A0A077ZH20_TRITR Loading...

Cytoplasmic FMR1-interacting protein

AlphaFold DB , UniProt , Accession A0A077ZH20, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,260 aa.

						>A0A077ZH20_TRITR|A0A077ZH20
MSTEVISFNAAIGNVELLEEISLPDGQPMIEAQPRLMQYSANFDTNFEDRGAFITGISKYIEEATRHAELKELLSEGERHAVNLYTWRCCSRAVPMAKSNEQPNRAEIYDTIVEVLQPEVKKLLQFMYFQVRATRRFCEEVKRLSHCEKRKDFVSEVYLLTLGKMINMFAVLDELKNMKASIKNDYSTYRRATQFLQVMSDSQTLQESQNLSMFLATQNKIKDTLRKQLQEIDGYEELLADVVSVCVNYFDNRRYITPVVGFGICLIDDSTGNLAKLDQKKRLSISRLDRILKAREKGGKCFPKGRLHCFFFQQHEVVPLFGDMQVMPFAFIKRSQAFDPAKWPQSNVESLVCPINIAERTRTFREEHSDFVTRLAAIRNKILLHGRDVALNIEETKELTDMALQGLQLLSSWTSCVVEVYAWKLLHPTDPHQNRDCPADAEEYERATRYNYSSEEKVISMIKGLQVLMAKMETDFVTSIQRTIYLLSQELVQVTLREPLRKATKNKKELIRSILQSVRDTVVDFSSFHEVEDIYGKCRKDTMTSSSEIQISVRSVAPSFTQLYMVRTMLESLVSDRSGGKKFRKDLEEQHATAINNFLKQSVFWTPLLQFSEFLDACCDLSQLWFREFYLEMTMGKNIQFPIEMSMPWILTDHILESRNPAMIECALYQLDLYNDSAQCALVKFKKQFLYDEVEAEVNLGFDQFVCKLSHKIFAHYKQLASSILLDKRFKADCSSQGMCIPFVFNTRYATLMKQRHFQLLGRSIDLNHLLTQRINVALLKSLDLAINHFEANSITEIVALEGLVMLNRLCHQLLREHLPGLTDFNELFQEANHSVSAPYGRITLHVFWELNYDFLLSYCYNGATNRFVRSKVSSAASSVQRDSPPQATASYFWGSKDFNSAFSNLYAMYSGFLGAPHFHSLARLLKYQGIAVIMEELLKVSGNLLQNSILSALRKVITLVPKVCKLPRYDYGSPGVVSFYYAQLKKLVFNTDLQRDIFQSCRELGNTILFCLHLEKALTHEEVLDLVQSNVFIGNLPRPFCKANENPEIKIKRLEQKYANLQVSRTIGRYGVEKQVSLAQEGELLTRERLCCGLSIFEVLLSRMKNFLVDPIWFGSSPPTNSVMYIDECAEFHRLWSALQFVFCIPARENQVSIEETYGEGLNWCGCALVAMLDQRRRFEVVDFCYHVLRVFKVDGKDDNVPGIGQLSRMIERIRQFQLLNSTIFGVLCKYLKYGGLNNFMPLEKVQVFHPPAKNMQMQ
					

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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	42.7	Very low	64.8	Low	237 Å²	237	121.7 Å²	121.7	100%	1.167	68%	0.683	S	S	*	*				0	104.4	0	-68.2	-178.2	-173.9	0	0	106.3	T3	M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.11Å
2	S	41.1	Very low	66.3	Low	116 Å²	116	117 Å²	117	81%	0.811	65%	0.654	S	S	*	*			trans	-63	110.2	172.1	42.7	0	0	0	0	107.2	E4	S2-E4 VanDerWaalsContact C-N 3.28Å; S2-E4 PolarHBondContact O-N 2.96Å
3	T	49.7	Very low	67.5	Low	127 Å²	127	109.8 Å²	109.8	78%	0.779	62%	0.623	S	S	*	*			trans	-64.6	94.9	169	38.5	0	0	0	0	107	M1 V5	M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.11Å; T3-V5 PolarHBondContact O-N 3.18Å; T3-V5 VanDerWaalsContact O-N 3.07Å
4	E	53.1	Low	68.3	Low	174 Å²	174	108.9 Å²	108.9	81%	0.813	62%	0.615	S	S	*	*			trans	-55.4	113.9	167	-111.3	177.2	169.6	0	0	107.2	S2 I6	S2-E4 VanDerWaalsContact C-N 3.28Å; S2-E4 PolarHBondContact O-N 2.96Å; E4-I6 VanDerWaalsContact C-N 3.25Å; E4-I6 PolarHBondContact O-N 3.46Å
5	V	58.8	Low	69	Low	139 Å²	139	107.9 Å²	107.9	84%	0.842	61%	0.612	S	S	*	*			trans	-73.6	89.1	175.4	-179	0	0	0	0	106.1	T3 S7	T3-V5 PolarHBondContact O-N 3.18Å; T3-V5 VanDerWaalsContact O-N 3.07Å; V5-S7 PolarHBondContact O-N 3.46Å
6	I	63.4	Low	69.6	Low	111 Å²	111	108.1 Å²	108.1	57%	0.569	61%	0.606	S	S	*	*			trans	-63.5	123.7	172.7	-59.8	172.3	0	0	0	106.9	E4 A10	E4-I6 VanDerWaalsContact C-N 3.25Å; E4-I6 PolarHBondContact O-N 3.46Å; I6-A10 HydrophobicContact CG2-CB 3.7Å
7	S	80.6	Confident	69.9	Low	64 Å²	64	107.4 Å²	107.4	45%	0.448	60%	0.6	S	S	.	*			trans	-65.4	150.4	179.9	80.4	0	0	0	0	110.5	V5 N9 A10 A11	V5-S7 PolarHBondContact O-N 3.46Å; S7-N9 PolarHBondContact O-N 2.53Å; S7-N9 VanDerWaalsContact O-N 3.15Å; S7-A10 PolarHBondContact O-N 3.12Å; S7-A10 PolarHBondContact OG-N 3.26Å; S7-A11 PolarHBondContact O-N 3.24Å
8	F	81.7	Confident	70	Confident	158 Å²	158	107.7 Å²	107.7	69%	0.693	60%	0.6	S	S	*	*	H	α-helix	trans	-52.4	-37.6	176.4	-179.3	-103	0	0	0	112.2	A11 I12	F8-A11 PolarHBondContact O-N 3.1Å; F8-I12 HydrophobicContact CD1-CD1 4.06Å; F8-I12 HydrophobicContact CD1-CG1 4.5Å; F8-I12 HydrophobicContact CE1-CD1 3.33Å; F8-I12 HydrophobicContact CE1-CG1 4.12Å; F8-I12 HydrophobicContact CE2-CD1 4.37Å; F8-I12 HydrophobicContact CZ-CD1 3.53Å; F8-I12 HydrophobicContact CZ-CG1 4.16Å; F8-I12 PolarHBondContact O-N 3.32Å
9	N	81.4	Confident	69.6	Low	126 Å²	126	111.2 Å²	111.2	67%	0.674	61%	0.611	S	S	*	*	H	α-helix	trans	-67.3	-37.8	176.6	-69.9	-8.3	0	0	0	112.8	S7 A11 I12 G13	S7-N9 PolarHBondContact O-N 2.53Å; S7-N9 VanDerWaalsContact O-N 3.15Å; N9-A11 VanDerWaalsContact C-N 3.34Å; N9-I12 PolarHBondContact O-N 3.48Å; N9-G13 PolarHBondContact O-N 3.14Å
10	A	79.3	Confident	69.1	Low	42 Å²	42	113.4 Å²	113.4	35%	0.347	62%	0.617	S	S	.	*	H	α-helix	trans	-69.3	-34.3	175.6	0	0	0	0	0	111.8	I6 S7 N14	I6-A10 HydrophobicContact CG2-CB 3.7Å; S7-A10 PolarHBondContact O-N 3.12Å; S7-A10 PolarHBondContact OG-N 3.26Å; A10-N14 VanDerWaalsContact O-CG 3.31Å; A10-N14 PolarHBondContact O-N 2.83Å; A10-N14 VanDerWaalsContact O-N 3.12Å
11	A	81	Confident	68.6	Low	45 Å²	45	112.8 Å²	112.8	37%	0.372	61%	0.612	S	S	.	*	H	α-helix	trans	-67.3	-42.7	173.1	0	0	0	0	0	112	S7 F8 N9 N14 V15	S7-A11 PolarHBondContact O-N 3.24Å; F8-A11 PolarHBondContact O-N 3.1Å; N9-A11 VanDerWaalsContact C-N 3.34Å; A11-N14 PolarHBondContact O-N 3.42Å; A11-V15 WeakPolarHBondContact O-CG2 3.28Å; A11-V15 PolarHBondContact O-N 2.96Å
12	I	83.3	Confident	69.2	Low	65 Å²	65	106.5 Å²	106.5	33%	0.333	59%	0.591	S	S	.	*	H	α-helix	trans	-62.8	-46.4	173.2	-74.8	-167.9	0	0	0	111	F8 N9 N14 V15 E16	F8-I12 HydrophobicContact CD1-CD1 4.06Å; F8-I12 HydrophobicContact CD1-CG1 4.5Å; F8-I12 HydrophobicContact CE1-CD1 3.33Å; F8-I12 HydrophobicContact CE1-CG1 4.12Å; F8-I12 HydrophobicContact CE2-CD1 4.37Å; F8-I12 HydrophobicContact CZ-CD1 3.53Å; F8-I12 HydrophobicContact CZ-CG1 4.16Å; F8-I12 PolarHBondContact O-N 3.32Å; N9-I12 PolarHBondContact O-N 3.48Å; I12-N14 PolarHBondContact O-N 3.4Å; I12-V15 CarbonylContact O-C 3.36Å; I12-V15 WeakPolarHBondContact O-CA 3.14Å; I12-V15 PolarHBondContact O-N 3.13Å; I12-E16 HydrophobicContact CG2-CG 4.03Å; I12-E16 WeakPolarHBondContact CG2-OE1 3.21Å; I12-E16 PolarHBondContact O-N 3.38Å
13	G	81.3	Confident	70	Confident	24 Å²	24	108.3 Å²	108.3	25%	0.247	59%	0.591	C	S	.	*	H	α-helix	trans	-57.8	-34.8	178	0	0	0	0	0	113.1	N9 L17	N9-G13 PolarHBondContact O-N 3.14Å; G13-L17 WeakPolarHBondContact O-CB 3.48Å; G13-L17 PolarHBondContact O-N 3.17Å
14	N	79.5	Confident	70.4	Confident	97 Å²	97	107.9 Å²	107.9	52%	0.519	59%	0.591	S	S	.	*	H	α-helix	trans	-70.1	-30.4	173.8	-72.9	-14.3	0	0	0	113.5	A10 A11 I12	A10-N14 VanDerWaalsContact O-CG 3.31Å; A10-N14 PolarHBondContact O-N 2.83Å; A10-N14 VanDerWaalsContact O-N 3.12Å; A11-N14 PolarHBondContact O-N 3.42Å; I12-N14 PolarHBondContact O-N 3.4Å
15	V	77.8	Confident	71	Confident	93 Å²	93	104.1 Å²	104.1	56%	0.564	58%	0.576	S	S	*	*	H	α-helix	trans	-78.3	-39.6	175.6	175.3	0	0	0	0	110.7	A11 I12 L17 L18 E19	A11-V15 WeakPolarHBondContact O-CG2 3.28Å; A11-V15 PolarHBondContact O-N 2.96Å; I12-V15 CarbonylContact O-C 3.36Å; I12-V15 WeakPolarHBondContact O-CA 3.14Å; I12-V15 PolarHBondContact O-N 3.13Å; V15-L17 VanDerWaalsContact C-N 3.26Å; V15-L17 PolarHBondContact O-N 3.18Å; V15-L18 WeakPolarHBondContact O-CA 3.2Å; V15-L18 VanDerWaalsContact O-CB 3.31Å; V15-L18 WeakPolarHBondContact O-CB 3.36Å; V15-L18 PolarHBondContact O-N 3.3Å; V15-E19 PolarHBondContact O-N 3.13Å
16	E	78.4	Confident	71.4	Confident	111 Å²	111	100.9 Å²	100.9	52%	0.519	57%	0.571	S	S	.	*	H	α-helix	trans	-60.9	-37.2	172.8	-70.9	176.2	167.4	0	0	110.9	I12 L18 E19 E20	I12-E16 HydrophobicContact CG2-CG 4.03Å; I12-E16 WeakPolarHBondContact CG2-OE1 3.21Å; I12-E16 PolarHBondContact O-N 3.38Å; E16-L18 PolarHBondContact O-N 3.35Å; E16-E19 WeakPolarHBondContact O-CB 3.42Å; E16-E19 PolarHBondContact O-N 3.44Å; E16-E20 PolarHBondContact O-N 3Å; E16-E20 VanDerWaalsContact O-N 3.1Å
17	L	74.6	Confident	72.2	Confident	97 Å²	97	96.8 Å²	96.8	51%	0.508	55%	0.549	S	S	.	.	H	α-helix	trans	-58.2	-29.5	170.3	-92.9	157.6	0	0	0	113.5	G13 V15 E20 I21	G13-L17 WeakPolarHBondContact O-CB 3.48Å; G13-L17 PolarHBondContact O-N 3.17Å; V15-L17 VanDerWaalsContact C-N 3.26Å; V15-L17 PolarHBondContact O-N 3.18Å; L17-E20 PolarHBondContact O-N 3.13Å; L17-I21 WeakPolarHBondContact O-CG1 3.17Å; L17-I21 PolarHBondContact O-N 3.42Å
18	L	73	Confident	72.1	Confident	112 Å²	112	95.2 Å²	95.2	59%	0.586	54%	0.538	S	S	*	.	H	α-helix	trans	-75	-32.7	174.4	-62.7	174.4	0	0	0	112	V15 E16 E20 I21	V15-L18 WeakPolarHBondContact O-CA 3.2Å; V15-L18 VanDerWaalsContact O-CB 3.31Å; V15-L18 WeakPolarHBondContact O-CB 3.36Å; V15-L18 PolarHBondContact O-N 3.3Å; E16-L18 PolarHBondContact O-N 3.35Å; L18-E20 VanDerWaalsContact C-N 3.26Å; L18-I21 HydrophobicContact CD2-CD1 3.68Å; L18-I21 PolarHBondContact O-N 3.05Å
19	E	62.7	Low	71.8	Confident	175 Å²	175	91.9 Å²	91.9	82%	0.818	53%	0.525	S	S	*	.	H	α-helix	trans	-66.4	-29.7	171.6	-89.4	-173.3	161.8	0	0	111.8	V15 E16 I21	V15-E19 PolarHBondContact O-N 3.13Å; E16-E19 WeakPolarHBondContact O-CB 3.42Å; E16-E19 PolarHBondContact O-N 3.44Å; E19-I21 VanDerWaalsContact C-N 3.32Å
20	E	59	Low	71.8	Confident	155 Å²	155	86.5 Å²	86.5	72%	0.724	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-12.5	174.4	-67.6	-168.6	167.7	0	0	114.1	E16 L17 L18 S22	E16-E20 PolarHBondContact O-N 3Å; E16-E20 VanDerWaalsContact O-N 3.1Å; L17-E20 PolarHBondContact O-N 3.13Å; L18-E20 VanDerWaalsContact C-N 3.26Å; E20-S22 PolarHBondContact O-N 2.99Å
21	I	58.7	Low	71.7	Confident	100 Å²	100	85.2 Å²	85.2	51%	0.513	48%	0.483	S	S	.	.			trans	-69.6	99.3	175.9	-63.6	176	0	0	0	108.3	L17 L18 E19 L23	L17-I21 WeakPolarHBondContact O-CG1 3.17Å; L17-I21 PolarHBondContact O-N 3.42Å; L18-I21 HydrophobicContact CD2-CD1 3.68Å; L18-I21 PolarHBondContact O-N 3.05Å; E19-I21 VanDerWaalsContact C-N 3.32Å; I21-L23 PolarHBondContact O-N 3.45Å
22	S	55	Low	71.1	Confident	105 Å²	105	83.2 Å²	83.2	73%	0.734	47%	0.466	S	S	*	.			trans	-57.4	105.8	168.1	63.2	0	0	0	0	108.7	E20 P24	E20-S22 PolarHBondContact O-N 2.99Å; S22-P24 WeakPolarHBondContact O-CD 3.49Å; S22-P24 VanDerWaalsContact O-N 3.15Å
23	L	58.4	Low	70.6	Confident	154 Å²	154	82 Å²	82	81%	0.806	46%	0.459	S	S	*	.			trans	-58.8	119.8	169.7	-70.4	169.3	0	0	0	107	I21 D25	I21-L23 PolarHBondContact O-N 3.45Å; L23-D25 PolarHBondContact O-N 2.93Å
24	P	58.6	Low	69.7	Low	119 Å²	119	84 Å²	84	77%	0.773	47%	0.468	S	S	*	.			trans	-63.2	112.1	-179.9	24.1	-30.9	0	0	0	107.5	S22 G26	S22-P24 WeakPolarHBondContact O-CD 3.49Å; S22-P24 VanDerWaalsContact O-N 3.15Å; P24-G26 PolarHBondContact O-N 3.39Å; P24-G26 VanDerWaalsContact O-N 3.14Å
25	D	65.6	Low	68.8	Low	95 Å²	95	82.1 Å²	82.1	51%	0.508	45%	0.453	S	S	.	.			trans	-59.2	119.4	169.4	176.7	17.6	0	0	0	108.3	L23 Q27 H757	L23-D25 PolarHBondContact O-N 2.93Å; D25-Q27 PolarHBondContact O-N 3.25Å; D25-Q27 VanDerWaalsContact O-N 3.14Å; D25-Q27 WeakPolarHBondContact OD1-CB 3.14Å; D25-Q27 PolarHBondContact OD1-N 3.47Å; D25-Q27 VanDerWaalsContact OD1-N 3.13Å; D25-Q27 WeakPolarHBondContact OD2-CB 3.29Å; D25-H757 IonicContact OD1-NE2 3.01Å; D25-H757 IonicContact OD2-CD2 3.51Å; D25-H757 IonicContact OD2-CE1 3.59Å; D25-H757 PolarHBondContact OD2-CE1 3.04Å; D25-H757 IonicContact OD2-NE2 2.62Å; D25-H757 PolarHBondContact OD2-NE2 3.39Å
26	G	66.3	Low	67.8	Low	71 Å²	71	83.4 Å²	83.4	73%	0.732	46%	0.457	S	S	*	.			trans	-70.4	-1	-178.6	0	0	0	0	0	113.6	P24 P28	P24-G26 PolarHBondContact O-N 3.39Å; P24-G26 VanDerWaalsContact O-N 3.14Å; G26-P28 WeakPolarHBondContact O-CD 3.43Å
27	Q	79.5	Confident	66.8	Low	24 Å²	24	86.7 Å²	86.7	11%	0.112	47%	0.474	C	S	.	.			trans	-64.3	127.3	177	-175.5	168.6	-57.2	0	0	111.8	D25 M29 H757	D25-Q27 PolarHBondContact O-N 3.25Å; D25-Q27 VanDerWaalsContact O-N 3.14Å; D25-Q27 WeakPolarHBondContact OD1-CB 3.14Å; D25-Q27 PolarHBondContact OD1-N 3.47Å; D25-Q27 VanDerWaalsContact OD1-N 3.13Å; D25-Q27 WeakPolarHBondContact OD2-CB 3.29Å; Q27-M29 PolarHBondContact O-N 3.48Å; Q27-H757 PolarHBondContact NE2-CE1 2.85Å; Q27-H757 PolarHBondContact NE2-ND1 3.41Å; Q27-H757 PolarHBondContact OE1-CD2 2.84Å; Q27-H757 PolarHBondContact OE1-CE1 3.27Å; Q27-H757 PolarHBondContact OE1-ND1 2.99Å; Q27-H757 PolarHBondContact OE1-NE2 2.9Å
28	P	78.5	Confident	66.2	Low	32 Å²	32	86.1 Å²	86.1	21%	0.208	47%	0.469	C	S	.	.			trans	-64	133.7	171.9	-24.7	37.1	0	0	0	111.7	G26 I30 T751 K754 Q755	G26-P28 WeakPolarHBondContact O-CD 3.43Å; P28-I30 PolarHBondContact O-N 3.44Å; P28-I30 VanDerWaalsContact O-N 3.08Å; P28-T751 HydrophobicContact CB-CG2 3.9Å; P28-T751 HydrophobicContact CG-CG2 4.11Å; P28-K754 HydrophobicContact CG-CB 4.04Å; P28-K754 HydrophobicContact CG-CD 3.98Å; P28-Q755 PolarHBondContact O-NE2 3.29Å
29	M	75.8	Confident	65.7	Low	88 Å²	88	90.8 Å²	90.8	43%	0.433	48%	0.48	S	S	.	.			trans	-79.4	91.9	177.9	-179.5	156.3	-75.6	0	0	111.2	Q27 V467 K471	Q27-M29 PolarHBondContact O-N 3.48Å; M29-V467 HydrophobicContact CE-CG1 4.24Å; M29-V467 HydrophobicContact CG-CG1 4.44Å; M29-V467 HydrophobicContact SD-CG1 3.57Å; M29-V467 VanDerWaalsContact SD-CG1 3.57Å; M29-K471 HydrophobicContact SD-CD 4.38Å; M29-K471 WeakPolarHBondContact SD-CE 3.3Å; M29-K471 PolarHBondContact SD-NZ 3.38Å
30	I	81.5	Confident	65.7	Low	12 Å²	12	85.5 Å²	85.5	6%	0.062	46%	0.463	C	S	.	.			trans	-129.3	13.8	177.5	56.6	158.6	0	0	0	112.5	P28 E665 L668 L752 Q755	P28-I30 PolarHBondContact O-N 3.44Å; P28-I30 VanDerWaalsContact O-N 3.08Å; I30-E665 HydrophobicContact CG2-CB 4.37Å; I30-L668 HydrophobicContact CD1-CD1 3.86Å; I30-L668 HydrophobicContact CG1-CD1 4.06Å; I30-L752 HydrophobicContact CD1-CD2 3.63Å; I30-L752 HydrophobicContact CD1-CG 4.05Å; I30-Q755 HydrophobicContact CD1-CG 4.09Å; I30-Q755 HydrophobicContact CG1-CG 4.34Å
