	Very low	4 Å²	4	96.8 Å²	96.8	4%	0.041	55%	0.546	C	S	.	.	H	α-helix	trans	-73.8	-39.4	173.6	0	0	0	0	0	113.4	S961 I962 I963 A967	S961-G965 PolarHBondContact O-N 3.08Å; S961-G965 VanDerWaalsContact O-N 3.1Å; I962-G965 WeakPolarHBondContact O-CA 3.23Å; I962-G965 PolarHBondContact O-N 3.48Å; I963-G965 VanDerWaalsContact C-N 3.34Å; G965-A967 VanDerWaalsContact C-N 3.31Å; G965-A967 PolarHBondContact O-N 2.75Å
966	E	53.1	Low	45.3	Very low	85 Å²	85	95 Å²	95	40%	0.397	54%	0.544	S	S	.	.	H	α-helix	trans	-65.3	-30.8	172.9	-88.1	178	154.9	0	0	113	I962 L968 P969	I962-E966 PolarHBondContact O-N 2.92Å; E966-L968 PolarHBondContact O-N 3.11Å; E966-P969 WeakPolarHBondContact O-CD 3.4Å
967	A	46.9	Very low	44.1	Very low	84 Å²	84	94.5 Å²	94.5	69%	0.694	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-1.8	-178.1	0	0	0	0	0	115.4	I963 G965 P969	I963-A967 WeakPolarHBondContact O-CB 3.26Å; I963-A967 PolarHBondContact O-N 3.03Å; I963-A967 VanDerWaalsContact O-N 3.16Å; G965-A967 VanDerWaalsContact C-N 3.31Å; G965-A967 PolarHBondContact O-N 2.75Å; A967-P969 VanDerWaalsContact C-CD 3.48Å
968	L	47.2	Very low	42.9	Very low	48 Å²	48	99.1 Å²	99.1	25%	0.251	59%	0.594	S	S	.	*			trans	-99.9	-4.3	-172.4	-84.8	167	0	0	0	119	V918 K964 E966	V918-L968 HydrophobicContact CG1-CD1 4.2Å; K964-L968 WeakPolarHBondContact O-CD1 3.37Å; K964-L968 VanDerWaalsContact O-CG 3.27Å; K964-L968 WeakPolarHBondContact O-CG 3.46Å; E966-L968 PolarHBondContact O-N 3.11Å
969	P	42.8	Very low	41.5	Very low	76 Å²	76	99.9 Å²	99.9	49%	0.494	60%	0.603	S	S	.	*	S	Bend	trans	-66.7	142.3	-179.8	25.7	-29.9	0	0	0	111.5	E966 A967 H971	E966-P969 WeakPolarHBondContact O-CD 3.4Å; A967-P969 VanDerWaalsContact C-CD 3.48Å; P969-H971 PolarHBondContact O-N 2.75Å
970	P	36	Very low	40.6	Very low	68 Å²	68	99.5 Å²	99.5	44%	0.442	61%	0.61	S	S	.	*			trans	-67.8	128.5	173.9	27.4	-30.7	0	0	0	109.5	S972	P970-S972 PolarHBondContact O-N 3.15Å
971	H	33.8	Very low	39.2	Very low	204 Å²	204	94.3 Å²	94.3	94%	0.944	61%	0.608	S	S	*	*			trans	-54.2	106.6	167.1	-77.6	-77.6	0	0	0	109.7	P969	P969-H971 PolarHBondContact O-N 2.75Å
972	S	28.3	Very low	37.8	Very low	104 Å²	104	102.1 Å²	102.1	73%	0.727	64%	0.641	S	S	*	*			trans	-100.7	108.4	165.3	57.2	0	0	0	0	109.9	P970	P970-S972 PolarHBondContact O-N 3.15Å
973	S	28.6	Very low	36.3	Very low	116 Å²	116	108.3 Å²	108.3	81%	0.811	67%	0.674	S	S	*	*			trans	70.9	121.9	145	42.6	0	0	0	0	120.2
974	G	26.6	Very low	35	Very low	81 Å²	81	111.1 Å²	111.1	84%	0.835	69%	0.689	S	S	*	*			trans	-64.2	140.1	175.8	0	0	0	0	0	114