31	E	77.2	Confident	66	Low	16 Å²	16	80.6 Å²	80.6	8%	0.075	45%	0.448	C	S	.	.	S	Bend	trans	-108.6	161	172.5	62.7	174.1	-179.6	0	0	110.7	Y669 F758 Q759	E31-Y669 WeakPolarHBondContact O-CE1 3.47Å; E31-F758 HydrophobicContact CB-CD2 3.98Å; E31-F758 HydrophobicContact CB-CE2 4.24Å; E31-F758 VanDerWaalsContact OE2-CA 3.28Å; E31-F758 WeakPolarHBondContact OE2-CA 3.48Å; E31-F758 WeakPolarHBondContact OE2-CD2 3.09Å; E31-Q759 PolarHBondContact OE2-N 2.98Å
32	A	69.6	Low	66.6	Low	2 Å²	2	80.3 Å²	80.3	2%	0.017	45%	0.448	C	S	.	.			trans	-73.2	-174.3	172.7	0	0	0	0	0	111.5	P34 K463 Y669 D672	A32-P34 WeakPolarHBondContact O-CD 3.48Å; A32-P34 VanDerWaalsContact O-N 3.12Å; A32-K463 HydrophobicContact CB-CB 4.07Å; A32-K463 HydrophobicContact CB-CD 4.13Å; A32-K463 HydrophobicContact CB-CG 4.37Å; A32-Y669 HydrophobicContact CB-CD1 4.26Å; A32-D672 HydrophobicContact CB-CB 3.7Å; A32-D672 WeakPolarHBondContact CB-OD1 3.45Å; A32-D672 WeakPolarHBondContact CB-OD2 3.48Å
33	Q	71	Confident	67.7	Low	39 Å²	39	82.8 Å²	82.8	18%	0.182	45%	0.446	C	S	.	.			trans	-66.5	114.8	-172	-173.3	-174.9	-4.7	0	0	110	R35 V467 A470	Q33-R35 VanDerWaalsContact CD-NE 3.32Å; Q33-R35 HydrophobicContact CG-CG 4.34Å; Q33-R35 PolarHBondContact O-N 3.45Å; Q33-V467 HydrophobicContact CB-CG2 4.17Å; Q33-V467 VanDerWaalsContact N-CG2 3.25Å; Q33-A470 VanDerWaalsContact CD-CB 3.4Å; Q33-A470 HydrophobicContact CG-CB 4.14Å
34	P	63.4	Low	68.8	Low	67 Å²	67	77.7 Å²	77.7	44%	0.435	42%	0.419	S	S	.	.			trans	-68.6	120.4	179.4	27.1	-32.8	0	0	0	109.5	A32 Q759	A32-P34 WeakPolarHBondContact O-CD 3.48Å; A32-P34 VanDerWaalsContact O-N 3.12Å; P34-Q759 HydrophobicContact CB-CB 4.12Å; P34-Q759 HydrophobicContact CB-CG 3.43Å; P34-Q759 VanDerWaalsContact CB-CG 3.43Å
35	R	61	Low	70	Confident	57 Å²	57	74.4 Å²	74.4	22%	0.215	40%	0.397	C	S	.	.			trans	-126.6	92	178.8	-71.5	-177.8	178.1	-152.7	-1.5	111.1	Q33 Q38 D616	Q33-R35 VanDerWaalsContact CD-NE 3.32Å; Q33-R35 HydrophobicContact CG-CG 4.34Å; Q33-R35 PolarHBondContact O-N 3.45Å; R35-Q38 VanDerWaalsContact NH1-NE2 3.19Å; R35-D616 IonicContact CZ-OD1 2.79Å; R35-D616 IonicContact CZ-OD2 3.93Å; R35-D616 IonicContact NH1-OD1 3.93Å; R35-D616 PolarHBondContact NH1-OD1 2.99Å; R35-D616 IonicContact NH1-OD2 2.68Å; R35-D616 PolarHBondContact NH1-OD2 3.39Å; R35-D616 IonicContact NH2-OD1 3.79Å; R35-D616 PolarHBondContact NH2-OD1 3.12Å; R35-D616 IonicContact NH2-OD2 3.7Å
36	L	56.7	Low	70.9	Confident	121 Å²	121	71.7 Å²	71.7	63%	0.634	38%	0.383	S	S	*	.	S	Bend	trans	-75.6	-37.2	171.3	-72.7	165.2	0	0	0	111.6	Q759	L36-Q759 VanDerWaalsContact CD2-OE1 3.31Å
37	M	56.4	Low	71.9	Confident	180 Å²	180	68.5 Å²	68.5	89%	0.887	35%	0.349	S	S	*	.			trans	-141.6	131.8	172.7	-76.1	-160.1	-76.2	0	0	109.5
38	Q	61.5	Low	72.1	Confident	84 Å²	84	75.2 Å²	75.2	39%	0.393	38%	0.38	S	S	.	.			trans	-104.2	118.6	172.8	-177.5	164.7	-13.9	0	0	109.4	R35 D616	R35-Q38 VanDerWaalsContact NH1-NE2 3.19Å; Q38-D616 PolarHBondContact NE2-OD2 3.22Å
39	Y	63.2	Low	72.5	Confident	210 Å²	210	76 Å²	76	82%	0.824	38%	0.382	S	S	*	.			trans	-117.4	117.3	171.7	-178.4	-96.4	0	0	0	108	A41	Y39-A41 HydrophobicContact CE1-CB 4.27Å
40	S	63.1	Low	72.8	Confident	64 Å²	64	74.6 Å²	74.6	45%	0.448	37%	0.373	S	S	.	.			trans	-116.9	126.9	169.1	74	0	0	0	0	109.6
41	A	65.9	Low	72.7	Confident	52 Å²	52	76.3 Å²	76.3	43%	0.43	39%	0.393	S	S	.	.			trans	-87.3	109.3	170.4	0	0	0	0	0	108.2	Y39 F43	Y39-A41 HydrophobicContact CE1-CB 4.27Å; A41-F43 HydrophobicContact CB-CD2 4.46Å; A41-F43 HydrophobicContact CB-CE2 3.73Å; A41-F43 HydrophobicContact CB-CZ 3.77Å
42	N	71	Confident	72.9	Confident	95 Å²	95	79.3 Å²	79.3	51%	0.508	42%	0.421	S	S	.	.			trans	-91.8	112.5	172.1	-173.1	4.1	0	0	0	109.6	D44 Q610	N42-D44 VanDerWaalsContact OD1-CB 3.32Å; N42-D44 WeakPolarHBondContact OD1-CB 3.24Å; N42-D44 PolarHBondContact OD1-N 2.93Å; N42-Q610 PolarHBondContact OD1-NE2 3.04Å
43	F	77.1	Confident	73.2	Confident	156 Å²	156	80.4 Å²	80.4	68%	0.684	43%	0.425	S	S	*	.			trans	-94.3	4.7	176.3	-56.7	-80.1	0	0	0	113.1	A41 T45 F560	A41-F43 HydrophobicContact CB-CD2 4.46Å; A41-F43 HydrophobicContact CB-CE2 3.73Å; A41-F43 HydrophobicContact CB-CZ 3.77Å; F43-T45 PolarHBondContact O-N 3.38Å; F43-F560 HydrophobicContact CB-CE2 4Å; F43-F560 WeakPolarHBondContact O-CD2 3.39Å
44	D	82.1	Confident	72.7	Confident	47 Å²	47	84.4 Å²	84.4	25%	0.251	45%	0.446	S	S	.	.			trans	-72.2	107.4	171.9	-173	-0.4	0	0	0	109.6	N42 N46 K71 F560	N42-D44 VanDerWaalsContact OD1-CB 3.32Å; N42-D44 WeakPolarHBondContact OD1-CB 3.24Å; N42-D44 PolarHBondContact OD1-N 2.93Å; D44-N46 PolarHBondContact O-N 2.78Å; D44-N46 PolarHBondContact OD1-N 3.49Å; D44-K71 IonicContact OD2-NZ 2.7Å; D44-F560 VanDerWaalsContact CA-CD2 3.48Å; D44-F560 HydrophobicContact CB-CD2 3.93Å; D44-F560 HydrophobicContact CB-CE2 4.26Å; D44-F560 HydrophobicContact CB-CG 4.06Å
45	T	83.1	Confident	72.6	Confident	50 Å²	50	85 Å²	85	31%	0.307	45%	0.448	S	S	.	.			trans	-79.4	3.5	179.3	54.4	0	0	0	0	113.2	F43 F47 E48 D49 T561	F43-T45 PolarHBondContact O-N 3.38Å; T45-F47 PolarHBondContact O-N 3.38Å; T45-F47 VanDerWaalsContact O-N 3.09Å; T45-E48 WeakPolarHBondContact O-CB 3.32Å; T45-E48 VanDerWaalsContact O-CG 3.29Å; T45-E48 WeakPolarHBondContact O-CG 3.38Å; T45-E48 PolarHBondContact O-N 3.37Å; T45-D49 PolarHBondContact OG1-OD1 3.18Å; T45-T561 PolarHBondContact OG1-OG1 2.95Å
46	N	85.3	Confident	72.4	Confident	38 Å²	38	82.9 Å²	82.9	20%	0.203	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	39.4	-172.1	-165	32.9	0	0	0	112.9	D44 E48 K71	D44-N46 PolarHBondContact O-N 2.78Å; D44-N46 PolarHBondContact OD1-N 3.49Å; N46-E48 VanDerWaalsContact C-N 3.31Å; N46-E48 PolarHBondContact O-N 3.09Å; N46-K71 WeakPolarHBondContact OD1-CD 3.25Å
47	F	86.2	Confident	72.8	Confident	5 Å²	5	79.7 Å²	79.7	2%	0.022	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	21.6	-179.3	-38.3	-62.3	0	0	0	115.3	T45 D49 R50 A64 H67 A68 K71 T561 Y564	T45-F47 PolarHBondContact O-N 3.38Å; T45-F47 VanDerWaalsContact O-N 3.09Å; F47-D49 VanDerWaalsContact C-N 3.25Å; F47-D49 PolarHBondContact O-N 2.88Å; F47-R50 HydrophobicContact CB-CB 4.38Å; F47-R50 VanDerWaalsContact O-CB 3.25Å; F47-R50 WeakPolarHBondContact O-CB 3.47Å; F47-R50 WeakPolarHBondContact O-CD 3.09Å; F47-R50 WeakPolarHBondContact O-CG 3.4Å; F47-R50 PolarHBondContact O-N 2.93Å; F47-R50 PolarHBondContact O-NH1 3.48Å; F47-A64 HydrophobicContact CB-CB 4.34Å; F47-A64 HydrophobicContact CD2-CB 4.36Å; F47-A64 WeakPolarHBondContact CD2-O 3.09Å; F47-A64 HydrophobicContact CG-CB 4.2Å; F47-H67 HydrophobicContact CE2-CB 4.15Å; F47-A68 HydrophobicContact CD2-CB 4.18Å; F47-K71 HydrophobicContact CE2-CD 4.5Å; F47-T561 WeakPolarHBondContact CA-OG1 3.48Å; F47-T561 HydrophobicContact CD1-CG2 4.28Å; F47-Y564 HydrophobicContact CD1-CD1 4.32Å; F47-Y564 HydrophobicContact CD1-CG 4.32Å; F47-Y564 AromaticContact CE1-CD1 3.77Å; F47-Y564 HydrophobicContact CE1-CD1 3.77Å; F47-Y564 AromaticContact CE1-CD2 3.76Å; F47-Y564 HydrophobicContact CE1-CD2 3.76Å; F47-Y564 HydrophobicContact CE1-CE1 4.39Å; F47-Y564 HydrophobicContact CE1-CE2 4.37Å; F47-Y564 AromaticContact CE1-CG 3.41Å; F47-Y564 HydrophobicContact CE1-CG 3.41Å; F47-Y564 VanDerWaalsContact CE1-CG 3.41Å; F47-Y564 HydrophobicContact CZ-CD1 4.16Å; F47-Y564 AromaticContact CZ-CD2 3.65Å; F47-Y564 HydrophobicContact CZ-CD2 3.65Å; F47-Y564 HydrophobicContact CZ-CE1 4.39Å; F47-Y564 AromaticContact CZ-CE2 3.88Å; F47-Y564 HydrophobicContact CZ-CE2 3.88Å; F47-Y564 AromaticContact CZ-CG 3.79Å; F47-Y564 HydrophobicContact CZ-CG 3.79Å
48	E	85.2	Confident	73.8	Confident	165 Å²	165	75.6 Å²	75.6	77%	0.771	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-61.2	-34.9	174.2	-77.2	-178.5	177.2	0	0	112.6	T45 N46 R50	T45-E48 WeakPolarHBondContact O-CB 3.32Å; T45-E48 VanDerWaalsContact O-CG 3.29Å; T45-E48 WeakPolarHBondContact O-CG 3.38Å; T45-E48 PolarHBondContact O-N 3.37Å; N46-E48 VanDerWaalsContact C-N 3.31Å; N46-E48 PolarHBondContact O-N 3.09Å; E48-R50 PolarHBondContact O-N 2.85Å
49	D	86.3	Confident	74.7	Confident	47 Å²	47	74.2 Å²	74.2	25%	0.251	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-79.8	3.9	178.2	63.1	-37.4	0	0	0	113.9	T45 F47 G51 A52 F53 T561	T45-D49 PolarHBondContact OG1-OD1 3.18Å; F47-D49 VanDerWaalsContact C-N 3.25Å; F47-D49 PolarHBondContact O-N 2.88Å; D49-G51 PolarHBondContact O-N 3.24Å; D49-A52 WeakPolarHBondContact O-CB 3.43Å; D49-A52 PolarHBondContact O-N 2.67Å; D49-F53 WeakPolarHBondContact O-CE2 3.46Å; D49-T561 VanDerWaalsContact OD1-CB 3.3Å; D49-T561 WeakPolarHBondContact OD1-CB 3.34Å; D49-T561 PolarHBondContact OD1-OG1 3.44Å
50	R	82.6	Confident	75.8	Confident	60 Å²	60	64.7 Å²	64.7	23%	0.226	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-55.5	-27.8	-179.4	68	-170.3	170.5	-108.9	5	114.3	F47 E48 A52 F53 I61 T65 T561	F47-R50 HydrophobicContact CB-CB 4.38Å; F47-R50 VanDerWaalsContact O-CB 3.25Å; F47-R50 WeakPolarHBondContact O-CB 3.47Å; F47-R50 WeakPolarHBondContact O-CD 3.09Å; F47-R50 WeakPolarHBondContact O-CG 3.4Å; F47-R50 PolarHBondContact O-N 2.93Å; F47-R50 PolarHBondContact O-NH1 3.48Å; E48-R50 PolarHBondContact O-N 2.85Å; R50-A52 PolarHBondContact O-N 2.84Å; R50-F53 PolarHBondContact O-N 3.25Å; R50-F53 VanDerWaalsContact O-N 3.15Å; R50-I61 HydrophobicContact CB-CG2 4.5Å; R50-I61 HydrophobicContact CG-CG2 4.16Å; R50-T65 PolarHBondContact NE-OG1 3.3Å; R50-T561 HydrophobicContact CB-CG2 4.13Å
51	G	79.8	Confident	76.8	Confident	47 Å²	47	63.1 Å²	63.1	49%	0.485	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-64.5	-16.9	175.8	0	0	0	0	0	114	D49 F53 I54	D49-G51 PolarHBondContact O-N 3.24Å; G51-F53 VanDerWaalsContact C-N 3.3Å; G51-I54 WeakPolarHBondContact O-CD1 3.42Å; G51-I54 WeakPolarHBondContact O-CG1 3.34Å
52	A	79.7	Confident	77.7	Confident	80 Å²	80	64.7 Å²	64.7	66%	0.661	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-76.3	-18.4	174.5	0	0	0	0	0	112.9	D49 R50	D49-A52 WeakPolarHBondContact O-CB 3.43Å; D49-A52 PolarHBondContact O-N 2.67Å; R50-A52 PolarHBondContact O-N 2.84Å
53	F	76.4	Confident	78.6	Confident	25 Å²	25	60.8 Å²	60.8	11%	0.11	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-110.2	34.8	-172.5	-47	-70.3	0	0	0	112.6	D49 R50 G51 T55 G56 T521 T561 Q562	D49-F53 WeakPolarHBondContact O-CE2 3.46Å; R50-F53 PolarHBondContact O-N 3.25Å; R50-F53 VanDerWaalsContact O-N 3.15Å; G51-F53 VanDerWaalsContact C-N 3.3Å; F53-T55 PolarHBondContact O-N 3.11Å; F53-G56 PolarHBondContact O-N 3.05Å; F53-T521 HydrophobicContact CB-CG2 4.47Å; F53-T521 HydrophobicContact CD1-CG2 3.95Å; F53-T521 HydrophobicContact CG-CG2 4.26Å; F53-T561 HydrophobicContact CD2-CG2 3.76Å; F53-T561 HydrophobicContact CE2-CG2 3.75Å; F53-Q562 HydrophobicContact CD1-CG 4.17Å; F53-Q562 HydrophobicContact CE1-CG 3.42Å; F53-Q562 VanDerWaalsContact CE1-CG 3.42Å; F53-Q562 HydrophobicContact CE2-CG 4.22Å; F53-Q562 HydrophobicContact CZ-CG 3.47Å; F53-Q562 VanDerWaalsContact CZ-CG 3.47Å
54	I	61.7	Low	79.1	Confident	123 Å²	123	53.3 Å²	53.3	63%	0.631	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-5.2	-179.1	-67.3	165.2	0	0	0	113.1	G51 G56 I61	G51-I54 WeakPolarHBondContact O-CD1 3.42Å; G51-I54 WeakPolarHBondContact O-CG1 3.34Å; I54-G56 PolarHBondContact O-N 2.84Å; I54-G56 VanDerWaalsContact O-N 3.11Å; I54-I61 HydrophobicContact CG1-CD1 4.42Å
55	T	60.3	Low	79.5	Confident	78 Å²	78	53 Å²	53	48%	0.479	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.5	175.7	52.9	0	0	0	0	113.5	F53 S517 D520	F53-T55 PolarHBondContact O-N 3.11Å; T55-S517 PolarHBondContact O-OG 2.91Å; T55-D520 HydrophobicContact CG2-CB 4.37Å
56	G	57.1	Low	79.9	Confident	13 Å²	13	53 Å²	53	13%	0.134	30%	0.297	C	S	.	.	S	Bend	trans	-91.4	162.7	179.2	0	0	0	0	0	116.6	F53 I54 S58	F53-G56 PolarHBondContact O-N 3.05Å; I54-G56 PolarHBondContact O-N 2.84Å; I54-G56 VanDerWaalsContact O-N 3.11Å; G56-S58 PolarHBondContact O-N 3.09Å
57	I	65.9	Low	80.1	Confident	54 Å²	54	51.1 Å²	51.1	28%	0.277	29%	0.287	S	S	.	.			trans	-54	120.9	170.8	-57.2	178.1	0	0	0	109.2	K59 Y60 I514	I57-K59 HydrophobicContact CG2-CB 4.03Å; I57-K59 PolarHBondContact O-N 2.86Å; I57-Y60 HydrophobicContact CB-CD2 3.99Å; I57-Y60 HydrophobicContact CB-CE2 3.89Å; I57-Y60 HydrophobicContact CD1-CE2 4.2Å; I57-Y60 HydrophobicContact CG1-CE2 4.34Å; I57-Y60 PolarHBondContact O-N 3.21Å; I57-I514 HydrophobicContact CD1-CD1 4.19Å; I57-I514 HydrophobicContact CD1-CG1 3.54Å
58	S	75.9	Confident	80.3	Confident	95 Å²	95	51.2 Å²	51.2	66%	0.664	29%	0.289	S	S	*	.	H	α-helix	trans	-48.1	-29.1	-173.9	60.4	0	0	0	0	114.7	G56 Y60 I61 E62	G56-S58 PolarHBondContact O-N 3.09Å; S58-Y60 VanDerWaalsContact C-N 3.31Å; S58-Y60 PolarHBondContact O-N 3.47Å; S58-I61 PolarHBondContact O-N 3.29Å; S58-E62 PolarHBondContact O-N 2.67Å
59	K	81.9	Confident	80.7	Confident	55 Å²	55	47 Å²	47	24%	0.239	27%	0.269	C	S	.	.	H	α-helix	trans	-51.1	-42.2	175.1	-176.7	-175.5	171.1	-172.5	0	113.7	I57 E62 E63 F153	I57-K59 HydrophobicContact CG2-CB 4.03Å; I57-K59 PolarHBondContact O-N 2.86Å; K59-E62 PolarHBondContact O-N 3.02Å; K59-E63 PolarHBondContact O-N 3.26Å; K59-F153 PolarHBondContact NZ-O 2.81Å
60	Y	85.3	Confident	81.1	Confident	10 Å²	10	44.8 Å²	44.8	4%	0.039	26%	0.257	C	S	.	.	H	α-helix	trans	-73.2	-34.2	-175.9	-58.7	-60.2	0	0	0	112.3	I57 S58 E63 A64 F153 T568 M569 S572	I57-Y60 HydrophobicContact CB-CD2 3.99Å; I57-Y60 HydrophobicContact CB-CE2 3.89Å; I57-Y60 HydrophobicContact CD1-CE2 4.2Å; I57-Y60 HydrophobicContact CG1-CE2 4.34Å; I57-Y60 PolarHBondContact O-N 3.21Å; S58-Y60 VanDerWaalsContact C-N 3.31Å; S58-Y60 PolarHBondContact O-N 3.47Å; Y60-E63 PolarHBondContact O-N 3.23Å; Y60-A64 PolarHBondContact O-N 3.26Å; Y60-F153 HydrophobicContact CE1-CD1 4.4Å; Y60-F153 HydrophobicContact CE1-CE1 4.48Å; Y60-T568 HydrophobicContact CD1-CG2 3.73Å; Y60-T568 HydrophobicContact CE1-CG2 4.22Å; Y60-M569 HydrophobicContact CD2-CG 3.62Å; Y60-M569 HydrophobicContact CD2-SD 4.22Å; Y60-M569 HydrophobicContact CE2-CG 3.64Å; Y60-M569 HydrophobicContact CE2-SD 4.38Å; Y60-M569 HydrophobicContact CG-CG 4.11Å; Y60-S572 WeakPolarHBondContact OH-CB 3.36Å; Y60-S572 PolarHBondContact OH-OG 3.38Å
61	I	84	Confident	81.4	Confident	31 Å²	31	45 Å²	45	16%	0.159	26%	0.26	C	S	.	.	H	α-helix	trans	-69.4	-39	175.3	-58.8	176	0	0	0	110.2	R50 I54 S58 A64 T65 M565	R50-I61 HydrophobicContact CB-CG2 4.5Å; R50-I61 HydrophobicContact CG-CG2 4.16Å; I54-I61 HydrophobicContact CG1-CD1 4.42Å; S58-I61 PolarHBondContact O-N 3.29Å; I61-A64 PolarHBondContact O-N 3.43Å; I61-T65 WeakPolarHBondContact O-CB 3.3Å; I61-T65 PolarHBondContact O-N 2.75Å; I61-T65 PolarHBondContact O-OG1 3.28Å; I61-M565 HydrophobicContact CG1-CE 3.78Å
62	E	85.9	Confident	82.1	Confident	85 Å²	85	48.6 Å²	48.6	40%	0.397	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-42.3	173.7	-165.7	-170.3	167	0	0	111.4	S58 K59 T65 R66	S58-E62 PolarHBondContact O-N 2.67Å; K59-E62 PolarHBondContact O-N 3.02Å; E62-T65 PolarHBondContact O-N 2.93Å; E62-R66 VanDerWaalsContact CD-NH1 3.26Å; E62-R66 PolarHBondContact O-N 3.04Å; E62-R66 VanDerWaalsContact O-N 3.14Å; E62-R66 IonicContact OE1-CZ 2.64Å; E62-R66 IonicContact OE1-NH1 3.45Å; E62-R66 PolarHBondContact OE1-NH1 2.92Å; E62-R66 IonicContact OE1-NH2 3.66Å; E62-R66 PolarHBondContact OE1-NH2 3.4Å
63	E	88.2	Confident	82.8	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.056	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-45.9	173.9	-170.3	174.4	124.3	0	0	111.6	K59 Y60 T65 R66 H67 S155 Y158	K59-E63 PolarHBondContact O-N 3.26Å; Y60-E63 PolarHBondContact O-N 3.23Å; E63-T65 VanDerWaalsContact C-N 3.32Å; E63-T65 PolarHBondContact O-N 3.25Å; E63-R66 PolarHBondContact O-N 3.4Å; E63-H67 VanDerWaalsContact O-CB 3.27Å; E63-H67 WeakPolarHBondContact O-CB 3.28Å; E63-H67 PolarHBondContact O-N 3.02Å; E63-S155 WeakPolarHBondContact OE1-CB 3.3Å; E63-S155 PolarHBondContact OE1-N 3.49Å; E63-S155 PolarHBondContact OE1-OG 2.94Å; E63-Y158 HydrophobicContact CG-CD2 4.07Å; E63-Y158 HydrophobicContact CG-CE2 4.39Å; E63-Y158 HydrophobicContact CG-CG 4.17Å
64	A	88.1	Confident	83.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-40.3	176.5	0	0	0	0	0	112.5	F47 Y60 I61 H67 A68 Y564	F47-A64 HydrophobicContact CB-CB 4.34Å; F47-A64 HydrophobicContact CD2-CB 4.36Å; F47-A64 WeakPolarHBondContact CD2-O 3.09Å; F47-A64 HydrophobicContact CG-CB 4.2Å; Y60-A64 PolarHBondContact O-N 3.26Å; I61-A64 PolarHBondContact O-N 3.43Å; A64-H67 WeakPolarHBondContact O-CB 3.36Å; A64-H67 PolarHBondContact O-N 3.39Å; A64-A68 PolarHBondContact O-N 2.72Å; A64-Y564 HydrophobicContact CB-CD1 4.39Å; A64-Y564 HydrophobicContact CB-CE1 3.88Å
65	T	90.2	Very high	85	Confident	40 Å²	40	43.3 Å²	43.3	25%	0.245	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-49.7	177.5	-57.5	0	0	0	0	111.2	R50 I61 E62 E63 H67 A68 E69	R50-T65 PolarHBondContact NE-OG1 3.3Å; I61-T65 WeakPolarHBondContact O-CB 3.3Å; I61-T65 PolarHBondContact O-N 2.75Å; I61-T65 PolarHBondContact O-OG1 3.28Å; E62-T65 PolarHBondContact O-N 2.93Å; E63-T65 VanDerWaalsContact C-N 3.32Å; E63-T65 PolarHBondContact O-N 3.25Å; T65-H67 VanDerWaalsContact C-N 3.27Å; T65-H67 PolarHBondContact O-N 3.13Å; T65-A68 WeakPolarHBondContact O-CB 3.41Å; T65-A68 PolarHBondContact O-N 3.46Å; T65-E69 PolarHBondContact O-N 3.38Å
66	R	90.9	Very high	86.7	Confident	49 Å²	49	41.7 Å²	41.7	19%	0.185	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-34.2	176.9	-67.9	-176.1	174.4	118	6.4	112.1	E62 E63 E69 L70 E140 R143 Y158	E62-R66 VanDerWaalsContact CD-NH1 3.26Å; E62-R66 PolarHBondContact O-N 3.04Å; E62-R66 VanDerWaalsContact O-N 3.14Å; E62-R66 IonicContact OE1-CZ 2.64Å; E62-R66 IonicContact OE1-NH1 3.45Å; E62-R66 PolarHBondContact OE1-NH1 2.92Å; E62-R66 IonicContact OE1-NH2 3.66Å; E62-R66 PolarHBondContact OE1-NH2 3.4Å; E63-R66 PolarHBondContact O-N 3.4Å; R66-E69 PolarHBondContact O-N 3.35Å; R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.88Å; R66-L70 VanDerWaalsContact O-N 3.13Å; R66-E140 WeakPolarHBondContact CD-OE1 3.46Å; R66-E140 IonicContact NE-OE1 3.08Å; R66-R143 VanDerWaalsContact NH1-CZ 3.33Å; R66-Y158 HydrophobicContact CB-CE2 4.37Å; R66-Y158 WeakPolarHBondContact CB-OH 3.45Å
67	H	91.2	Very high	88.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-42.4	177.1	-162.2	164.8	0	0	0	111.5	F47 E63 A64 T65 E69 L70 K71 Y158 T161 Y564	F47-H67 HydrophobicContact CE2-CB 4.15Å; E63-H67 VanDerWaalsContact O-CB 3.27Å; E63-H67 WeakPolarHBondContact O-CB 3.28Å; E63-H67 PolarHBondContact O-N 3.02Å; A64-H67 WeakPolarHBondContact O-CB 3.36Å; A64-H67 PolarHBondContact O-N 3.39Å; T65-H67 VanDerWaalsContact C-N 3.27Å; T65-H67 PolarHBondContact O-N 3.13Å; H67-E69 VanDerWaalsContact C-N 3.33Å; H67-E69 PolarHBondContact O-N 3.43Å; H67-L70 PolarHBondContact O-N 3.4Å; H67-K71 PolarHBondContact O-N 2.95Å; H67-Y158 HydrophobicContact CB-CD2 3.74Å; H67-Y158 HydrophobicContact CB-CE2 3.78Å; H67-Y158 AromaticContact CG-CD2 3.69Å; H67-Y158 AromaticContact ND1-CD2 3.83Å; H67-T161 WeakPolarHBondContact NE2-CB 3.33Å; H67-T161 PolarHBondContact NE2-OG1 3.43Å; H67-Y564 AromaticContact CE1-CE2 3.78Å; H67-Y564 AromaticContact ND1-CE2 3.47Å; H67-Y564 WeakPolarHBondContact ND1-CE2 3.31Å; H67-Y564 AromaticContact ND1-CZ 3.52Å; H67-Y564 PolarHBondContact ND1-OH 2.87Å
68	A	90.7	Very high	89.8	Confident	7 Å²	7	42.9 Å²	42.9	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-46.8	175	0	0	0	0	0	111.6	F47 A64 T65 L70 K71 E72	F47-A68 HydrophobicContact CD2-CB 4.18Å; A64-A68 PolarHBondContact O-N 2.72Å; T65-A68 WeakPolarHBondContact O-CB 3.41Å; T65-A68 PolarHBondContact O-N 3.46Å; A68-L70 VanDerWaalsContact C-N 3.34Å; A68-L70 PolarHBondContact O-N 3.41Å; A68-K71 WeakPolarHBondContact O-CB 3.14Å; A68-K71 PolarHBondContact O-N 2.99Å; A68-K71 VanDerWaalsContact O-N 3.14Å; A68-E72 PolarHBondContact O-N 3.12Å
69	E	92.8	Very high	90.7	Very high	77 Å²	77	45.5 Å²	45.5	36%	0.36	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-39.4	178.2	-65.3	173.7	-165.4	0	0	112.5	T65 R66 H67 E72 L73 R136	T65-E69 PolarHBondContact O-N 3.38Å; R66-E69 PolarHBondContact O-N 3.35Å; H67-E69 VanDerWaalsContact C-N 3.33Å; H67-E69 PolarHBondContact O-N 3.43Å; E69-E72 PolarHBondContact O-N 2.83Å; E69-L73 PolarHBondContact O-N 3.09Å; E69-L73 VanDerWaalsContact O-N 3.13Å; E69-R136 IonicContact OE2-CZ 3.9Å; E69-R136 IonicContact OE2-NE 2.75Å; E69-R136 PolarHBondContact OE2-NE 2.99Å; E69-R136 IonicContact OE2-NH2 3.27Å; E69-R136 PolarHBondContact OE2-NH2 2.9Å
70	L	93.6	Very high	91.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-37.5	175.6	-66.5	178.7	0	0	0	111.8	R66 H67 A68 E72 L73 L74 Y158 T161 L162 M165	R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.88Å; R66-L70 VanDerWaalsContact O-N 3.13Å; H67-L70 PolarHBondContact O-N 3.4Å; A68-L70 VanDerWaalsContact C-N 3.34Å; A68-L70 PolarHBondContact O-N 3.41Å; L70-E72 VanDerWaalsContact C-N 3.33Å; L70-L73 PolarHBondContact O-N 3.37Å; L70-L74 WeakPolarHBondContact O-CG 3.36Å; L70-L74 PolarHBondContact O-N 3.46Å; L70-Y158 HydrophobicContact CD1-CE2 3.83Å; L70-T161 HydrophobicContact CB-CG2 3.85Å; L70-T161 HydrophobicContact CD1-CG2 4.34Å; L70-L162 HydrophobicContact CD1-CD2 3.88Å; L70-M165 HydrophobicContact CD2-CE 4.35Å
71	K	90	Very high	91.8	Very high	63 Å²	63	43.3 Å²	43.3	27%	0.274	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-39.1	174.2	-79.7	178.6	165.4	-168.8	0	111.7	D44 N46 F47 H67 A68 L74 S75	D44-K71 IonicContact OD2-NZ 2.7Å; N46-K71 WeakPolarHBondContact OD1-CD 3.25Å; F47-K71 HydrophobicContact CE2-CD 4.5Å; H67-K71 PolarHBondContact O-N 2.95Å; A68-K71 WeakPolarHBondContact O-CB 3.14Å; A68-K71 PolarHBondContact O-N 2.99Å; A68-K71 VanDerWaalsContact O-N 3.14Å; K71-L74 WeakPolarHBondContact O-CB 3.46Å; K71-L74 PolarHBondContact O-N 3.36Å; K71-S75 PolarHBondContact O-N 3.14Å
72	E	93.4	Very high	92.4	Very high	123 Å²	123	42.1 Å²	42.1	58%	0.575	20%	0.201	S	C	*	.	H	α-helix	trans	-63.1	-44.1	174.9	-72.4	178.6	-176.4	0	0	112.1	A68 E69 L70 L74 S75 E76	A68-E72 PolarHBondContact O-N 3.12Å; E69-E72 PolarHBondContact O-N 2.83Å; L70-E72 VanDerWaalsContact C-N 3.33Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 3.42Å; E72-S75 PolarHBondContact O-N 3.28Å; E72-E76 PolarHBondContact O-N 2.91Å
73	L	95.8	Very high	92.8	Very high	17 Å²	17	40.1 Å²	40.1	9%	0.089	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-38.6	175	-73.5	175.1	0	0	0	112.3	E69 L70 E76 G77 F129 R136 M165	E69-L73 PolarHBondContact O-N 3.09Å; E69-L73 VanDerWaalsContact O-N 3.13Å; L70-L73 PolarHBondContact O-N 3.37Å; L73-E76 PolarHBondContact O-N 2.92Å; L73-G77 PolarHBondContact O-N 3.13Å; L73-F129 HydrophobicContact CD2-CE2 3.98Å; L73-F129 WeakPolarHBondContact O-CZ 3.48Å; L73-R136 HydrophobicContact CD1-CB 4.07Å; L73-R136 HydrophobicContact CD1-CG 3.88Å; L73-M165 HydrophobicContact CB-CE 4.1Å; L73-M165 HydrophobicContact CB-SD 4.22Å; L73-M165 HydrophobicContact CD1-CE 4.05Å
74	L	92.7	Very high	93.1	Very high	32 Å²	32	39.8 Å²	39.8	17%	0.168	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-44.5	174.7	-73.6	170.8	0	0	0	111.8	L70 K71 E72 G77 E78 T161 K164 M165 M168	L70-L74 WeakPolarHBondContact O-CG 3.36Å; L70-L74 PolarHBondContact O-N 3.46Å; K71-L74 WeakPolarHBondContact O-CB 3.46Å; K71-L74 PolarHBondContact O-N 3.36Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 3.42Å; L74-G77 PolarHBondContact O-N 2.96Å; L74-E78 PolarHBondContact O-N 3.4Å; L74-T161 HydrophobicContact CD1-CG2 3.96Å; L74-K164 HydrophobicContact CD1-CB 3.76Å; L74-K164 HydrophobicContact CD1-CD 4.23Å; L74-K164 HydrophobicContact CD2-CB 3.9Å; L74-M165 HydrophobicContact CD2-CG 4.05Å; L74-M165 HydrophobicContact CD2-SD 3.6Å; L74-M165 VanDerWaalsContact CD2-SD 3.6Å; L74-M165 HydrophobicContact CG-CG 4.29Å; L74-M165 HydrophobicContact CG-SD 3.67Å; L74-M168 HydrophobicContact CD2-CB 4.05Å; L74-M168 HydrophobicContact CD2-SD 4.1Å
75	S	91.8	Very high	93.5	Very high	68 Å²	68	39.8 Å²	39.8	48%	0.476	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-40	177.6	-175.7	0	0	0	0	112.1	K71 E72 E78 R79	K71-S75 PolarHBondContact O-N 3.14Å; E72-S75 PolarHBondContact O-N 3.28Å; S75-E78 PolarHBondContact O-N 3.36Å; S75-R79 PolarHBondContact O-N 2.89Å
76	E	95.8	Very high	93.7	Very high	44 Å²	44	38.2 Å²	38.2	21%	0.206	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-39.6	172.6	-174	175.4	-164.6	0	0	112.5	E72 L73 E78 R79 H80 F129 R132	E72-E76 PolarHBondContact O-N 2.91Å; L73-E76 PolarHBondContact O-N 2.92Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-E78 PolarHBondContact O-N 3.35Å; E76-R79 WeakPolarHBondContact O-CB 3.44Å; E76-R79 PolarHBondContact O-N 2.95Å; E76-H80 PolarHBondContact O-CD2 3.46Å; E76-H80 VanDerWaalsContact O-CD2 3.23Å; E76-H80 PolarHBondContact O-N 3.45Å; E76-H80 VanDerWaalsContact O-N 3.09Å; E76-F129 HydrophobicContact CB-CD2 4.31Å; E76-F129 HydrophobicContact CB-CE2 3.75Å; E76-F129 HydrophobicContact CB-CZ 4.41Å; E76-F129 HydrophobicContact CG-CD2 3.62Å; E76-F129 HydrophobicContact CG-CE2 3.59Å; E76-F129 HydrophobicContact CG-CG 4.5Å; E76-F129 HydrophobicContact CG-CZ 4.45Å; E76-F129 WeakPolarHBondContact OE2-CD2 3.46Å; E76-R132 IonicContact OE1-CZ 2.72Å; E76-R132 IonicContact OE1-NH2 2.68Å; E76-R132 PolarHBondContact OE1-NH2 2.93Å; E76-R132 IonicContact OE2-CZ 3.98Å; E76-R132 IonicContact OE2-NH2 2.67Å; E76-R132 PolarHBondContact OE2-NH2 3.5Å
77	G	95.6	Very high	94	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-40.3	174.3	0	0	0	0	0	113	L73 L74 R79 H80 A81 F129	L73-G77 PolarHBondContact O-N 3.13Å; L74-G77 PolarHBondContact O-N 2.96Å; G77-R79 PolarHBondContact O-N 3.4Å; G77-H80 PolarHBondContact O-N 3.11Å; G77-A81 PolarHBondContact O-N 3.28Å; G77-F129 VanDerWaalsContact CA-CZ 3.44Å