975	L	25.8	Very low	33.6	Very low	179 Å²	179	109.8 Å²	109.8	94%	0.937	70%	0.695	S	S	*	*			trans	-90	107.9	157.3	-88.3	146.4	0	0	0	107.1
976	A	27.7	Very low	32.5	Very low	89 Å²	89	118.6 Å²	118.6	74%	0.736	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-92.1	142.6	160.2	0	0	0	0	0	108.8
977	P	30.4	Very low	32.2	Very low	127 Å²	127	119.1 Å²	119.1	83%	0.825	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-81	156.6	-171.9	33.8	-34.1	0	0	0	112.3
978	A	27.6	Very low	31.3	Very low	99 Å²	99	124.3 Å²	124.3	82%	0.818	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-66.4	140.7	178.4	0	0	0	0	0	113.6
979	T	27.6	Very low	30.1	Very low	141 Å²	141	126.1 Å²	126.1	87%	0.865	78%	0.777	S	S	*	*			trans	-147.7	152.8	147.9	37	0	0	0	0	110.4
980	P	35.3	Very low	30.2	Very low	126 Å²	126	127.6 Å²	127.6	82%	0.818	79%	0.786	S	S	*	*			trans	-105	154.1	-155.9	37.9	-29.9	0	0	0	115.1
981	G	26.7	Very low	29.6	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	81%	0.805	S	S	*	*			trans	77.5	116.9	144.7	0	0	0	0	0	118.7
982	Q	28.3	Very low	29.1	Very low	201 Å²	201	124.2 Å²	124.2	94%	0.939	79%	0.792	S	S	*	*				179.8	150.4	119.4	-99.5	177.2	-7.5	0	0	112
983	D	25.8	Very low	29	Very low	153 Å²	153	126.6 Å²	126.6	82%	0.818	80%	0.795	S	S	*	*			trans	-72.9	174	-170.8	-70	-58.6	0	0	0	116.2
984	L	28.6	Very low	28.7	Very low	159 Å²	159	126.2 Å²	126.2	83%	0.832	79%	0.791	S	S	*	*			trans	104.5	107.5	145.2	-75.7	156.6	0	0	0	120
985	S	26.5	Very low	28.5	Very low	91 Å²	91	130.4 Å²	130.4	64%	0.636	79%	0.789	S	S	*	*				75.9	118.3	123.6	66	0	0	0	0	122.6
986	H	28	Very low	28.6	Very low	189 Å²	189	127.3 Å²	127.3	88%	0.875	78%	0.777	S	S	*	*			trans	76.5	147	136.3	-81.5	-64	0	0	0	122.6
987	P	48	Very low	28.4	Very low	95 Å²	95	132.6 Å²	132.6	62%	0.617	78%	0.783	S	S	*	*			trans	-102	163	-161.1	40.9	-34.6	0	0	0	112.8
988	H	27.5	Very low	28.1	Very low	194 Å²	194	133 Å²	133	90%	0.898	78%	0.778	S	S	*	*			trans	-169.6	133.8	143.4	-96.9	-63.4	0	0	0	110.6
989	A	23.3	Very low	27.9	Very low	86 Å²	86	132.7 Å²	132.7	71%	0.711	77%	0.769	S	S	*	*			trans	-77.2	-170.6	161.3	0	0	0	0	0	109.8
990	P	43.1	Very low	27.6	Very low	106 Å²	106	134.1 Å²	134.1	69%	0.688	77%	0.766	S	S	*	*			cis	-138.8	-165	-11.9	33.7	-10.7	0	0	0	113.6
991	T	24.8	Very low	27	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	76%	0.763	S	S	*	*			trans	78.7	137.5	145.7	38.3	0	0	0	0	122.8
992	G	23.6	Very low	26.9	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	77%	0.769	S	S	*	*			trans	123.5	89.5	145.5	0	0	0	0	0	115