78	E	91.8	Very high	94.1	Very high	91 Å²	91	39.1 Å²	39.1	43%	0.425	19%	0.186	S	C	.	.	H	α-helix	trans	-61.7	-42.9	173.9	-174.1	170.7	-163.7	0	0	111.3	L74 S75 E76 H80 A81 V82 K684	L74-E78 PolarHBondContact O-N 3.4Å; S75-E78 PolarHBondContact O-N 3.36Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-E78 PolarHBondContact O-N 3.35Å; E78-H80 VanDerWaalsContact C-N 3.28Å; E78-H80 PolarHBondContact O-N 3.38Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.1Å; E78-A81 VanDerWaalsContact O-N 3.12Å; E78-V82 WeakPolarHBondContact O-CG2 3.43Å; E78-V82 PolarHBondContact O-N 2.86Å; E78-K684 VanDerWaalsContact OE1-CE 3.26Å; E78-K684 WeakPolarHBondContact OE1-CE 3.33Å
79	R	95	Very high	94.2	Very high	151 Å²	151	39.6 Å²	39.6	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-58.4	-39.9	174.1	-70.5	-175.4	-69.7	155.1	-1	112.3	S75 E76 G77 N83	S75-R79 PolarHBondContact O-N 2.89Å; E76-R79 WeakPolarHBondContact O-CB 3.44Å; E76-R79 PolarHBondContact O-N 2.95Å; G77-R79 PolarHBondContact O-N 3.4Å; R79-N83 VanDerWaalsContact O-CG 3.29Å; R79-N83 PolarHBondContact O-N 2.98Å; R79-N83 VanDerWaalsContact O-N 3.08Å; R79-N83 PolarHBondContact O-ND2 3.27Å
80	H	96.5	Very high	94.2	Very high	15 Å²	15	37.8 Å²	37.8	7%	0.069	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-41.4	174.5	-75.1	-64.5	0	0	0	112.4	E76 G77 E78 N83 L84 F126 F129 L172	E76-H80 PolarHBondContact O-CD2 3.46Å; E76-H80 VanDerWaalsContact O-CD2 3.23Å; E76-H80 PolarHBondContact O-N 3.45Å; E76-H80 VanDerWaalsContact O-N 3.09Å; G77-H80 PolarHBondContact O-N 3.11Å; E78-H80 VanDerWaalsContact C-N 3.28Å; E78-H80 PolarHBondContact O-N 3.38Å; H80-N83 PolarHBondContact O-N 3.37Å; H80-L84 WeakPolarHBondContact O-CG 3.36Å; H80-L84 PolarHBondContact O-N 3.16Å; H80-F126 HydrophobicContact CB-CD2 4.05Å; H80-F129 AromaticContact CD2-CD1 3.52Å; H80-F129 AromaticContact CD2-CG 3.5Å; H80-F129 VanDerWaalsContact CD2-CG 3.5Å; H80-F129 WeakPolarHBondContact CD2-CG 3.43Å; H80-F129 AromaticContact NE2-CG 3.63Å; H80-L172 HydrophobicContact CB-CD2 3.88Å
81	A	94.8	Very high	94	Very high	3 Å²	3	38.4 Å²	38.4	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-45.9	176.2	0	0	0	0	0	111.6	G77 E78 N83 L84 Y85 V171 L172 L175 F321	G77-A81 PolarHBondContact O-N 3.28Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.1Å; E78-A81 VanDerWaalsContact O-N 3.12Å; A81-N83 PolarHBondContact O-N 3.09Å; A81-L84 PolarHBondContact O-N 3.11Å; A81-Y85 WeakPolarHBondContact O-CB 3.44Å; A81-Y85 PolarHBondContact O-N 3.48Å; A81-V171 HydrophobicContact CB-CG1 3.87Å; A81-L172 HydrophobicContact CB-CD2 3.95Å; A81-L175 HydrophobicContact CB-CD1 3.68Å; A81-L175 WeakPolarHBondContact O-CD1 3.07Å; A81-F321 HydrophobicContact CB-CD2 4.07Å; A81-F321 HydrophobicContact CB-CE2 3.64Å; A81-F321 HydrophobicContact CB-CZ 4.05Å
82	V	94.8	Very high	93.9	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-55.8	-49.5	173.2	169.3	0	0	0	0	111	E78 L84 Y85 T86 F321 F685	E78-V82 WeakPolarHBondContact O-CG2 3.43Å; E78-V82 PolarHBondContact O-N 2.86Å; V82-L84 VanDerWaalsContact C-N 3.31Å; V82-L84 PolarHBondContact O-N 2.94Å; V82-Y85 PolarHBondContact O-N 3.34Å; V82-T86 WeakPolarHBondContact O-CB 2.97Å; V82-T86 WeakPolarHBondContact O-CG2 3.25Å; V82-T86 PolarHBondContact O-N 2.69Å; V82-T86 PolarHBondContact O-OG1 3.48Å; V82-F321 HydrophobicContact CB-CZ 4.48Å; V82-F321 HydrophobicContact CG2-CZ 3.82Å; V82-F685 HydrophobicContact CB-CD1 4.39Å; V82-F685 HydrophobicContact CG1-CB 4.1Å; V82-F685 HydrophobicContact CG1-CD1 3.89Å; V82-F685 HydrophobicContact CG1-CG 4.41Å; V82-F685 VanDerWaalsContact CG1-O 3.26Å; V82-F685 WeakPolarHBondContact CG1-O 3.32Å; V82-F685 HydrophobicContact CG2-CD1 3.83Å; V82-F685 HydrophobicContact CG2-CE1 4.3Å
83	N	94.5	Very high	93.6	Very high	43 Å²	43	39.9 Å²	39.9	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-37.8	-179.7	-75.1	-23.2	0	0	0	112.4	R79 H80 A81 W87 K687	R79-N83 VanDerWaalsContact O-CG 3.29Å; R79-N83 PolarHBondContact O-N 2.98Å; R79-N83 VanDerWaalsContact O-N 3.08Å; R79-N83 PolarHBondContact O-ND2 3.27Å; H80-N83 PolarHBondContact O-N 3.37Å; A81-N83 PolarHBondContact O-N 3.09Å; N83-W87 WeakPolarHBondContact O-CB 3.36Å; N83-W87 PolarHBondContact O-N 2.98Å; N83-K687 PolarHBondContact OD1-NZ 2.72Å
84	L	95.8	Very high	93	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-48.3	176.7	-70	169.5	0	0	0	111.6	H80 A81 V82 T86 W87 F126 L172 L175 K179 I182	H80-L84 WeakPolarHBondContact O-CG 3.36Å; H80-L84 PolarHBondContact O-N 3.16Å; A81-L84 PolarHBondContact O-N 3.11Å; V82-L84 VanDerWaalsContact C-N 3.31Å; V82-L84 PolarHBondContact O-N 2.94Å; L84-T86 PolarHBondContact O-N 3.38Å; L84-W87 VanDerWaalsContact O-CB 3.3Å; L84-W87 WeakPolarHBondContact O-CB 3.41Å; L84-W87 PolarHBondContact O-N 3.43Å; L84-F126 HydrophobicContact CD1-CD1 4.42Å; L84-F126 HydrophobicContact CD1-CE1 3.86Å; L84-F126 HydrophobicContact CD1-CE2 4.03Å; L84-F126 HydrophobicContact CD1-CZ 3.65Å; L84-F126 HydrophobicContact CD2-CD1 4.21Å; L84-F126 HydrophobicContact CD2-CE1 4.1Å; L84-L172 HydrophobicContact CD1-CD2 4Å; L84-L175 HydrophobicContact CB-CB 3.98Å; L84-L175 HydrophobicContact CB-CD1 4.39Å; L84-L175 HydrophobicContact CD1-CB 4.1Å; L84-K179 WeakPolarHBondContact O-CE 3.48Å; L84-K179 WeakPolarHBondContact O-CG 3.49Å; L84-I182 HydrophobicContact CD2-CD1 4Å; L84-I182 HydrophobicContact CD2-CG2 4.43Å
85	Y	95.8	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-47.9	-179.1	177.7	-109.5	0	0	0	112	A81 V82 W87 L175 K179 F321 D323 F626 E628 F685	A81-Y85 WeakPolarHBondContact O-CB 3.44Å; A81-Y85 PolarHBondContact O-N 3.48Å; V82-Y85 PolarHBondContact O-N 3.34Å; Y85-W87 PolarHBondContact O-N 3.49Å; Y85-L175 HydrophobicContact CD2-CD2 4.01Å; Y85-L175 HydrophobicContact CG-CD2 4.44Å; Y85-K179 WeakPolarHBondContact O-CE 3.3Å; Y85-K179 PolarHBondContact O-NZ 2.68Å; Y85-F321 VanDerWaalsContact CB-CE1 3.42Å; Y85-F321 HydrophobicContact CD1-CD1 4.05Å; Y85-F321 AromaticContact CD1-CE1 3.78Å; Y85-F321 HydrophobicContact CD1-CE1 3.78Å; Y85-F321 AromaticContact CD2-CD1 3.8Å; Y85-F321 HydrophobicContact CD2-CD1 3.8Å; Y85-F321 HydrophobicContact CD2-CE1 4.32Å; Y85-F321 AromaticContact CG-CD1 3.52Å; Y85-F321 HydrophobicContact CG-CD1 3.52Å; Y85-F321 AromaticContact CG-CE1 3.58Å; Y85-F321 HydrophobicContact CG-CE1 3.58Å; Y85-D323 WeakPolarHBondContact CE2-OD1 3.37Å; Y85-D323 VanDerWaalsContact CZ-OD1 3.25Å; Y85-D323 PolarHBondContact OH-N 3.45Å; Y85-D323 PolarHBondContact OH-OD1 3.37Å; Y85-F626 WeakPolarHBondContact OH-CB 3.23Å; Y85-E628 HydrophobicContact CD1-CB 4.43Å; Y85-E628 HydrophobicContact CD1-CG 4.31Å; Y85-E628 HydrophobicContact CD2-CB 4.27Å; Y85-E628 HydrophobicContact CE1-CB 3.95Å; Y85-E628 HydrophobicContact CE1-CG 3.77Å; Y85-E628 HydrophobicContact CE2-CB 3.77Å; Y85-E628 PolarHBondContact OH-N 3.08Å; Y85-F685 HydrophobicContact CD1-CE1 4.41Å; Y85-F685 HydrophobicContact CD1-CE2 4.48Å; Y85-F685 HydrophobicContact CD1-CZ 4.07Å; Y85-F685 HydrophobicContact CE1-CE2 4.15Å; Y85-F685 AromaticContact CE1-CZ 3.96Å; Y85-F685 HydrophobicContact CE1-CZ 3.96Å
86	T	95.5	Very high	91.8	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.037	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	7.7	-178.1	61.9	0	0	0	0	113.8	V82 L84 R88 F685 K687 F689 L690	V82-T86 WeakPolarHBondContact O-CB 2.97Å; V82-T86 WeakPolarHBondContact O-CG2 3.25Å; V82-T86 PolarHBondContact O-N 2.69Å; V82-T86 PolarHBondContact O-OG1 3.48Å; L84-T86 PolarHBondContact O-N 3.38Å; T86-R88 PolarHBondContact O-N 2.97Å; T86-F685 HydrophobicContact CG2-CB 4.43Å; T86-F685 HydrophobicContact CG2-CG 4.32Å; T86-K687 HydrophobicContact CG2-CG 3.99Å; T86-K687 WeakPolarHBondContact OG1-CE 3.21Å; T86-F689 WeakPolarHBondContact O-CZ 3.46Å; T86-L690 HydrophobicContact CG2-CD1 3.71Å
87	W	95.4	Very high	91.1	Very high	16 Å²	16	42.6 Å²	42.6	6%	0.061	22%	0.224	C	C	.	.			trans	-75.5	110.5	178.5	-162.8	-64.3	0	0	0	111	N83 L84 Y85 E119 K122 L123 K179 I182 D185	N83-W87 WeakPolarHBondContact O-CB 3.36Å; N83-W87 PolarHBondContact O-N 2.98Å; L84-W87 VanDerWaalsContact O-CB 3.3Å; L84-W87 WeakPolarHBondContact O-CB 3.41Å; L84-W87 PolarHBondContact O-N 3.43Å; Y85-W87 PolarHBondContact O-N 3.49Å; W87-E119 HydrophobicContact CH2-CB 3.68Å; W87-E119 WeakPolarHBondContact CH2-O 3.4Å; W87-E119 HydrophobicContact CZ2-CB 3.83Å; W87-K122 HydrophobicContact CZ3-CB 4.47Å; W87-L123 HydrophobicContact CE3-CD2 4.27Å; W87-L123 HydrophobicContact CH2-CD1 3.86Å; W87-L123 HydrophobicContact CH2-CD2 3.7Å; W87-L123 HydrophobicContact CH2-CG 3.52Å; W87-L123 HydrophobicContact CZ2-CD1 4.14Å; W87-L123 HydrophobicContact CZ2-CD2 4.41Å; W87-L123 HydrophobicContact CZ2-CG 4.28Å; W87-L123 HydrophobicContact CZ3-CD2 3.62Å; W87-L123 HydrophobicContact CZ3-CG 3.91Å; W87-K179 PolarHBondContact O-NZ 3.23Å; W87-I182 HydrophobicContact CB-CG2 4.07Å; W87-I182 HydrophobicContact CD2-CG2 3.49Å; W87-I182 VanDerWaalsContact CD2-CG2 3.49Å; W87-I182 HydrophobicContact CE3-CG2 3.95Å; W87-I182 HydrophobicContact CG-CG2 3.52Å; W87-I182 HydrophobicContact CZ2-CG2 4.43Å; W87-D185 PolarHBondContact NE1-OD2 3.14Å
88	R	94.6	Very high	90.4	Very high	53 Å²	53	52.1 Å²	52.1	20%	0.2	27%	0.265	C	S	.	.			trans	-99.4	146	169.1	-66.4	-169.1	178.1	177.1	15	110.8	T86 C90 E628 I639 F689 E693	T86-R88 PolarHBondContact O-N 2.97Å; R88-C90 PolarHBondContact O-N 2.73Å; R88-E628 IonicContact CZ-OE1 3.35Å; R88-E628 IonicContact CZ-OE2 2.73Å; R88-E628 IonicContact NE-OE1 3.53Å; R88-E628 PolarHBondContact NE-OE1 3.46Å; R88-E628 IonicContact NE-OE2 3.75Å; R88-E628 PolarHBondContact NE-OE2 2.68Å; R88-E628 IonicContact NH2-OE1 2.94Å; R88-E628 PolarHBondContact NH2-OE1 3.41Å; R88-E628 IonicContact NH2-OE2 2.86Å; R88-I639 PolarHBondContact NH1-O 2.67Å; R88-F689 HydrophobicContact CG-CE2 4.48Å; R88-E693 IonicContact CZ-OE1 3.48Å; R88-E693 VanDerWaalsContact CZ-OE1 3.25Å; R88-E693 IonicContact CZ-OE2 3.77Å; R88-E693 IonicContact NH1-OE1 3.14Å; R88-E693 PolarHBondContact NH1-OE1 3.29Å; R88-E693 IonicContact NH1-OE2 3.75Å; R88-E693 IonicContact NH2-OE1 2.95Å; R88-E693 PolarHBondContact NH2-OE1 3.3Å; R88-E693 VanDerWaalsContact NH2-OE1 3.17Å; R88-E693 IonicContact NH2-OE2 3.51Å; R88-E693 PolarHBondContact NH2-OE2 3.13Å
89	C	93.2	Very high	90	Very high	16 Å²	16	50.6 Å²	50.6	11%	0.108	26%	0.264	C	S	.	.			trans	-67.9	104	-171.6	-160	0	0	0	0	112.2	S91 R92 S181 D185	C89-S91 VanDerWaalsContact C-N 3.3Å; C89-S91 PolarHBondContact O-N 2.81Å; C89-S91 PolarHBondContact SG-OG 3.17Å; C89-R92 HydrophobicContact CB-CB 4.45Å; C89-R92 HydrophobicContact CB-CG 3.86Å; C89-R92 PolarHBondContact O-N 3.37Å; C89-S181 WeakPolarHBondContact CB-OG 3.32Å; C89-D185 WeakPolarHBondContact CA-OD2 3.49Å; C89-D185 PolarHBondContact SG-OD1 3.18Å
90	C	92.2	Very high	89.4	Confident	39 Å²	39	49.4 Å²	49.4	26%	0.264	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-63.6	-37.3	176.1	-66.7	0	0	0	0	111.5	R88 R92 A93 V94 L116 D185	R88-C90 PolarHBondContact O-N 2.73Å; C90-R92 PolarHBondContact O-N 2.64Å; C90-R92 VanDerWaalsContact O-N 3.07Å; C90-A93 WeakPolarHBondContact O-CB 3.39Å; C90-A93 PolarHBondContact O-N 3.34Å; C90-V94 WeakPolarHBondContact O-CG2 3.5Å; C90-V94 PolarHBondContact O-N 2.92Å; C90-L116 HydrophobicContact CB-CD2 3.44Å; C90-L116 VanDerWaalsContact CB-CD2 3.44Å; C90-D185 PolarHBondContact N-OD1 3Å; C90-D185 VanDerWaalsContact N-OD1 3.13Å; C90-D185 PolarHBondContact N-OD2 3.4Å
91	S	89	Confident	88.6	Confident	14 Å²	14	57.2 Å²	57.2	10%	0.098	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.6	-14.9	-178.4	54.4	0	0	0	0	114.6	C89 D185 T188	C89-S91 VanDerWaalsContact C-N 3.3Å; C89-S91 PolarHBondContact O-N 2.81Å; C89-S91 PolarHBondContact SG-OG 3.17Å; S91-D185 WeakPolarHBondContact CB-OD1 3.41Å; S91-D185 PolarHBondContact N-OD1 3.38Å; S91-D185 PolarHBondContact OG-OD1 3.01Å; S91-T188 WeakPolarHBondContact CB-OG1 3.48Å
92	R	88.3	Confident	88.1	Confident	129 Å²	129	59.2 Å²	59.2	49%	0.487	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-77.1	-26.5	170.1	-67	177	-172.5	-93	5.3	112.9	C89 C90 M635	C89-R92 HydrophobicContact CB-CB 4.45Å; C89-R92 HydrophobicContact CB-CG 3.86Å; C89-R92 PolarHBondContact O-N 3.37Å; C90-R92 PolarHBondContact O-N 2.64Å; C90-R92 VanDerWaalsContact O-N 3.07Å; R92-M635 VanDerWaalsContact CZ-C 3.44Å; R92-M635 VanDerWaalsContact NH1-C 3.35Å; R92-M635 PolarHBondContact NH1-O 2.94Å; R92-M635 PolarHBondContact NH2-O 2.9Å
93	A	87.3	Confident	87.6	Confident	87 Å²	87	65.2 Å²	65.2	72%	0.719	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-23.9	-179	0	0	0	0	0	112.9	C90	C90-A93 WeakPolarHBondContact O-CB 3.39Å; C90-A93 PolarHBondContact O-N 3.34Å
94	V	83.4	Confident	87.3	Confident	23 Å²	23	66.1 Å²	66.1	14%	0.139	36%	0.359	C	S	.	.	S	Bend	trans	-83.2	131.1	-177.4	-167.2	0	0	0	0	110.9	C90 M96 I112	C90-V94 WeakPolarHBondContact O-CG2 3.5Å; C90-V94 PolarHBondContact O-N 2.92Å; V94-M96 PolarHBondContact O-N 2.98Å; V94-I112 HydrophobicContact CB-CG1 4.25Å; V94-I112 HydrophobicContact CG1-CD1 4.11Å; V94-I112 HydrophobicContact CG1-CG1 3.31Å
95	P	79.1	Confident	86.9	Confident	86 Å²	86	68.1 Å²	68.1	56%	0.558	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-59.2	126.1	175.9	21	-32.4	0	0	0	111.2	I108	P95-I108 WeakPolarHBondContact O-CG2 3.31Å
96	M	79.9	Confident	86.5	Confident	83 Å²	83	70.3 Å²	70.3	41%	0.409	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-88.5	140	175.4	-71.5	-73.8	-155.4	0	0	110.7	V94 K98 T188	V94-M96 PolarHBondContact O-N 2.98Å; M96-K98 PolarHBondContact O-N 3.3Å; M96-T188 HydrophobicContact CE-CG2 3.89Å; M96-T188 HydrophobicContact SD-CG2 4.25Å
97	A	79.9	Confident	86.1	Confident	27 Å²	27	76.2 Å²	76.2	22%	0.223	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-61.7	120.7	171.4	0	0	0	0	0	110.2	R105	A97-R105 HydrophobicContact CB-CG 3.9Å
98	K	82.6	Confident	85.9	Confident	201 Å²	201	76 Å²	76	87%	0.874	41%	0.411	S	S	*	.			trans	-79.5	-29.5	-175.6	-67.6	-175.7	179.6	178.9	0	112.9	M96	M96-K98 PolarHBondContact O-N 3.3Å
99	S	83.2	Confident	85.7	Confident	58 Å²	58	74.9 Å²	74.9	41%	0.406	41%	0.407	S	S	.	.	S	Bend	trans	-146.5	163.4	177.6	71.7	0	0	0	0	110.5	E101 Q102	S99-E101 PolarHBondContact O-N 2.81Å; S99-E101 PolarHBondContact OG-N 3.31Å; S99-Q102 PolarHBondContact O-N 2.78Å
100	N	81.2	Confident	85.6	Confident	127 Å²	127	78.4 Å²	78.4	68%	0.679	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-20.3	176.4	-72.4	-26.8	0	0	0	113	R105	N100-R105 PolarHBondContact O-NH1 3.34Å; N100-R105 VanDerWaalsContact OD1-CZ 3.28Å; N100-R105 PolarHBondContact OD1-NH1 3.46Å; N100-R105 PolarHBondContact OD1-NH2 3.26Å
101	E	80.8	Confident	85.5	Confident	179 Å²	179	79.8 Å²	79.8	84%	0.836	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	0	-175.4	-62.1	173.3	178.5	0	0	113.2	S99	S99-E101 PolarHBondContact O-N 2.81Å; S99-E101 PolarHBondContact OG-N 3.31Å
102	Q	84.3	Confident	85.6	Confident	44 Å²	44	79.1 Å²	79.1	21%	0.206	43%	0.428	C	S	.	.			trans	-64.8	125.9	-177.2	-174.9	174	-15.7	0	0	110.9	S99 N104 R105 I108	S99-Q102 PolarHBondContact O-N 2.78Å; Q102-N104 VanDerWaalsContact CG-OD1 3.24Å; Q102-N104 WeakPolarHBondContact CG-OD1 3.46Å; Q102-N104 PolarHBondContact NE2-OD1 2.93Å; Q102-N104 PolarHBondContact O-N 2.92Å; Q102-R105 HydrophobicContact CB-CB 4.4Å; Q102-R105 WeakPolarHBondContact O-CB 3.41Å; Q102-R105 PolarHBondContact O-N 2.92Å; Q102-R105 VanDerWaalsContact O-N 3.13Å; Q102-I108 VanDerWaalsContact NE2-CD1 3.32Å
103	P	83.9	Confident	85.8	Confident	133 Å²	133	73.6 Å²	73.6	86%	0.864	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-43.5	-170.6	-23.1	31.3	0	0	0	113.6	R105	P103-R105 PolarHBondContact O-N 3.43Å
104	N	88.4	Confident	86	Confident	63 Å²	63	76.3 Å²	76.3	34%	0.337	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	20.8	-179.1	65	-23.4	0	0	0	113.2	Q102 A106 E107 I108	Q102-N104 VanDerWaalsContact CG-OD1 3.24Å; Q102-N104 WeakPolarHBondContact CG-OD1 3.46Å; Q102-N104 PolarHBondContact NE2-OD1 2.93Å; Q102-N104 PolarHBondContact O-N 2.92Å; N104-A106 PolarHBondContact O-N 2.89Å; N104-E107 HydrophobicContact CB-CB 4.42Å; N104-E107 WeakPolarHBondContact CB-OE2 3.24Å; N104-E107 PolarHBondContact O-N 3.14Å; N104-I108 WeakPolarHBondContact O-CB 3.37Å; N104-I108 VanDerWaalsContact O-CG1 3.25Å; N104-I108 WeakPolarHBondContact O-CG1 3.3Å; N104-I108 PolarHBondContact O-N 3.45Å
105	R	87.1	Confident	86.4	Confident	46 Å²	46	78.5 Å²	78.5	17%	0.174	42%	0.419	C	S	.	.	H	α-helix	trans	-61.5	-41.2	-178.7	178.9	175.9	-178.2	-158	0.7	112.8	A97 N100 Q102 P103 Y109 F195	A97-R105 HydrophobicContact CB-CG 3.9Å; N100-R105 PolarHBondContact O-NH1 3.34Å; N100-R105 VanDerWaalsContact OD1-CZ 3.28Å; N100-R105 PolarHBondContact OD1-NH1 3.46Å; N100-R105 PolarHBondContact OD1-NH2 3.26Å; Q102-R105 HydrophobicContact CB-CB 4.4Å; Q102-R105 WeakPolarHBondContact O-CB 3.41Å; Q102-R105 PolarHBondContact O-N 2.92Å; Q102-R105 VanDerWaalsContact O-N 3.13Å; P103-R105 PolarHBondContact O-N 3.43Å; R105-Y109 HydrophobicContact CG-CD2 3.97Å; R105-Y109 HydrophobicContact CG-CE2 3.71Å; R105-Y109 WeakPolarHBondContact O-CD2 3.28Å; R105-Y109 PolarHBondContact O-N 3.43Å; R105-Y109 VanDerWaalsContact O-N 3.11Å; R105-F195 HydrophobicContact CG-CZ 4.44Å
106	A	86.8	Confident	87.1	Confident	46 Å²	46	74.5 Å²	74.5	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-65.2	-46.8	177.4	0	0	0	0	0	111	N104 I108 Y109 D110 F195	N104-A106 PolarHBondContact O-N 2.89Å; A106-I108 VanDerWaalsContact C-N 3.32Å; A106-I108 PolarHBondContact O-N 2.99Å; A106-Y109 PolarHBondContact O-N 3.42Å; A106-Y109 VanDerWaalsContact O-N 3.09Å; A106-D110 PolarHBondContact O-N 3.34Å; A106-F195 HydrophobicContact CB-CE1 4.39Å
107	E	88.6	Confident	87.7	Confident	130 Å²	130	75.4 Å²	75.4	61%	0.607	40%	0.396	S	S	*	.	H	α-helix	trans	-58.8	-41.7	176.5	-63.1	173	-177.4	0	0	112.3	N104 Y109 D110 T111	N104-E107 HydrophobicContact CB-CB 4.42Å; N104-E107 WeakPolarHBondContact CB-OE2 3.24Å; N104-E107 PolarHBondContact O-N 3.14Å; E107-Y109 VanDerWaalsContact C-N 3.35Å; E107-Y109 PolarHBondContact O-N 3.45Å; E107-D110 PolarHBondContact O-N 3.48Å; E107-T111 WeakPolarHBondContact O-CB 3.48Å; E107-T111 PolarHBondContact O-N 2.86Å; E107-T111 PolarHBondContact O-OG1 3.18Å
108	I	90	Very high	88.4	Confident	12 Å²	12	77.5 Å²	77.5	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-59.6	-46.7	174.6	-73.7	167.1	0	0	0	110.4	P95 Q102 N104 A106 T111 I112	P95-I108 WeakPolarHBondContact O-CG2 3.31Å; Q102-I108 VanDerWaalsContact NE2-CD1 3.32Å; N104-I108 WeakPolarHBondContact O-CB 3.37Å; N104-I108 VanDerWaalsContact O-CG1 3.25Å; N104-I108 WeakPolarHBondContact O-CG1 3.3Å; N104-I108 PolarHBondContact O-N 3.45Å; A106-I108 VanDerWaalsContact C-N 3.32Å; A106-I108 PolarHBondContact O-N 2.99Å; I108-T111 PolarHBondContact O-N 2.88Å; I108-I112 HydrophobicContact CG2-CD1 3.75Å; I108-I112 HydrophobicContact CG2-CG1 4.46Å; I108-I112 VanDerWaalsContact O-CG1 3.25Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.07Å
109	Y	91.3	Very high	88.9	Confident	29 Å²	29	70.3 Å²	70.3	11%	0.114	38%	0.377	C	S	.	.	H	α-helix	trans	-68.8	-37.1	179.1	-74.3	-45.6	0	0	0	112.9	R105 A106 E107 T111 I112 V113 A192 F195	R105-Y109 HydrophobicContact CG-CD2 3.97Å; R105-Y109 HydrophobicContact CG-CE2 3.71Å; R105-Y109 WeakPolarHBondContact O-CD2 3.28Å; R105-Y109 PolarHBondContact O-N 3.43Å; R105-Y109 VanDerWaalsContact O-N 3.11Å; A106-Y109 PolarHBondContact O-N 3.42Å; A106-Y109 VanDerWaalsContact O-N 3.09Å; E107-Y109 VanDerWaalsContact C-N 3.35Å; E107-Y109 PolarHBondContact O-N 3.45Å; Y109-T111 VanDerWaalsContact C-N 3.31Å; Y109-T111 PolarHBondContact O-N 3.3Å; Y109-I112 HydrophobicContact CD1-CD1 3.72Å; Y109-I112 HydrophobicContact CE1-CD1 4.2Å; Y109-I112 WeakPolarHBondContact O-CB 3.26Å; Y109-I112 PolarHBondContact O-N 3.38Å; Y109-V113 WeakPolarHBondContact O-CG2 3.45Å; Y109-V113 PolarHBondContact O-N 3.31Å; Y109-A192 HydrophobicContact CD1-CB 3.5Å; Y109-A192 VanDerWaalsContact CD1-CB 3.5Å; Y109-A192 HydrophobicContact CE1-CB 4.33Å; Y109-A192 HydrophobicContact CG-CB 4.06Å; Y109-F195 HydrophobicContact CD2-CB 3.95Å; Y109-F195 AromaticContact CD2-CD1 3.31Å; Y109-F195 HydrophobicContact CD2-CD1 3.31Å; Y109-F195 HydrophobicContact CD2-CD2 4.28Å; Y109-F195 AromaticContact CD2-CE1 3.81Å; Y109-F195 HydrophobicContact CD2-CE1 3.81Å; Y109-F195 AromaticContact CD2-CG 3.57Å; Y109-F195 HydrophobicContact CD2-CG 3.57Å; Y109-F195 HydrophobicContact CD2-CZ 4.47Å; Y109-F195 HydrophobicContact CE2-CB 4Å; Y109-F195 AromaticContact CE2-CD1 3.85Å; Y109-F195 HydrophobicContact CE2-CD1 3.85Å; Y109-F195 AromaticContact CE2-CD2 3.96Å; Y109-F195 HydrophobicContact CE2-CD2 3.96Å; Y109-F195 HydrophobicContact CE2-CE1 4.31Å; Y109-F195 HydrophobicContact CE2-CE2 4.41Å; Y109-F195 AromaticContact CE2-CG 3.64Å; Y109-F195 HydrophobicContact CE2-CG 3.64Å; Y109-F195 HydrophobicContact CG-CD1 4.23Å
110	D	90.1	Very high	89.4	Confident	90 Å²	90	67.9 Å²	67.9	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-46.3	174	-88.3	-13.7	0	0	0	110.1	A106 E107 I112 V113 E114 L196	A106-D110 PolarHBondContact O-N 3.34Å; E107-D110 PolarHBondContact O-N 3.48Å; D110-I112 PolarHBondContact O-N 3.42Å; D110-V113 PolarHBondContact O-N 3.09Å; D110-E114 PolarHBondContact O-N 3.24Å; D110-L196 WeakPolarHBondContact OD1-CD1 3.24Å; D110-L196 VanDerWaalsContact OD1-CD2 3.28Å; D110-L196 WeakPolarHBondContact OD1-CD2 3.42Å
111	T	90	Very high	90	Very high	69 Å²	69	68.1 Å²	68.1	42%	0.423	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-41.1	176.6	-49	0	0	0	0	111.8	E107 I108 Y109 V113 E114 V115	E107-T111 WeakPolarHBondContact O-CB 3.48Å; E107-T111 PolarHBondContact O-N 2.86Å; E107-T111 PolarHBondContact O-OG1 3.18Å; I108-T111 PolarHBondContact O-N 2.88Å; Y109-T111 VanDerWaalsContact C-N 3.31Å; Y109-T111 PolarHBondContact O-N 3.3Å; T111-V113 VanDerWaalsContact C-N 3.31Å; T111-V113 PolarHBondContact O-N 2.85Å; T111-E114 PolarHBondContact O-N 2.77Å; T111-V115 HydrophobicContact CG2-CG2 4.4Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 3.13Å
112	I	92.1	Very high	90.7	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-58.2	-45.2	174.9	-74.4	162.9	0	0	0	110.4	V94 I108 Y109 D110 L116 T188 A192	V94-I112 HydrophobicContact CB-CG1 4.25Å; V94-I112 HydrophobicContact CG1-CD1 4.11Å; V94-I112 HydrophobicContact CG1-CG1 3.31Å; I108-I112 HydrophobicContact CG2-CD1 3.75Å; I108-I112 HydrophobicContact CG2-CG1 4.46Å; I108-I112 VanDerWaalsContact O-CG1 3.25Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.07Å; Y109-I112 HydrophobicContact CD1-CD1 3.72Å; Y109-I112 HydrophobicContact CE1-CD1 4.2Å; Y109-I112 WeakPolarHBondContact O-CB 3.26Å; Y109-I112 PolarHBondContact O-N 3.38Å; D110-I112 PolarHBondContact O-N 3.42Å; I112-L116 HydrophobicContact CG2-CD1 3.78Å; I112-L116 VanDerWaalsContact O-CB 3.28Å; I112-L116 WeakPolarHBondContact O-CB 3.48Å; I112-L116 WeakPolarHBondContact O-CG 3.5Å; I112-L116 PolarHBondContact O-N 2.97Å; I112-T188 HydrophobicContact CD1-CG2 4.45Å; I112-T188 HydrophobicContact CG2-CG2 4.05Å; I112-A192 HydrophobicContact CB-CB 4.02Å; I112-A192 HydrophobicContact CG2-CB 3.6Å
113	V	91.6	Very high	91.3	Very high	12 Å²	12	60.9 Å²	60.9	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-47.5	179.1	172.2	0	0	0	0	110.2	Y109 D110 T111 V115 L116 Q117 Y189 A192 T193 L196	Y109-V113 WeakPolarHBondContact O-CG2 3.45Å; Y109-V113 PolarHBondContact O-N 3.31Å; D110-V113 PolarHBondContact O-N 3.09Å; T111-V113 VanDerWaalsContact C-N 3.31Å; T111-V113 PolarHBondContact O-N 2.85Å; V113-V115 VanDerWaalsContact C-N 3.35Å; V113-V115 PolarHBondContact O-N 3.18Å; V113-L116 PolarHBondContact O-N 2.64Å; V113-Q117 WeakPolarHBondContact O-CB 3.46Å; V113-Q117 PolarHBondContact O-N 3.37Å; V113-Y189 HydrophobicContact CB-CE2 4.48Å; V113-Y189 HydrophobicContact CG1-CE2 4.04Å; V113-Y189 HydrophobicContact CG2-CE2 4.46Å; V113-A192 HydrophobicContact CG2-CB 3.72Å; V113-T193 HydrophobicContact CG1-CG2 4.18Å; V113-T193 HydrophobicContact CG2-CG2 3.62Å; V113-L196 HydrophobicContact CB-CD1 4.43Å; V113-L196 HydrophobicContact CG2-CD1 3.77Å
114	E	91.2	Very high	91.8	Very high	145 Å²	145	56.3 Å²	56.3	68%	0.678	29%	0.288	S	S	*	.	H	α-helix	trans	-54.8	-47.9	178.4	-173.5	-177.2	175	0	0	112.2	D110 T111 P118	D110-E114 PolarHBondContact O-N 3.24Å; T111-E114 PolarHBondContact O-N 2.77Å; E114-P118 WeakPolarHBondContact O-CD 3.24Å
115	V	92.1	Very high	92.2	Very high	69 Å²	69	58 Å²	58	42%	0.418	29%	0.294	S	S	.	.	H	α-helix	trans	-72.7	-43.5	-177.9	174.3	0	0	0	0	112.2	T111 V113	T111-V115 HydrophobicContact CG2-CG2 4.4Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 3.13Å; V113-V115 VanDerWaalsContact C-N 3.35Å; V113-V115 PolarHBondContact O-N 3.18Å
116	L	93.5	Very high	92.6	Very high	1 Å²	1	56 Å²	56	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-87.3	-21.3	-172.3	-67.8	179	0	0	0	113.9	C90 I112 V113 E119 V120 D185 T188 Y189	C90-L116 HydrophobicContact CB-CD2 3.44Å; C90-L116 VanDerWaalsContact CB-CD2 3.44Å; I112-L116 HydrophobicContact CG2-CD1 3.78Å; I112-L116 VanDerWaalsContact O-CB 3.28Å; I112-L116 WeakPolarHBondContact O-CB 3.48Å; I112-L116 WeakPolarHBondContact O-CG 3.5Å; I112-L116 PolarHBondContact O-N 2.97Å; V113-L116 PolarHBondContact O-N 2.64Å; L116-E119 PolarHBondContact O-N 3.43Å; L116-E119 VanDerWaalsContact O-N 3.12Å; L116-V120 WeakPolarHBondContact O-CG2 3.21Å; L116-V120 PolarHBondContact O-N 2.7Å; L116-D185 HydrophobicContact CD2-CB 4.18Å; L116-T188 HydrophobicContact CD1-CG2 4.38Å; L116-Y189 HydrophobicContact CB-CD2 3.83Å; L116-Y189 HydrophobicContact CB-CG 4.31Å
117	Q	92.6	Very high	93.1	Very high	103 Å²	103	54.5 Å²	54.5	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-57.6	-45.8	-177	-176.4	175.9	14.3	0	0	113.4	V113 E119 V120 K121 Y189	V113-Q117 WeakPolarHBondContact O-CB 3.46Å; V113-Q117 PolarHBondContact O-N 3.37Å; Q117-E119 VanDerWaalsContact C-N 3.29Å; Q117-E119 PolarHBondContact O-N 2.83Å; Q117-V120 PolarHBondContact O-N 3.18Å; Q117-K121 PolarHBondContact O-N 2.77Å; Q117-Y189 HydrophobicContact CB-CE2 3.8Å; Q117-Y189 HydrophobicContact CG-CE2 4.35Å
118	P	94.8	Very high	93.4	Very high	71 Å²	71	53 Å²	53	46%	0.461	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-36.5	175.7	-21.8	34.3	0	0	0	112.8	E114 K121 K122	E114-P118 WeakPolarHBondContact O-CD 3.24Å; P118-K121 WeakPolarHBondContact O-CB 3.42Å; P118-K121 PolarHBondContact O-N 2.91Å; P118-K122 PolarHBondContact O-N 3.09Å