993	I	24.4	Very low	27.8	Very low	154 Å²	154	133.8 Å²	133.8	79%	0.79	76%	0.755	S	S	*	*				83.8	119.9	85.1	-73	169.8	0	0	0	113.6
994	C	23	Very low	27.7	Very low	109 Å²	109	134 Å²	134	74%	0.736	75%	0.751	S	S	*	*			trans	54.6	148.6	149.9	-68.4	0	0	0	0	118.3
995	Q	23	Very low	27.6	Very low	169 Å²	169	133.4 Å²	133.4	79%	0.79	75%	0.747	S	S	*	*			cis	-172.8	146.9	28.3	-136.6	167.1	32.3	0	0	109.5
996	V	26.9	Very low	27.5	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.685	76%	0.76	S	S	*	*			trans	18.3	127.9	137.1	-170.4	0	0	0	0	119.2
997	K	24.1	Very low	27.4	Very low	201 Å²	201	135.5 Å²	135.5	87%	0.874	75%	0.751	S	S	*	*			trans	-163.9	103.9	136.5	-112.7	170.2	-176.8	178.1	0	113.5
998	D	23.7	Very low	26.3	Very low	134 Å²	134	139.3 Å²	139.3	72%	0.717	77%	0.766	S	S	*	*				30.9	129.2	126.5	-69.4	-32.8	0	0	0	122.7
999	C	23.1	Very low	26.1	Very low	93 Å²	93	138.6 Å²	138.6	63%	0.628	76%	0.763	S	S	*	*				95.8	132.3	120.7	-85.6	0	0	0	0	122.6
1000	H	23.1	Very low	26.2	Very low	172 Å²	172	139.3 Å²	139.3	80%	0.796	76%	0.762	S	S	*	*			trans	73.2	138.3	150.4	-63.4	-42.8	0	0	0	115.7
1001	S	22.6	Very low	25.3	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	77%	0.77	S	S	*	*			cis	-176	148.1	17.5	23.1	0	0	0	0	108
1002	Q	24.3	Very low	25.3	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	77%	0.771	S	S	*	*			trans	-58.6	178.8	156.2	-85.3	-176	-21.4	0	0	110.9
1003	P	45.7	Very low	25.6	Very low	98 Å²	98	146.6 Å²	146.6	64%	0.636	78%	0.775	S	S	*	*			cis	-148.5	-168.2	19.3	23.5	6.1	0	0	0	116.5
1004	H	25	Very low	26.4	Very low	158 Å²	158	144.8 Å²	144.8	73%	0.731	77%	0.773	S	S	*	*			trans	109.1	110.8	152	-73.2	-75.7	0	0	0	117.4
1005	L	25.7	Very low	26.4	Very low	146 Å²	146	144.7 Å²	144.7	76%	0.764	77%	0.773	S	S	*	*				74.4	112.6	69.3	-102.1	157.8	0	0	0	115.2
1006	R	24.7	Very low	26.5	Very low	241 Å²	241	143.5 Å²	143.5	91%	0.909	77%	0.771	S	S	*	*			trans	170.9	109.1	142	-97.3	173.4	-177.4	-176.3	1.7	106.9
1007	A	26.3	Very low	26.5	Very low	83 Å²	83	146.3 Å²	146.3	69%	0.686	78%	0.782	S	S	*	*				54.7	106.1	69.6	0	0	0	0	0	113.2
1008	L	24.7	Very low	26.5	Very low	176 Å²	176	145 Å²	145	92%	0.921	78%	0.777	S	S	*	*			trans	-163.3	118.6	135.5	-126.3	105.3	0	0	0	110.5
1009	E	23.5	Very low	26.6	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	78%	0.784	S	S	*	*			trans	-73.1	153.1	163	-64.9	167.9	131.7	0	0	110.5
1010	S	24.5	Very low	26.9	Very low	101 Å²	101	147 Å²	147	71%	0.706	79%	0.785	S	S	*	*			trans	-173.8	110.3	137	58.2	0	0	0	0	113.1