119	E	94.3	Very high	93.8	Very high	49 Å²	49	52.5 Å²	52.5	23%	0.229	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-44.1	178.4	-60.4	-51	131.1	0	0	111.1	W87 L116 Q117 K121 K122 L123	W87-E119 HydrophobicContact CH2-CB 3.68Å; W87-E119 WeakPolarHBondContact CH2-O 3.4Å; W87-E119 HydrophobicContact CZ2-CB 3.83Å; L116-E119 PolarHBondContact O-N 3.43Å; L116-E119 VanDerWaalsContact O-N 3.12Å; Q117-E119 VanDerWaalsContact C-N 3.29Å; Q117-E119 PolarHBondContact O-N 2.83Å; E119-K121 PolarHBondContact O-N 3.45Å; E119-K122 WeakPolarHBondContact O-CA 3.31Å; E119-K122 VanDerWaalsContact O-CB 3.3Å; E119-K122 WeakPolarHBondContact O-CB 3.3Å; E119-K122 PolarHBondContact O-N 3.22Å; E119-K122 IonicContact OE1-NZ 2.65Å; E119-K122 PolarHBondContact OE1-NZ 3.32Å; E119-K122 WeakPolarHBondContact OE2-CD 3.44Å; E119-K122 WeakPolarHBondContact OE2-CE 3.32Å; E119-K122 IonicContact OE2-NZ 3.34Å; E119-K122 PolarHBondContact OE2-NZ 3.28Å; E119-L123 PolarHBondContact O-N 3Å
120	V	93.1	Very high	94	Very high	8 Å²	8	51.5 Å²	51.5	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-34.4	174.4	173.2	0	0	0	0	111.6	L116 Q117 K122 L123 L124 Y186 Y189 L211	L116-V120 WeakPolarHBondContact O-CG2 3.21Å; L116-V120 PolarHBondContact O-N 2.7Å; Q117-V120 PolarHBondContact O-N 3.18Å; V120-K122 VanDerWaalsContact C-N 3.28Å; V120-K122 PolarHBondContact O-N 3.1Å; V120-L123 WeakPolarHBondContact O-CB 3.4Å; V120-L123 PolarHBondContact O-N 3.34Å; V120-L123 VanDerWaalsContact O-N 3.09Å; V120-L124 PolarHBondContact O-N 3.08Å; V120-Y186 HydrophobicContact CG1-CD2 3.81Å; V120-Y186 HydrophobicContact CG1-CE2 3.81Å; V120-Y186 HydrophobicContact CG2-CD2 3.92Å; V120-Y189 HydrophobicContact CB-CD1 4.3Å; V120-Y189 HydrophobicContact CB-CE1 4.34Å; V120-Y189 HydrophobicContact CG1-CD1 4.1Å; V120-Y189 HydrophobicContact CG1-CE1 3.98Å; V120-Y189 HydrophobicContact CG2-CD1 3.73Å; V120-Y189 HydrophobicContact CG2-CD2 4.24Å; V120-Y189 HydrophobicContact CG2-CE1 4.27Å; V120-Y189 HydrophobicContact CG2-CG 3.7Å; V120-L211 HydrophobicContact CG1-CD2 4.1Å
121	K	94.3	Very high	94.2	Very high	132 Å²	132	50.8 Å²	50.8	57%	0.574	25%	0.254	S	S	*	.	H	α-helix	trans	-60.1	-36.7	172.1	-170.9	177.1	-180	177.6	0	112.3	Q117 P118 E119 L124 Q125	Q117-K121 PolarHBondContact O-N 2.77Å; P118-K121 WeakPolarHBondContact O-CB 3.42Å; P118-K121 PolarHBondContact O-N 2.91Å; E119-K121 PolarHBondContact O-N 3.45Å; K121-L124 PolarHBondContact O-N 2.84Å; K121-Q125 VanDerWaalsContact O-CG 3.3Å; K121-Q125 WeakPolarHBondContact O-CG 3.48Å; K121-Q125 PolarHBondContact O-N 3.47Å
122	K	95.6	Very high	94.5	Very high	69 Å²	69	52.6 Å²	52.6	30%	0.3	25%	0.253	S	S	.	.	H	α-helix	trans	-66.5	-37	173.6	-59.1	175	-165.6	161.9	0	111.6	W87 P118 E119 V120 Q125 F126	W87-K122 HydrophobicContact CZ3-CB 4.47Å; P118-K122 PolarHBondContact O-N 3.09Å; E119-K122 WeakPolarHBondContact O-CA 3.31Å; E119-K122 VanDerWaalsContact O-CB 3.3Å; E119-K122 WeakPolarHBondContact O-CB 3.3Å; E119-K122 PolarHBondContact O-N 3.22Å; E119-K122 IonicContact OE1-NZ 2.65Å; E119-K122 PolarHBondContact OE1-NZ 3.32Å; E119-K122 WeakPolarHBondContact OE2-CD 3.44Å; E119-K122 WeakPolarHBondContact OE2-CE 3.32Å; E119-K122 IonicContact OE2-NZ 3.34Å; E119-K122 PolarHBondContact OE2-NZ 3.28Å; V120-K122 VanDerWaalsContact C-N 3.28Å; V120-K122 PolarHBondContact O-N 3.1Å; K122-Q125 PolarHBondContact O-N 3.49Å; K122-F126 WeakPolarHBondContact O-CB 3.22Å; K122-F126 PolarHBondContact O-N 3.27Å
123	L	95.7	Very high	94.7	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-39.6	174.7	-62.7	177.1	0	0	0	112.2	W87 E119 V120 F126 M127 I182 L211 L215	W87-L123 HydrophobicContact CE3-CD2 4.27Å; W87-L123 HydrophobicContact CH2-CD1 3.86Å; W87-L123 HydrophobicContact CH2-CD2 3.7Å; W87-L123 HydrophobicContact CH2-CG 3.52Å; W87-L123 HydrophobicContact CZ2-CD1 4.14Å; W87-L123 HydrophobicContact CZ2-CD2 4.41Å; W87-L123 HydrophobicContact CZ2-CG 4.28Å; W87-L123 HydrophobicContact CZ3-CD2 3.62Å; W87-L123 HydrophobicContact CZ3-CG 3.91Å; E119-L123 PolarHBondContact O-N 3Å; V120-L123 WeakPolarHBondContact O-CB 3.4Å; V120-L123 PolarHBondContact O-N 3.34Å; V120-L123 VanDerWaalsContact O-N 3.09Å; L123-F126 PolarHBondContact O-N 2.85Å; L123-M127 PolarHBondContact O-N 3.4Å; L123-I182 HydrophobicContact CD1-CB 4.48Å; L123-I182 HydrophobicContact CD2-CB 4.1Å; L123-I182 HydrophobicContact CD2-CG2 4.07Å; L123-L211 HydrophobicContact CB-CD1 4.16Å; L123-L211 HydrophobicContact CB-CD2 4.14Å; L123-L215 HydrophobicContact CD1-CD1 4.18Å
124	L	94.4	Very high	94.9	Very high	36 Å²	36	52 Å²	52	19%	0.188	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-47.5	172.2	-73.3	170.9	0	0	0	111	V120 K121 F126 M127 Y128 L211	V120-L124 PolarHBondContact O-N 3.08Å; K121-L124 PolarHBondContact O-N 2.84Å; L124-F126 VanDerWaalsContact C-N 3.3Å; L124-F126 PolarHBondContact O-N 3.39Å; L124-M127 HydrophobicContact CD2-CE 4.1Å; L124-M127 WeakPolarHBondContact O-CB 3.33Å; L124-M127 PolarHBondContact O-N 2.89Å; L124-M127 VanDerWaalsContact O-N 3.14Å; L124-Y128 HydrophobicContact CB-CE2 4.07Å; L124-Y128 WeakPolarHBondContact O-CD2 3.39Å; L124-Y128 PolarHBondContact O-N 3.02Å; L124-L211 HydrophobicContact CD2-CB 4.16Å; L124-L211 HydrophobicContact CD2-CD2 3.75Å; L124-L211 HydrophobicContact CD2-CG 4.43Å; L124-L211 HydrophobicContact CG-CD2 3.94Å
125	Q	96.2	Very high	95.1	Very high	98 Å²	98	51.3 Å²	51.3	46%	0.458	24%	0.24	S	C	.	.	H	α-helix	trans	-56.9	-43.2	175	-74.2	172.5	-10.4	0	0	111.8	K121 K122 Y128 F129	K121-Q125 VanDerWaalsContact O-CG 3.3Å; K121-Q125 WeakPolarHBondContact O-CG 3.48Å; K121-Q125 PolarHBondContact O-N 3.47Å; K122-Q125 PolarHBondContact O-N 3.49Å; Q125-Y128 PolarHBondContact O-N 2.97Å; Q125-F129 VanDerWaalsContact O-CB 3.24Å; Q125-F129 WeakPolarHBondContact O-CB 3.33Å; Q125-F129 PolarHBondContact O-N 3.3Å
126	F	97.2	Very high	95.2	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-44.3	175.1	170.9	-130.2	0	0	0	112.4	H80 L84 K122 L123 L124 Y128 F129 Q130 L172 K176 F214 I221	H80-F126 HydrophobicContact CB-CD2 4.05Å; L84-F126 HydrophobicContact CD1-CD1 4.42Å; L84-F126 HydrophobicContact CD1-CE1 3.86Å; L84-F126 HydrophobicContact CD1-CE2 4.03Å; L84-F126 HydrophobicContact CD1-CZ 3.65Å; L84-F126 HydrophobicContact CD2-CD1 4.21Å; L84-F126 HydrophobicContact CD2-CE1 4.1Å; K122-F126 WeakPolarHBondContact O-CB 3.22Å; K122-F126 PolarHBondContact O-N 3.27Å; L123-F126 PolarHBondContact O-N 2.85Å; L124-F126 VanDerWaalsContact C-N 3.3Å; L124-F126 PolarHBondContact O-N 3.39Å; F126-Y128 VanDerWaalsContact C-N 3.35Å; F126-Y128 PolarHBondContact O-N 3.25Å; F126-F129 PolarHBondContact O-N 2.87Å; F126-Q130 HydrophobicContact CE2-CB 4.48Å; F126-Q130 PolarHBondContact O-N 3.3Å; F126-L172 HydrophobicContact CE2-CB 4.12Å; F126-L172 HydrophobicContact CE2-CD1 4.25Å; F126-L172 HydrophobicContact CE2-CD2 3.93Å; F126-L172 HydrophobicContact CE2-CG 4.33Å; F126-L172 HydrophobicContact CZ-CB 4.32Å; F126-K176 HydrophobicContact CE1-CB 4.36Å; F126-K176 HydrophobicContact CE1-CD 4.29Å; F126-K176 HydrophobicContact CE1-CG 4.26Å; F126-K176 HydrophobicContact CZ-CB 4.49Å; F126-F214 AromaticContact CD1-CE1 3.66Å; F126-F214 HydrophobicContact CD1-CE1 3.66Å; F126-F214 HydrophobicContact CD1-CZ 4.04Å; F126-F214 AromaticContact CE1-CE1 3.5Å; F126-F214 HydrophobicContact CE1-CE1 3.5Å; F126-F214 VanDerWaalsContact CE1-CE1 3.5Å; F126-F214 AromaticContact CE1-CZ 3.52Å; F126-F214 HydrophobicContact CE1-CZ 3.52Å; F126-F214 HydrophobicContact CZ-CE1 4.33Å; F126-F214 AromaticContact CZ-CZ 3.89Å; F126-F214 HydrophobicContact CZ-CZ 3.89Å; F126-I221 HydrophobicContact CE2-CD1 4.2Å; F126-I221 HydrophobicContact CZ-CD1 3.77Å
127	M	95.7	Very high	95.3	Very high	16 Å²	16	50.3 Å²	50.3	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-60	-44	176.2	-176.4	-175.2	69.2	0	0	111.5	L123 L124 Q130 V131 N210 L211 F214	L123-M127 PolarHBondContact O-N 3.4Å; L124-M127 HydrophobicContact CD2-CE 4.1Å; L124-M127 WeakPolarHBondContact O-CB 3.33Å; L124-M127 PolarHBondContact O-N 2.89Å; L124-M127 VanDerWaalsContact O-N 3.14Å; M127-Q130 WeakPolarHBondContact O-CG 3.25Å; M127-Q130 PolarHBondContact O-NE2 3.45Å; M127-V131 WeakPolarHBondContact O-CG2 3.42Å; M127-V131 PolarHBondContact O-N 3.4Å; M127-N210 HydrophobicContact CE-CB 4.33Å; M127-N210 HydrophobicContact SD-CB 4.16Å; M127-L211 HydrophobicContact CB-CD1 4.24Å; M127-L211 HydrophobicContact SD-CB 4.11Å; M127-L211 HydrophobicContact SD-CD1 4.22Å; M127-F214 HydrophobicContact CB-CD1 4.07Å; M127-F214 HydrophobicContact CB-CE1 4.24Å; M127-F214 HydrophobicContact CG-CB 4.32Å; M127-F214 HydrophobicContact CG-CD1 4.08Å; M127-F214 HydrophobicContact CG-CG 4.07Å; M127-F214 HydrophobicContact SD-CB 4.17Å
128	Y	96	Very high	95.4	Very high	98 Å²	98	45.8 Å²	45.8	38%	0.384	21%	0.209	S	C	.	.	H	α-helix	trans	-68.4	-40.9	176.4	-60.5	-42.8	0	0	0	112.3	L124 Q125 F126 V131 R132 E207	L124-Y128 HydrophobicContact CB-CE2 4.07Å; L124-Y128 WeakPolarHBondContact O-CD2 3.39Å; L124-Y128 PolarHBondContact O-N 3.02Å; Q125-Y128 PolarHBondContact O-N 2.97Å; F126-Y128 VanDerWaalsContact C-N 3.35Å; F126-Y128 PolarHBondContact O-N 3.25Å; Y128-V131 PolarHBondContact O-N 2.95Å; Y128-R132 WeakPolarHBondContact O-CB 3.15Å; Y128-R132 PolarHBondContact O-N 3.14Å; Y128-E207 PolarHBondContact OH-OE1 3.07Å; Y128-E207 PolarHBondContact OH-OE2 2.88Å
129	F	97.6	Very high	95.4	Very high	2 Å²	2	46 Å²	46	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-51.1	178.6	169.7	-99.3	0	0	0	111.1	L73 E76 G77 H80 Q125 F126 V131 R132 A133 M168 L172	L73-F129 HydrophobicContact CD2-CE2 3.98Å; L73-F129 WeakPolarHBondContact O-CZ 3.48Å; E76-F129 HydrophobicContact CB-CD2 4.31Å; E76-F129 HydrophobicContact CB-CE2 3.75Å; E76-F129 HydrophobicContact CB-CZ 4.41Å; E76-F129 HydrophobicContact CG-CD2 3.62Å; E76-F129 HydrophobicContact CG-CE2 3.59Å; E76-F129 HydrophobicContact CG-CG 4.5Å; E76-F129 HydrophobicContact CG-CZ 4.45Å; E76-F129 WeakPolarHBondContact OE2-CD2 3.46Å; G77-F129 VanDerWaalsContact CA-CZ 3.44Å; H80-F129 AromaticContact CD2-CD1 3.52Å; H80-F129 AromaticContact CD2-CG 3.5Å; H80-F129 VanDerWaalsContact CD2-CG 3.5Å; H80-F129 WeakPolarHBondContact CD2-CG 3.43Å; H80-F129 AromaticContact NE2-CG 3.63Å; Q125-F129 VanDerWaalsContact O-CB 3.24Å; Q125-F129 WeakPolarHBondContact O-CB 3.33Å; Q125-F129 PolarHBondContact O-N 3.3Å; F126-F129 PolarHBondContact O-N 2.87Å; F129-V131 VanDerWaalsContact C-N 3.29Å; F129-V131 PolarHBondContact O-N 3.09Å; F129-R132 PolarHBondContact O-N 2.91Å; F129-R132 VanDerWaalsContact O-N 3.13Å; F129-A133 HydrophobicContact CE1-CB 4.22Å; F129-A133 HydrophobicContact CE2-CB 4.26Å; F129-A133 HydrophobicContact CZ-CB 4Å; F129-A133 VanDerWaalsContact O-CB 3.31Å; F129-A133 WeakPolarHBondContact O-CB 3.16Å; F129-A133 PolarHBondContact O-N 3.3Å; F129-M168 HydrophobicContact CE1-CE 4.37Å; F129-M168 HydrophobicContact CE1-SD 4.32Å; F129-M168 HydrophobicContact CZ-CE 4.16Å; F129-M168 HydrophobicContact CZ-SD 3.97Å; F129-L172 HydrophobicContact CD1-CD1 4.39Å; F129-L172 HydrophobicContact CE1-CD1 3.8Å
130	Q	95.3	Very high	95.4	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-35	-177	71.5	76.7	20	0	0	112	F126 M127 T134 F214 I221	F126-Q130 HydrophobicContact CE2-CB 4.48Å; F126-Q130 PolarHBondContact O-N 3.3Å; M127-Q130 WeakPolarHBondContact O-CG 3.25Å; M127-Q130 PolarHBondContact O-NE2 3.45Å; Q130-T134 VanDerWaalsContact O-CB 3.24Å; Q130-T134 WeakPolarHBondContact O-CB 3.44Å; Q130-T134 PolarHBondContact O-N 2.93Å; Q130-T134 PolarHBondContact O-OG1 2.82Å; Q130-F214 HydrophobicContact CG-CE2 3.84Å; Q130-F214 HydrophobicContact CG-CZ 3.87Å; Q130-I221 HydrophobicContact CB-CD1 4.09Å; Q130-I221 HydrophobicContact CB-CG1 4.32Å; Q130-I221 HydrophobicContact CG-CD1 4.28Å; Q130-I221 HydrophobicContact CG-CG1 4.19Å
131	V	95	Very high	95.4	Very high	75 Å²	75	43.5 Å²	43.5	46%	0.455	19%	0.191	S	C	.	.	H	α-helix	trans	-65	-47.1	173.5	175.7	0	0	0	0	110.6	M127 Y128 F129 R135	M127-V131 WeakPolarHBondContact O-CG2 3.42Å; M127-V131 PolarHBondContact O-N 3.4Å; Y128-V131 PolarHBondContact O-N 2.95Å; F129-V131 VanDerWaalsContact C-N 3.29Å; F129-V131 PolarHBondContact O-N 3.09Å; V131-R135 WeakPolarHBondContact O-CB 3.46Å; V131-R135 PolarHBondContact O-N 3.19Å
132	R	96.1	Very high	95.4	Very high	107 Å²	107	44 Å²	44	40%	0.404	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-46.7	178.9	-177.4	177	68.3	-149.8	-2.2	111.6	E76 Y128 F129 R135 R136	E76-R132 IonicContact OE1-CZ 2.72Å; E76-R132 IonicContact OE1-NH2 2.68Å; E76-R132 PolarHBondContact OE1-NH2 2.93Å; E76-R132 IonicContact OE2-CZ 3.98Å; E76-R132 IonicContact OE2-NH2 2.67Å; E76-R132 PolarHBondContact OE2-NH2 3.5Å; Y128-R132 WeakPolarHBondContact O-CB 3.15Å; Y128-R132 PolarHBondContact O-N 3.14Å; F129-R132 PolarHBondContact O-N 2.91Å; F129-R132 VanDerWaalsContact O-N 3.13Å; R132-R135 PolarHBondContact O-N 3.01Å; R132-R136 WeakPolarHBondContact O-CB 3.5Å; R132-R136 PolarHBondContact O-N 2.91Å