1011	H	25.2	Very low	27.4	Very low	182 Å²	182	144.6 Å²	144.6	84%	0.843	79%	0.785	S	S	*	*				51	115.1	129.6	-60.8	-68	0	0	0	122.6
1012	L	24.7	Very low	27.5	Very low	165 Å²	165	147.5 Å²	147.5	86%	0.864	79%	0.791	S	S	*	*			trans	-96.5	152.4	146.9	-96.2	148.5	0	0	0	109.6
1013	P	29.3	Very low	27.9	Very low	114 Å²	114	143.6 Å²	143.6	74%	0.74	78%	0.782	S	S	*	*			trans	-119.3	165.7	151.2	34.1	-20.7	0	0	0	113.3
1014	P	41	Very low	26.9	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	78%	0.784	S	S	*	*			trans	-113.5	171.4	-146.8	40.6	-30.1	0	0	0	113.1
1015	S	24.3	Very low	26.9	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	79%	0.791	S	S	*	*			trans	-179.3	108.6	151.5	-78.6	0	0	0	0	108.9
1016	L	25.1	Very low	27	Very low	144 Å²	144	142.3 Å²	142.3	75%	0.754	79%	0.788	S	S	*	*				75.3	112.8	95.9	-80	163.7	0	0	0	114
1017	L	25.1	Very low	27.9	Very low	173 Å²	173	136.1 Å²	136.1	91%	0.906	78%	0.779	S	S	*	*				-167.1	128	114.8	-97.3	169.2	0	0	0	111.8
1018	F	25.1	Very low	27.9	Very low	174 Å²	174	137.5 Å²	137.5	76%	0.763	78%	0.784	S	S	*	*			trans	-70	150.3	170.7	-96.2	-109.9	0	0	0	111.9
1019	L	24.8	Very low	27.8	Very low	165 Å²	165	136.6 Å²	136.6	86%	0.864	78%	0.779	S	S	*	*				-175.8	158.9	115.6	-112.2	105.6	0	0	0	110.7
1020	P	31	Very low	27.9	Very low	103 Å²	103	136.1 Å²	136.1	67%	0.669	78%	0.782	S	S	*	*			trans	-111.1	-177.4	-141.1	16.2	8.7	0	0	0	114.5
1021	P	32.5	Very low	27.9	Very low	122 Å²	122	139 Å²	139	79%	0.792	79%	0.788	S	S	*	*			trans	-97.6	164.5	-167.1	38.2	-31.3	0	0	0	113.6
1022	L	25.3	Very low	28.2	Very low	169 Å²	169	135.5 Å²	135.5	89%	0.885	78%	0.782	S	S	*	*			trans	-142.5	156.5	168.1	-96.9	153.5	0	0	0	109
1023	P	31.9	Very low	28.3	Very low	102 Å²	102	133.7 Å²	133.7	66%	0.662	78%	0.783	S	S	*	*				-127.6	165.2	-118.5	33.5	-13.4	0	0	0	114.6
1024	S	26.1	Very low	28.2	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	78%	0.783	S	S	*	*			trans	27	127.5	147.4	63.8	0	0	0	0	121.1
1025	L	23.8	Very low	27.6	Very low	168 Å²	168	137.1 Å²	137.1	88%	0.88	79%	0.791	S	S	*	*				-168.5	142.9	108.3	-100.2	150	0	0	0	112.6
1026	P	28.9	Very low	27.7	Very low	108 Å²	108	138.8 Å²	138.8	70%	0.701	80%	0.796	S	S	*	*			trans	-109.6	-150.3	177.2	34.8	-14.7	0	0	0	110.8
1027	P	43.7	Very low	27.8	Very low	111 Å²	111	138.8 Å²	138.8	72%	0.721	80%	0.796	S	S	*	*				-123	171.9	-69.4	33.9	-17.1	0	0	0	112.4
1028	S	24.6	Very low	27.9	Very low	112 Å²	112	136 Å²	136	78%	0.783	79%	0.788	S	S	*	*			trans	-166.8	107.9	157.2	-70.5	0	0	0	0	109.5
1029	L	24.5	Very low	28.2	Very low	157 Å²	157	135.9 Å²	135.9	82%	0.822	79%	0.788	S	S	*	*				72.4	102	84.3	-85	170.7	0	0	0	115
1030	L	25.2	Very low	28.7	Very low	168 Å²	168	131.9 Å²	131.9	88%	0.88	77%	0.77	S	S	*	*				160.6	140.1	110.2	-87.6	156.6	0	0	0	113.4
1031	L	24.1	Very low	29	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	76%	0.758	S	S	*	*			trans	-76.3	-160	177.3	-73.3	129.6	0	0	0	112.4
1032	P	31.8	Very low	29.2	Very low	109 Å²	109	130.4 Å²	130.4	71%	0.708	75%	0.748	S	S	*	*				-119.5	153.4	-93.5	35.8	-16.9	0	0	0	112.6
1033	S	25.4	Very low	29.9	Very low	128 Å²	128	125.2 Å²	125.2	90%	0.895	72%	0.721	S	S	*	*			trans	-91.8	114.2	175.4	11.5	0	0	0	0	112.1
1034	S	27.4	Very low	30.4	Very low	105 Å²	105	122.6 Å²	122.6	73%	0.734	70%	0.699	S	S	*	*			trans	-80	146.1	167.3	-65.6	0	0	0	0	112.2
1035	Q	28.9	Very low	31.2	Very low	197 Å²	197	119.9 Å²	119.9	92%	0.921	68%	0.677	S	S	*	*			trans	-2.4	123.7	157.6	-63.5	176.8	-12.8	0	0	118.6
1036	V	27.2	Very low	32	Very low	140 Å²	140	115.4 Å²	115.4	85%	0.848	66%	0.658	S	S	*	*			trans	-128	125.8	162.2	179.3	0	0	0	0	108.8
1037	L	25.6	Very low	32.5	Very low	145 Å²	145	110.4 Å²	110.4	76%	0.759	63%	0.625	S	S	*	*			trans	-77.7	145.3	179.9	-76.5	155.7	0	0	0	111.9
1038	P	28.8	Very low	32.3	Very low	113 Å²	113	109.5 Å²	109.5	73%	0.734	61%	0.613	S	S	*	*			trans	-101.7	94.9	179.5	35.7	-25	0	0	0	111
1039	F	30.7	Very low	33	Very low	172 Å²	172	111 Å²	111	75%	0.754	60%	0.602	S	S	*	*			trans	-140.2	2.6	-179.4	-94	-77.2	0	0	0	116.6
1040	T	34.8	Very low	33.7	Very low	81 Å²	81	106.9 Å²	106.9	50%	0.497	58%	0.58	S	S	.	*	S	Bend	trans	-110.8	1.9	-165.6	42.2	0	0	0	0	116.5	F1044	T1040-F1044 WeakPolarHBondContact O-CD2 3.47Å; T1040-F1044 WeakPolarHBondContact O-CE2 3.47Å
1041	T	38.1	Very low	34.2	Very low	66 Å²	66	102.3 Å²	102.3	41%	0.405	56%	0.556	S	S	.	*	S	Bend	trans	-96	-21.7	-171.2	42.9	0	0	0	0	115.9
1042	H	36	Very low	34.5	Very low	129 Å²	129	98.6 Å²	98.6	60%	0.597	54%	0.543	S	S	*	.	S	Bend	trans	-90.1	-11.1	-169.6	-80.2	-72.5	0	0	0	116
1043	L	39.9	Very low	34.6	Very low	59 Å²	59	99.8 Å²	99.8	31%	0.309	55%	0.551	S	S	.	*	S	Bend	trans	-95.5	-18.9	-175.2	-126.2	94.3	0	0	0	115.4	M453 Q456	M453-L1043 HydrophobicContact CE-CD2 4.46Å; M453-L1043 HydrophobicContact CG-CD2 3.81Å; Q456-L1043 HydrophobicContact CB-CD1 4.26Å; Q456-L1043 HydrophobicContact CG-CD1 3.82Å