133	A	96.5	Very high	95.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.9	-44.8	-180	0	0	0	0	0	111.5	F129 R136 F137 M168 F169	F129-A133 HydrophobicContact CE1-CB 4.22Å; F129-A133 HydrophobicContact CE2-CB 4.26Å; F129-A133 HydrophobicContact CZ-CB 4Å; F129-A133 VanDerWaalsContact O-CB 3.31Å; F129-A133 WeakPolarHBondContact O-CB 3.16Å; F129-A133 PolarHBondContact O-N 3.3Å; A133-R136 PolarHBondContact O-N 2.98Å; A133-F137 VanDerWaalsContact O-CB 3.26Å; A133-F137 WeakPolarHBondContact O-CB 3.33Å; A133-F137 PolarHBondContact O-N 2.59Å; A133-M168 HydrophobicContact CB-CE 4.11Å; A133-F169 HydrophobicContact CB-CE1 3.82Å; A133-F169 HydrophobicContact CB-CZ 4.09Å
134	T	95.5	Very high	94.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.3	-48.9	176.1	-58.1	0	0	0	0	110.6	Q130 R136 F137 C138 L225	Q130-T134 VanDerWaalsContact O-CB 3.24Å; Q130-T134 WeakPolarHBondContact O-CB 3.44Å; Q130-T134 PolarHBondContact O-N 2.93Å; Q130-T134 PolarHBondContact O-OG1 2.82Å; T134-R136 PolarHBondContact O-N 3.44Å; T134-F137 PolarHBondContact O-N 3.41Å; T134-C138 WeakPolarHBondContact O-CB 3.47Å; T134-C138 PolarHBondContact O-N 2.7Å; T134-C138 PolarHBondContact O-SG 2.92Å; T134-C138 VanDerWaalsContact O-SG 3.37Å; T134-L225 HydrophobicContact CG2-CB 4.13Å; T134-L225 HydrophobicContact CG2-CD1 3.88Å
135	R	95.3	Very high	94.6	Very high	130 Å²	130	42.7 Å²	42.7	49%	0.491	19%	0.185	S	C	.	.	H	α-helix	trans	-58.3	-50.8	177.8	-179.4	179.6	64.8	96	-6.1	111.7	V131 R132 F137 C138 E139	V131-R135 WeakPolarHBondContact O-CB 3.46Å; V131-R135 PolarHBondContact O-N 3.19Å; R132-R135 PolarHBondContact O-N 3.01Å; R135-F137 VanDerWaalsContact C-N 3.32Å; R135-F137 PolarHBondContact O-N 3.31Å; R135-C138 PolarHBondContact O-N 3.42Å; R135-E139 HydrophobicContact CG-CG 4.45Å; R135-E139 WeakPolarHBondContact CG-OE1 3.41Å; R135-E139 IonicContact CZ-OE1 3.85Å; R135-E139 IonicContact NE-OE1 3.61Å; R135-E139 IonicContact NH1-OE1 3.98Å; R135-E139 PolarHBondContact NH1-OE1 2.69Å; R135-E139 IonicContact NH1-OE2 4Å; R135-E139 VanDerWaalsContact O-CG 3.31Å; R135-E139 WeakPolarHBondContact O-CG 3.45Å; R135-E139 PolarHBondContact O-N 3.36Å
136	R	95.3	Very high	94.2	Very high	47 Å²	47	42.7 Å²	42.7	18%	0.177	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-39.7	-178.8	-174.7	63.9	179.4	118.1	5	111.8	E69 L73 R132 A133 T134 E139 E140	E69-R136 IonicContact OE2-CZ 3.9Å; E69-R136 IonicContact OE2-NE 2.75Å; E69-R136 PolarHBondContact OE2-NE 2.99Å; E69-R136 IonicContact OE2-NH2 3.27Å; E69-R136 PolarHBondContact OE2-NH2 2.9Å; L73-R136 HydrophobicContact CD1-CB 4.07Å; L73-R136 HydrophobicContact CD1-CG 3.88Å; R132-R136 WeakPolarHBondContact O-CB 3.5Å; R132-R136 PolarHBondContact O-N 2.91Å; A133-R136 PolarHBondContact O-N 2.98Å; T134-R136 PolarHBondContact O-N 3.44Å; R136-E139 IonicContact NH1-OE2 2.84Å; R136-E139 PolarHBondContact O-N 3.36Å; R136-E140 IonicContact CZ-OE1 3.94Å; R136-E140 IonicContact NH1-OE1 2.73Å; R136-E140 PolarHBondContact NH1-OE1 3.33Å; R136-E140 IonicContact NH2-OE1 3.81Å; R136-E140 PolarHBondContact NH2-OE1 3.14Å; R136-E140 PolarHBondContact O-N 3.36Å; R136-E140 VanDerWaalsContact O-N 3.14Å
137	F	95.6	Very high	93.3	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-48.3	174.6	178	-98.7	0	0	0	111.5	A133 T134 R135 E139 E140 V141 L162 M165 I166 F169 L225 L229 L239	A133-F137 VanDerWaalsContact O-CB 3.26Å; A133-F137 WeakPolarHBondContact O-CB 3.33Å; A133-F137 PolarHBondContact O-N 2.59Å; T134-F137 PolarHBondContact O-N 3.41Å; R135-F137 VanDerWaalsContact C-N 3.32Å; R135-F137 PolarHBondContact O-N 3.31Å; F137-E139 VanDerWaalsContact C-N 3.33Å; F137-E139 PolarHBondContact O-N 3.33Å; F137-E140 PolarHBondContact O-N 3.09Å; F137-V141 HydrophobicContact CD1-CG2 4.15Å; F137-V141 HydrophobicContact CE1-CG2 3.76Å; F137-V141 HydrophobicContact CE2-CG2 4.41Å; F137-V141 HydrophobicContact CZ-CG2 3.9Å; F137-V141 WeakPolarHBondContact O-CG2 3.48Å; F137-V141 PolarHBondContact O-N 3.42Å; F137-L162 HydrophobicContact CD2-CD2 4.14Å; F137-L162 HydrophobicContact CE2-CB 4.23Å; F137-L162 HydrophobicContact CE2-CD2 3.92Å; F137-M165 HydrophobicContact CB-CE 4.39Å; F137-M165 HydrophobicContact CD2-CB 3.73Å; F137-M165 HydrophobicContact CD2-CG 4.33Å; F137-M165 HydrophobicContact CE2-CB 3.93Å; F137-I166 HydrophobicContact CE1-CG1 4.39Å; F137-I166 HydrophobicContact CE2-CG1 4.1Å; F137-I166 HydrophobicContact CZ-CD1 4.05Å; F137-I166 HydrophobicContact CZ-CG1 3.6Å; F137-F169 HydrophobicContact CB-CE2 4.01Å; F137-F169 HydrophobicContact CB-CZ 4.07Å; F137-F169 HydrophobicContact CD1-CE2 4.09Å; F137-F169 HydrophobicContact CD2-CE2 4.34Å; F137-F169 AromaticContact CG-CE2 3.89Å; F137-F169 HydrophobicContact CG-CE2 3.89Å; F137-F169 HydrophobicContact CG-CZ 4.45Å; F137-L225 HydrophobicContact CD1-CD1 3.7Å; F137-L225 HydrophobicContact CE1-CD1 4.02Å; F137-L229 HydrophobicContact CE1-CD2 4.15Å; F137-L239 HydrophobicContact CZ-CD2 4.44Å
138	C	95	Very high	92.4	Very high	9 Å²	9	53 Å²	53	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-35.4	177.3	-72.7	0	0	0	0	112.7	T134 R135 V141 K142 Q228 I232	T134-C138 WeakPolarHBondContact O-CB 3.47Å; T134-C138 PolarHBondContact O-N 2.7Å; T134-C138 PolarHBondContact O-SG 2.92Å; T134-C138 VanDerWaalsContact O-SG 3.37Å; R135-C138 PolarHBondContact O-N 3.42Å; C138-V141 PolarHBondContact O-N 2.95Å; C138-K142 VanDerWaalsContact O-CB 3.3Å; C138-K142 WeakPolarHBondContact O-CB 3.44Å; C138-K142 PolarHBondContact O-N 2.73Å; C138-Q228 HydrophobicContact CB-CB 4.45Å; C138-I232 HydrophobicContact CB-CD1 4.08Å; C138-I232 VanDerWaalsContact O-CD1 3.31Å; C138-I232 WeakPolarHBondContact O-CD1 3.23Å
139	E	94.3	Very high	91.5	Very high	75 Å²	75	52.4 Å²	52.4	35%	0.35	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-43.5	172.2	-75.8	167.4	-175.9	0	0	111.8	R135 R136 F137 K142 R143	R135-E139 HydrophobicContact CG-CG 4.45Å; R135-E139 WeakPolarHBondContact CG-OE1 3.41Å; R135-E139 IonicContact CZ-OE1 3.85Å; R135-E139 IonicContact NE-OE1 3.61Å; R135-E139 IonicContact NH1-OE1 3.98Å; R135-E139 PolarHBondContact NH1-OE1 2.69Å; R135-E139 IonicContact NH1-OE2 4Å; R135-E139 VanDerWaalsContact O-CG 3.31Å; R135-E139 WeakPolarHBondContact O-CG 3.45Å; R135-E139 PolarHBondContact O-N 3.36Å; R136-E139 IonicContact NH1-OE2 2.84Å; R136-E139 PolarHBondContact O-N 3.36Å; F137-E139 VanDerWaalsContact C-N 3.33Å; F137-E139 PolarHBondContact O-N 3.33Å; E139-K142 PolarHBondContact O-N 3.23Å; E139-R143 WeakPolarHBondContact O-CB 3.44Å; E139-R143 PolarHBondContact O-N 3.23Å
140	E	93.9	Very high	90.4	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.014	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-41	175.3	-76.7	-55.5	130.4	0	0	112.5	R66 R136 F137 K142 R143 L144 Y158	R66-E140 WeakPolarHBondContact CD-OE1 3.46Å; R66-E140 IonicContact NE-OE1 3.08Å; R136-E140 IonicContact CZ-OE1 3.94Å; R136-E140 IonicContact NH1-OE1 2.73Å; R136-E140 PolarHBondContact NH1-OE1 3.33Å; R136-E140 IonicContact NH2-OE1 3.81Å; R136-E140 PolarHBondContact NH2-OE1 3.14Å; R136-E140 PolarHBondContact O-N 3.36Å; R136-E140 VanDerWaalsContact O-N 3.14Å; F137-E140 PolarHBondContact O-N 3.09Å; E140-K142 VanDerWaalsContact C-N 3.35Å; E140-K142 PolarHBondContact O-N 3.48Å; E140-R143 PolarHBondContact O-N 3.42Å; E140-R143 IonicContact OE1-NE 3.94Å; E140-R143 IonicContact OE2-CZ 3.61Å; E140-R143 IonicContact OE2-NE 2.61Å; E140-R143 PolarHBondContact OE2-NE 2.83Å; E140-R143 IonicContact OE2-NH2 3.03Å; E140-R143 PolarHBondContact OE2-NH2 3.26Å; E140-L144 WeakPolarHBondContact O-CB 3.23Å; E140-L144 WeakPolarHBondContact O-CG 3.42Å; E140-L144 PolarHBondContact O-N 3.36Å; E140-Y158 PolarHBondContact OE2-OH 3.01Å; E140-Y158 VanDerWaalsContact OE2-OH 3.06Å
141	V	93.2	Very high	89.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-59.8	-46.7	174	171.9	0	0	0	0	110.5	F137 C138 R143 L144 S145 L229 I232 L238	F137-V141 HydrophobicContact CD1-CG2 4.15Å; F137-V141 HydrophobicContact CE1-CG2 3.76Å; F137-V141 HydrophobicContact CE2-CG2 4.41Å; F137-V141 HydrophobicContact CZ-CG2 3.9Å; F137-V141 WeakPolarHBondContact O-CG2 3.48Å; F137-V141 PolarHBondContact O-N 3.42Å; C138-V141 PolarHBondContact O-N 2.95Å; V141-R143 VanDerWaalsContact C-N 3.33Å; V141-R143 PolarHBondContact O-N 3.13Å; V141-L144 PolarHBondContact O-N 3.13Å; V141-S145 VanDerWaalsContact O-CB 3.24Å; V141-S145 WeakPolarHBondContact O-CB 3.35Å; V141-S145 PolarHBondContact O-N 3.06Å; V141-S145 PolarHBondContact O-OG 3.15Å; V141-L229 HydrophobicContact CB-CD2 4.2Å; V141-L229 HydrophobicContact CG1-CD2 3.86Å; V141-L229 HydrophobicContact CG2-CD2 4.07Å; V141-I232 HydrophobicContact CB-CD1 4.32Å; V141-I232 HydrophobicContact CG1-CD1 4.15Å; V141-I232 HydrophobicContact CG1-CG2 4.39Å; V141-L238 HydrophobicContact CB-CD2 4.18Å; V141-L238 HydrophobicContact CG1-CD2 4.02Å; V141-L238 HydrophobicContact CG2-CD2 4.11Å
142	K	93.2	Very high	88.7	Confident	142 Å²	142	61.9 Å²	61.9	62%	0.617	28%	0.277	S	S	*	.	H	α-helix	trans	-59.4	-42.7	177.5	-172.6	173.2	-177.3	172	0	112.2	C138 E139 E140 H146 I232	C138-K142 VanDerWaalsContact O-CB 3.3Å; C138-K142 WeakPolarHBondContact O-CB 3.44Å; C138-K142 PolarHBondContact O-N 2.73Å; E139-K142 PolarHBondContact O-N 3.23Å; E140-K142 VanDerWaalsContact C-N 3.35Å; E140-K142 PolarHBondContact O-N 3.48Å; K142-H146 PolarHBondContact O-N 3.23Å; K142-I232 HydrophobicContact CB-CD1 3.96Å; K142-I232 HydrophobicContact CB-CG1 4.13Å; K142-I232 HydrophobicContact CB-CG2 4.06Å; K142-I232 HydrophobicContact CG-CG1 4.44Å; K142-I232 HydrophobicContact CG-CG2 4.27Å
143	R	91.8	Very high	88.2	Confident	64 Å²	64	57.5 Å²	57.5	24%	0.242	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-44.7	177.7	-171.9	-173.7	67.5	78	-0.4	111.8	R66 E139 E140 V141 K149	R66-R143 VanDerWaalsContact NH1-CZ 3.33Å; E139-R143 WeakPolarHBondContact O-CB 3.44Å; E139-R143 PolarHBondContact O-N 3.23Å; E140-R143 PolarHBondContact O-N 3.42Å; E140-R143 IonicContact OE1-NE 3.94Å; E140-R143 IonicContact OE2-CZ 3.61Å; E140-R143 IonicContact OE2-NE 2.61Å; E140-R143 PolarHBondContact OE2-NE 2.83Å; E140-R143 IonicContact OE2-NH2 3.03Å; E140-R143 PolarHBondContact OE2-NH2 3.26Å; V141-R143 VanDerWaalsContact C-N 3.33Å; V141-R143 PolarHBondContact O-N 3.13Å; R143-K149 VanDerWaalsContact O-CB 3.28Å; R143-K149 WeakPolarHBondContact O-CB 3.36Å
144	L	90.3	Very high	87.7	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-77.7	-28.7	-177.4	-67.9	173.5	0	0	0	113.1	E140 V141 R150 V154 Y158 L162 L238	E140-L144 WeakPolarHBondContact O-CB 3.23Å; E140-L144 WeakPolarHBondContact O-CG 3.42Å; E140-L144 PolarHBondContact O-N 3.36Å; V141-L144 PolarHBondContact O-N 3.13Å; L144-R150 PolarHBondContact O-N 3Å; L144-V154 HydrophobicContact CD2-CG2 3.87Å; L144-Y158 HydrophobicContact CD1-CE1 4.06Å; L144-L162 HydrophobicContact CD1-CD1 3.86Å; L144-L238 HydrophobicContact CB-CD1 4.11Å; L144-L238 HydrophobicContact CB-CD2 3.71Å; L144-L238 HydrophobicContact CD1-CD1 4.24Å; L144-L238 HydrophobicContact CD1-CD2 4Å
145	S	88.3	Confident	87.4	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-79.4	-13.7	177.9	-71.6	0	0	0	0	113.8	V141 R150 G234	V141-S145 VanDerWaalsContact O-CB 3.24Å; V141-S145 WeakPolarHBondContact O-CB 3.35Å; V141-S145 PolarHBondContact O-N 3.06Å; V141-S145 PolarHBondContact O-OG 3.15Å; S145-R150 PolarHBondContact O-NE 2.86Å; S145-R150 PolarHBondContact O-NH2 2.94Å; S145-G234 PolarHBondContact OG-O 3.29Å
146	H	87.2	Confident	87	Confident	99 Å²	99	53.9 Å²	53.9	46%	0.458	25%	0.252	S	S	.	.	S	Bend	trans	-53.5	141.3	178.1	-173.3	-95.2	0	0	0	112.3	K142 E148 K149 R150	K142-H146 PolarHBondContact O-N 3.23Å; H146-E148 VanDerWaalsContact C-N 3.25Å; H146-E148 PolarHBondContact ND1-N 3.23Å; H146-E148 PolarHBondContact O-N 2.93Å; H146-E148 VanDerWaalsContact O-N 3.09Å; H146-K149 HydrophobicContact CB-CB 4.22Å; H146-K149 HydrophobicContact CB-CG 4.42Å; H146-K149 PolarHBondContact O-N 3.32Å; H146-R150 WeakPolarHBondContact O-CB 3.4Å; H146-R150 PolarHBondContact O-N 3.25Å
147	C	78.6	Confident	86.5	Confident	90 Å²	90	53.9 Å²	53.9	61%	0.608	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.2	-170.2	59.8	0	0	0	0	114.5
148	E	75.9	Confident	86.3	Confident	145 Å²	145	53.8 Å²	53.8	68%	0.678	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-42.1	174.2	-64.7	-160.9	152.3	0	0	112.8	H146 R150 K151	H146-E148 VanDerWaalsContact C-N 3.25Å; H146-E148 PolarHBondContact ND1-N 3.23Å; H146-E148 PolarHBondContact O-N 2.93Å; H146-E148 VanDerWaalsContact O-N 3.09Å; E148-R150 VanDerWaalsContact C-N 3.35Å; E148-R150 PolarHBondContact O-N 3.49Å; E148-K151 PolarHBondContact O-N 3.49Å
149	K	77	Confident	86	Confident	86 Å²	86	53.7 Å²	53.7	37%	0.374	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-74.1	-24.9	-177	-68.9	-60.9	-177.3	-176.8	0	113.3	R143 H146 K151 D152	R143-K149 VanDerWaalsContact O-CB 3.28Å; R143-K149 WeakPolarHBondContact O-CB 3.36Å; H146-K149 HydrophobicContact CB-CB 4.22Å; H146-K149 HydrophobicContact CB-CG 4.42Å; H146-K149 PolarHBondContact O-N 3.32Å; K149-K151 PolarHBondContact O-N 3.2Å; K149-K151 VanDerWaalsContact O-N 3.15Å; K149-D152 VanDerWaalsContact CD-OD2 3.23Å; K149-D152 WeakPolarHBondContact CD-OD2 3.33Å; K149-D152 IonicContact NZ-OD2 2.81Å; K149-D152 PolarHBondContact NZ-OD2 3.37Å; K149-D152 VanDerWaalsContact NZ-OD2 3.15Å; K149-D152 VanDerWaalsContact O-CB 3.3Å; K149-D152 WeakPolarHBondContact O-CB 3.49Å; K149-D152 PolarHBondContact O-N 2.93Å