1044	F	43.9	Very low	35.1	Very low	48 Å²	48	97 Å²	97	21%	0.211	54%	0.542	C	S	.	.	S	Bend	trans	-94.3	-22.3	-157.7	-77.5	-82.8	0	0	0	116	L414 S418 T1040	L414-F1044 HydrophobicContact CD2-CE1 3.92Å; L414-F1044 HydrophobicContact CG-CE1 4.37Å; S418-F1044 WeakPolarHBondContact OG-CD1 3.28Å; T1040-F1044 WeakPolarHBondContact O-CD2 3.47Å; T1040-F1044 WeakPolarHBondContact O-CE2 3.47Å
1045	L	41.7	Very low	35.1	Very low	40 Å²	40	96.8 Å²	96.8	21%	0.209	54%	0.536	C	S	.	.	H	α-helix	trans	-79.1	-26.1	-176.7	-92.2	116.8	0	0	0	117	F430 L1047 M1048	F430-L1045 HydrophobicContact CD1-CD1 4.07Å; F430-L1045 HydrophobicContact CD1-CD2 4.21Å; F430-L1045 HydrophobicContact CD2-CD1 3.94Å; F430-L1045 HydrophobicContact CE1-CB 4.12Å; F430-L1045 HydrophobicContact CE1-CD1 3.73Å; F430-L1045 HydrophobicContact CE1-CD2 3.27Å; F430-L1045 HydrophobicContact CE1-CG 3.84Å; F430-L1045 HydrophobicContact CE2-CB 3.59Å; F430-L1045 HydrophobicContact CE2-CD1 3.56Å; F430-L1045 HydrophobicContact CE2-CD2 4.29Å; F430-L1045 HydrophobicContact CE2-CG 3.95Å; F430-L1045 HydrophobicContact CG-CD1 4.2Å; F430-L1045 HydrophobicContact CZ-CB 3.24Å; F430-L1045 HydrophobicContact CZ-CD1 3.48Å; F430-L1045 VanDerWaalsContact CZ-CD1 3.48Å; F430-L1045 HydrophobicContact CZ-CD2 3.34Å; F430-L1045 HydrophobicContact CZ-CG 3.46Å; F430-L1045 VanDerWaalsContact CZ-CG 3.46Å; L1045-L1047 PolarHBondContact O-N 3.03Å; L1045-M1048 PolarHBondContact O-N 3.48Å
1046	P	40.2	Very low	35.3	Very low	74 Å²	74	96.9 Å²	96.9	48%	0.481	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-27.9	171.6	-21.2	32.8	0	0	0	113.2
1047	L	39.5	Very low	35.3	Very low	3 Å²	3	101.5 Å²	101.5	2%	0.016	54%	0.539	C	S	.	.	H	α-helix	trans	-70.6	-31.3	177.2	-96.9	85.4	0	0	0	113	V411 L414 V415 L449 L1045 Y1049	V411-L1047 HydrophobicContact CB-CD2 3.99Å; V411-L1047 HydrophobicContact CG1-CB 4.04Å; V411-L1047 HydrophobicContact CG1-CD2 3.51Å; V411-L1047 HydrophobicContact CG1-CG 3.73Å; V411-L1047 HydrophobicContact CG2-CD2 4.06Å; L414-L1047 HydrophobicContact CD2-CD2 3.8Å; V415-L1047 HydrophobicContact CG2-CB 3.77Å; V415-L1047 HydrophobicContact CG2-CD2 4.05Å; L449-L1047 HydrophobicContact CD1-CD1 3.97Å; L449-L1047 HydrophobicContact CD2-CD1 3.81Å; L449-L1047 HydrophobicContact CD2-CG 4.3Å; L449-L1047 HydrophobicContact CG-CD1 4.38Å; L1045-L1047 PolarHBondContact O-N 3.03Å; L1047-Y1049 PolarHBondContact O-N 2.86Å
1048	M	40.5	Very low	35.5	Very low	93 Å²	93	103 Å²	103	46%	0.458	57%	0.573	S	S	.	*	H	α-helix	trans	-70.2	-27.3	-174.5	-83.2	-151.2	71.1	0	0	114	V415 L1045	V415-M1048 HydrophobicContact CG1-CG 3.75Å; V415-M1048 HydrophobicContact CG1-SD 4.21Å; V415-M1048 HydrophobicContact CG2-CG 4.31Å; L1045-M1048 PolarHBondContact O-N 3.48Å
1049	Y	39.4	Very low	35.8	Very low	144 Å²	144	102.5 Å²	102.5	57%	0.565	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-8.4	-177.6	-99	-91.6	0	0	0	114.5	Y434 L1047 L1051	Y434-Y1049 HydrophobicContact CE1-CE2 4.48Å; Y434-Y1049 HydrophobicContact CE2-CE2 4.46Å; Y434-Y1049 AromaticContact CZ-CE2 3.76Å; Y434-Y1049 WeakPolarHBondContact OH-CD2 3.4Å; Y434-Y1049 WeakPolarHBondContact OH-CE2 3.37Å; Y434-Y1049 VanDerWaalsContact OH-CZ 3.29Å; L1047-Y1049 PolarHBondContact O-N 2.86Å; Y1049-L1051 VanDerWaalsContact C-N 3.27Å; Y1049-L1051 PolarHBondContact O-N 3.1Å
1050	L	39.7	Very low	36.1	Very low	69 Å²	69	98.8 Å²	98.8	36%	0.361	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.9	176.4	-114.7	105	0	0	0	113.7	A440	A440-L1050 HydrophobicContact CB-CD1 4.15Å; A440-L1050 HydrophobicContact CB-CG 4.31Å
1051	L	34	Very low	36.2	Very low	72 Å²	72	99.8 Å²	99.8	38%	0.377	56%	0.558	S	S	.	*	S	Bend	trans	-114.4	-6.4	-167.5	-80.7	158.7	0	0	0	116.1	P408 V411 A412 Y1049	P408-L1051 HydrophobicContact CB-CD2 4.1Å; V411-L1051 HydrophobicContact CG1-CD1 4.15Å; A412-L1051 HydrophobicContact CB-CD1 3.73Å; Y1049-L1051 VanDerWaalsContact C-N 3.27Å; Y1049-L1051 PolarHBondContact O-N 3.1Å
1052	C	32.1	Very low	36.1	Very low	84 Å²	84	101.8 Å²	101.8	57%	0.568	57%	0.567	S	S	*	*			trans	-143	96.3	175.5	-77.5	0	0	0	0	112.7	G1054	C1052-G1054 PolarHBondContact O-N 2.81Å
1053	P	33.1	Very low	36.1	Very low	134 Å²	134	100.1 Å²	100.1	87%	0.87	57%	0.565	S	S	*	*	S	Bend	trans	-77.1	100.4	162.4	31.1	-26	0	0	0	107.8
1054	G	34.6	Very low	35.8	Very low	68 Å²	68	102.9 Å²	102.9	70%	0.701	58%	0.582	S	S	*	*	S	Bend	trans	95.8	85.2	168.4	0	0	0	0	0	115.2	C1052	C1052-G1054 PolarHBondContact O-N 2.81Å
1055	T	28.5	Very low	35.2	Very low	102 Å²	102	106.8 Å²	106.8	63%	0.626	61%	0.608	S	S	*	*			trans	-157.1	117.1	141.2	16.3	0	0	0	0	107.6	W1057	T1055-W1057 PolarHBondContact O-N 2.77Å
1056	E	33.3	Very low	34.7	Very low	199 Å²	199	111.9 Å²	111.9	93%	0.93	64%	0.639	S	S	*	*			trans	-61.8	123.1	166.1	-69.3	178.3	154.3	0	0	108.4
1057	W	27.6	Very low	34.3	Very low	236 Å²	236	115.1 Å²	115.1	89%	0.894	65%	0.652	S	S	*	*			trans	-119.2	124.7	165.1	-82	62.5	0	0	0	107.8	T1055	T1055-W1057 PolarHBondContact O-N 2.77Å
1058	A	29.2	Very low	33.8	Very low	177 Å²	177	125.3 Å²	125.3	100%	1.463	71%	0.71	S	S	*	*			trans	-70.5	0	-177.7	0	0	0	0	0	113.3

Retrieved 1,058 of 1,058 residues in 915.8 ms (Link to these results)

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