150	R	75.5	Confident	85.6	Confident	93 Å²	93	51.6 Å²	51.6	35%	0.351	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-61.9	-22	173.3	-162.9	-179.1	-61.8	-161.5	4	112.8	L144 S145 H146 E148 D233 G234	L144-R150 PolarHBondContact O-N 3Å; S145-R150 PolarHBondContact O-NE 2.86Å; S145-R150 PolarHBondContact O-NH2 2.94Å; H146-R150 WeakPolarHBondContact O-CB 3.4Å; H146-R150 PolarHBondContact O-N 3.25Å; E148-R150 VanDerWaalsContact C-N 3.35Å; E148-R150 PolarHBondContact O-N 3.49Å; R150-D233 PolarHBondContact NH2-O 3.09Å; R150-D233 VanDerWaalsContact NH2-O 3.09Å; R150-G234 PolarHBondContact NH2-O 3.31Å
151	K	75.4	Confident	85.3	Confident	128 Å²	128	51.7 Å²	51.7	56%	0.557	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-84.9	-14.6	175.2	-64.1	-178.9	-176.6	174.4	0	112.7	E148 K149 G580	E148-K151 PolarHBondContact O-N 3.49Å; K149-K151 PolarHBondContact O-N 3.2Å; K149-K151 VanDerWaalsContact O-N 3.15Å; K151-G580 PolarHBondContact O-N 2.8Å
152	D	79.7	Confident	85.2	Confident	64 Å²	64	51.8 Å²	51.8	34%	0.342	25%	0.247	S	C	.	.	S	Bend	trans	-78	148.9	179.7	-76.7	-15.7	0	0	0	111.3	K149	K149-D152 VanDerWaalsContact CD-OD2 3.23Å; K149-D152 WeakPolarHBondContact CD-OD2 3.33Å; K149-D152 IonicContact NZ-OD2 2.81Å; K149-D152 PolarHBondContact NZ-OD2 3.37Å; K149-D152 VanDerWaalsContact NZ-OD2 3.15Å; K149-D152 VanDerWaalsContact O-CB 3.3Å; K149-D152 WeakPolarHBondContact O-CB 3.49Å; K149-D152 PolarHBondContact O-N 2.93Å
153	F	84.5	Confident	85	Confident	15 Å²	15	45 Å²	45	7%	0.066	22%	0.218	C	C	.	.			trans	-64.3	139.1	169.9	168.9	-99.8	0	0	0	111.5	K59 Y60 T568 E571	K59-F153 PolarHBondContact NZ-O 2.81Å; Y60-F153 HydrophobicContact CE1-CD1 4.4Å; Y60-F153 HydrophobicContact CE1-CE1 4.48Å; F153-T568 HydrophobicContact CE1-CG2 4.13Å; F153-E571 HydrophobicContact CE2-CB 4.24Å; F153-E571 HydrophobicContact CE2-CG 3.83Å; F153-E571 HydrophobicContact CZ-CB 3.8Å; F153-E571 HydrophobicContact CZ-CG 3.78Å
154	V	87.4	Confident	84.7	Confident	27 Å²	27	45.5 Å²	45.5	16%	0.164	22%	0.222	C	C	.	.			trans	-128.3	132.6	169.8	-174.9	0	0	0	0	107.2	L144 Y158 L159	L144-V154 HydrophobicContact CD2-CG2 3.87Å; V154-Y158 HydrophobicContact CG1-CD1 3.78Å; V154-Y158 HydrophobicContact CG1-CG 4.5Å; V154-L159 HydrophobicContact CB-CG 4.48Å; V154-L159 HydrophobicContact CG1-CD2 3.94Å; V154-L159 HydrophobicContact CG1-CG 3.9Å
155	S	89	Confident	84.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.219	C	C	.	.			trans	-69.4	150.3	-177.8	68.1	0	0	0	0	113.5	E63 V157 Y158 L159	E63-S155 WeakPolarHBondContact OE1-CB 3.3Å; E63-S155 PolarHBondContact OE1-N 3.49Å; E63-S155 PolarHBondContact OE1-OG 2.94Å; S155-V157 VanDerWaalsContact C-N 3.27Å; S155-V157 PolarHBondContact O-N 3.29Å; S155-Y158 PolarHBondContact O-N 3.38Å; S155-Y158 VanDerWaalsContact OG-CB 3.24Å; S155-Y158 WeakPolarHBondContact OG-CB 3.41Å; S155-Y158 PolarHBondContact OG-N 3.23Å; S155-L159 WeakPolarHBondContact O-CG 3.03Å; S155-L159 PolarHBondContact O-N 2.87Å
156	E	86.3	Confident	84.9	Confident	27 Å²	27	44.8 Å²	44.8	13%	0.126	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-43.2	173.2	-86.3	174.4	173.8	0	0	112.3	Y158 L159 L160 V245 Y249 E571 R577	E156-Y158 VanDerWaalsContact C-N 3.31Å; E156-Y158 PolarHBondContact O-N 3.18Å; E156-L159 PolarHBondContact O-N 2.88Å; E156-L160 VanDerWaalsContact O-CG 3.32Å; E156-L160 WeakPolarHBondContact O-CG 3.23Å; E156-L160 PolarHBondContact O-N 3.32Å; E156-V245 HydrophobicContact CG-CG1 4.32Å; E156-Y249 HydrophobicContact CB-CE2 4.22Å; E156-Y249 VanDerWaalsContact CD-CE2 3.49Å; E156-Y249 HydrophobicContact CG-CE2 4.03Å; E156-Y249 WeakPolarHBondContact OE2-CE2 3.26Å; E156-Y249 PolarHBondContact OE2-OH 2.94Å; E156-E571 VanDerWaalsContact CG-OE1 3.25Å; E156-E571 WeakPolarHBondContact CG-OE1 3.23Å; E156-E571 PolarHBondContact N-OE1 3.15Å; E156-E571 PolarHBondContact N-OE2 3.39Å; E156-E571 VanDerWaalsContact N-OE2 3.16Å; E156-R577 VanDerWaalsContact CD-NH2 3.3Å; E156-R577 IonicContact OE1-CZ 3.25Å; E156-R577 IonicContact OE1-NH1 2.68Å; E156-R577 IonicContact OE1-NH2 3.93Å; E156-R577 PolarHBondContact OE1-NH2 3.19Å
157	V	84.9	Confident	84.8	Confident	46 Å²	46	41.4 Å²	41.4	28%	0.279	20%	0.203	S	C	.	.	H	α-helix	trans	-65	-39.3	-177.6	-166.6	0	0	0	0	110.4	S155 L160 T161 Y564	S155-V157 VanDerWaalsContact C-N 3.27Å; S155-V157 PolarHBondContact O-N 3.29Å; V157-L160 PolarHBondContact O-N 2.97Å; V157-T161 PolarHBondContact O-N 3.07Å; V157-T161 PolarHBondContact O-OG1 3.39Å; V157-Y564 HydrophobicContact CB-CE2 4.32Å; V157-Y564 HydrophobicContact CG1-CE2 4.42Å
158	Y	90.4	Very high	85.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-42	176.4	-163.2	-107.7	0	0	0	112	E63 R66 H67 L70 E140 L144 V154 S155 E156 L160 T161 L162	E63-Y158 HydrophobicContact CG-CD2 4.07Å; E63-Y158 HydrophobicContact CG-CE2 4.39Å; E63-Y158 HydrophobicContact CG-CG 4.17Å; R66-Y158 HydrophobicContact CB-CE2 4.37Å; R66-Y158 WeakPolarHBondContact CB-OH 3.45Å; H67-Y158 HydrophobicContact CB-CD2 3.74Å; H67-Y158 HydrophobicContact CB-CE2 3.78Å; H67-Y158 AromaticContact CG-CD2 3.69Å; H67-Y158 AromaticContact ND1-CD2 3.83Å; L70-Y158 HydrophobicContact CD1-CE2 3.83Å; E140-Y158 PolarHBondContact OE2-OH 3.01Å; E140-Y158 VanDerWaalsContact OE2-OH 3.06Å; L144-Y158 HydrophobicContact CD1-CE1 4.06Å; V154-Y158 HydrophobicContact CG1-CD1 3.78Å; V154-Y158 HydrophobicContact CG1-CG 4.5Å; S155-Y158 PolarHBondContact O-N 3.38Å; S155-Y158 VanDerWaalsContact OG-CB 3.24Å; S155-Y158 WeakPolarHBondContact OG-CB 3.41Å; S155-Y158 PolarHBondContact OG-N 3.23Å; E156-Y158 VanDerWaalsContact C-N 3.31Å; E156-Y158 PolarHBondContact O-N 3.18Å; Y158-L160 VanDerWaalsContact C-N 3.32Å; Y158-L160 PolarHBondContact O-N 3.02Å; Y158-T161 PolarHBondContact O-N 2.83Å; Y158-T161 VanDerWaalsContact O-N 3.17Å; Y158-L162 HydrophobicContact CD1-CD1 4.37Å; Y158-L162 HydrophobicContact CE1-CD1 4.38Å; Y158-L162 PolarHBondContact O-N 3.19Å
159	L	89.1	Confident	86.3	Confident	6 Å²	6	30.8 Å²	30.8	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-62.2	-38.9	174.1	-68.8	172.4	0	0	0	112	V154 S155 E156 T161 L162 G163 L238 D241 V242 V245	V154-L159 HydrophobicContact CB-CG 4.48Å; V154-L159 HydrophobicContact CG1-CD2 3.94Å; V154-L159 HydrophobicContact CG1-CG 3.9Å; S155-L159 WeakPolarHBondContact O-CG 3.03Å; S155-L159 PolarHBondContact O-N 2.87Å; E156-L159 PolarHBondContact O-N 2.88Å; L159-T161 VanDerWaalsContact C-N 3.35Å; L159-L162 HydrophobicContact CD2-CD1 4.39Å; L159-L162 PolarHBondContact O-N 3.36Å; L159-G163 PolarHBondContact O-N 2.64Å; L159-L238 HydrophobicContact CD2-CD1 4.09Å; L159-D241 HydrophobicContact CD1-CB 4.44Å; L159-V242 HydrophobicContact CB-CG2 4.47Å; L159-V242 HydrophobicContact CD2-CG2 3.96Å; L159-V245 HydrophobicContact CB-CG2 4.05Å; L159-V245 HydrophobicContact CD1-CG2 3.52Å; L159-V245 HydrophobicContact CG-CG2 4.41Å
160	L	85.2	Confident	86.8	Confident	31 Å²	31	26.8 Å²	26.8	16%	0.162	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-38	173.8	-72.6	169.4	0	0	0	112	E156 V157 Y158 G163 K164 V245 Y249 I256	E156-L160 VanDerWaalsContact O-CG 3.32Å; E156-L160 WeakPolarHBondContact O-CG 3.23Å; E156-L160 PolarHBondContact O-N 3.32Å; V157-L160 PolarHBondContact O-N 2.97Å; Y158-L160 VanDerWaalsContact C-N 3.32Å; Y158-L160 PolarHBondContact O-N 3.02Å; L160-G163 CarbonylContact O-C 3.51Å; L160-G163 WeakPolarHBondContact O-CA 3.24Å; L160-G163 PolarHBondContact O-N 2.84Å; L160-G163 VanDerWaalsContact O-N 3.14Å; L160-K164 WeakPolarHBondContact O-CG 3.13Å; L160-K164 PolarHBondContact O-N 3.15Å; L160-V245 HydrophobicContact CD2-CG1 3.94Å; L160-V245 HydrophobicContact CG-CG1 3.93Å; L160-Y249 HydrophobicContact CD1-CD1 3.9Å; L160-Y249 HydrophobicContact CD1-CE1 3.5Å; L160-Y249 HydrophobicContact CD1-CE2 4.38Å; L160-I256 HydrophobicContact CD2-CG1 4.47Å
161	T	89.2	Confident	87.5	Confident	6 Å²	6	22.9 Å²	22.9	4%	0.037	11%	0.114	C	C	.	.	H	α-helix	trans	-66.1	-39.2	174.9	-65.2	0	0	0	0	112	H67 L70 L74 V157 Y158 L159 G163 K164 M165	H67-T161 WeakPolarHBondContact NE2-CB 3.33Å; H67-T161 PolarHBondContact NE2-OG1 3.43Å; L70-T161 HydrophobicContact CB-CG2 3.85Å; L70-T161 HydrophobicContact CD1-CG2 4.34Å; L74-T161 HydrophobicContact CD1-CG2 3.96Å; V157-T161 PolarHBondContact O-N 3.07Å; V157-T161 PolarHBondContact O-OG1 3.39Å; Y158-T161 PolarHBondContact O-N 2.83Å; Y158-T161 VanDerWaalsContact O-N 3.17Å; L159-T161 VanDerWaalsContact C-N 3.35Å; T161-G163 VanDerWaalsContact C-N 3.28Å; T161-G163 PolarHBondContact O-N 3.34Å; T161-K164 WeakPolarHBondContact O-CB 3.47Å; T161-K164 PolarHBondContact O-N 2.98Å; T161-K164 VanDerWaalsContact O-N 3.15Å; T161-M165 WeakPolarHBondContact O-CG 3.36Å; T161-M165 PolarHBondContact O-N 3Å
162	L	91.4	Very high	88.4	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-61	-39.7	169.2	-65.9	176.1	0	0	0	111.3	L70 F137 L144 Y158 L159 M165 I166 V242	L70-L162 HydrophobicContact CD1-CD2 3.88Å; F137-L162 HydrophobicContact CD2-CD2 4.14Å; F137-L162 HydrophobicContact CE2-CB 4.23Å; F137-L162 HydrophobicContact CE2-CD2 3.92Å; L144-L162 HydrophobicContact CD1-CD1 3.86Å; Y158-L162 HydrophobicContact CD1-CD1 4.37Å; Y158-L162 HydrophobicContact CE1-CD1 4.38Å; Y158-L162 PolarHBondContact O-N 3.19Å; L159-L162 HydrophobicContact CD2-CD1 4.39Å; L159-L162 PolarHBondContact O-N 3.36Å; L162-M165 WeakPolarHBondContact O-CB 3.24Å; L162-M165 PolarHBondContact O-N 3.37Å; L162-I166 WeakPolarHBondContact O-CG1 3.2Å; L162-I166 PolarHBondContact O-N 3.31Å; L162-I166 VanDerWaalsContact O-N 3.08Å; L162-V242 HydrophobicContact CB-CG2 4.16Å
163	G	87.3	Confident	89.1	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-57.1	-48.2	169.7	0	0	0	0	0	112.5	L159 L160 T161 M165 I166 N167 V259	L159-G163 PolarHBondContact O-N 2.64Å; L160-G163 CarbonylContact O-C 3.51Å; L160-G163 WeakPolarHBondContact O-CA 3.24Å; L160-G163 PolarHBondContact O-N 2.84Å; L160-G163 VanDerWaalsContact O-N 3.14Å; T161-G163 VanDerWaalsContact C-N 3.28Å; T161-G163 PolarHBondContact O-N 3.34Å; G163-M165 VanDerWaalsContact C-N 3.26Å; G163-M165 PolarHBondContact O-N 3.45Å; G163-I166 WeakPolarHBondContact O-CB 3.19Å; G163-I166 PolarHBondContact O-N 2.98Å; G163-I166 VanDerWaalsContact O-N 3.08Å; G163-N167 PolarHBondContact O-N 3.34Å; G163-V259 WeakPolarHBondContact O-CG2 3.43Å
164	K	86.4	Confident	89.3	Confident	73 Å²	73	14.6 Å²	14.6	32%	0.317	8%	0.076	S	C	.	.	H	α-helix	trans	-58.6	-37	176.1	-70.2	179.3	178.9	-174.7	0	112.2	L74 L160 T161 N167 M168 F312	L74-K164 HydrophobicContact CD1-CB 3.76Å; L74-K164 HydrophobicContact CD1-CD 4.23Å; L74-K164 HydrophobicContact CD2-CB 3.9Å; L160-K164 WeakPolarHBondContact O-CG 3.13Å; L160-K164 PolarHBondContact O-N 3.15Å; T161-K164 WeakPolarHBondContact O-CB 3.47Å; T161-K164 PolarHBondContact O-N 2.98Å; T161-K164 VanDerWaalsContact O-N 3.15Å; K164-N167 WeakPolarHBondContact O-CB 3.49Å; K164-N167 PolarHBondContact O-N 2.69Å; K164-M168 WeakPolarHBondContact O-CB 3.44Å; K164-M168 PolarHBondContact O-N 3.18Å; K164-F312 HydrophobicContact CG-CZ 4.43Å
165	M	91.8	Very high	89.6	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.7	-43.6	174.6	-70.6	-70.8	-72.5	0	0	111.6	L70 L73 L74 F137 T161 L162 G163 N167 M168 F169	L70-M165 HydrophobicContact CD2-CE 4.35Å; L73-M165 HydrophobicContact CB-CE 4.1Å; L73-M165 HydrophobicContact CB-SD 4.22Å; L73-M165 HydrophobicContact CD1-CE 4.05Å; L74-M165 HydrophobicContact CD2-CG 4.05Å; L74-M165 HydrophobicContact CD2-SD 3.6Å; L74-M165 VanDerWaalsContact CD2-SD 3.6Å; L74-M165 HydrophobicContact CG-CG 4.29Å; L74-M165 HydrophobicContact CG-SD 3.67Å; F137-M165 HydrophobicContact CB-CE 4.39Å; F137-M165 HydrophobicContact CD2-CB 3.73Å; F137-M165 HydrophobicContact CD2-CG 4.33Å; F137-M165 HydrophobicContact CE2-CB 3.93Å; T161-M165 WeakPolarHBondContact O-CG 3.36Å; T161-M165 PolarHBondContact O-N 3Å; L162-M165 WeakPolarHBondContact O-CB 3.24Å; L162-M165 PolarHBondContact O-N 3.37Å; G163-M165 VanDerWaalsContact C-N 3.26Å; G163-M165 PolarHBondContact O-N 3.45Å; M165-N167 VanDerWaalsContact C-N 3.29Å; M165-N167 PolarHBondContact O-N 3Å; M165-M168 HydrophobicContact CE-CE 3.78Å; M165-M168 WeakPolarHBondContact O-CB 3.41Å; M165-M168 PolarHBondContact O-N 3Å; M165-M168 HydrophobicContact SD-CE 3.83Å; M165-M168 HydrophobicContact SD-SD 4.31Å; M165-F169 HydrophobicContact CB-CE2 4.43Å; M165-F169 HydrophobicContact CE-CZ 4.29Å; M165-F169 WeakPolarHBondContact O-CD2 3.29Å; M165-F169 PolarHBondContact O-N 3.35Å
166	I	90.7	Very high	89.9	Confident	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-58.1	-43.8	174.1	-66	169.3	0	0	0	110.7	F137 L162 G163 F169 A170 L239 V242 F262 L266	F137-I166 HydrophobicContact CE1-CG1 4.39Å; F137-I166 HydrophobicContact CE2-CG1 4.1Å; F137-I166 HydrophobicContact CZ-CD1 4.05Å; F137-I166 HydrophobicContact CZ-CG1 3.6Å; L162-I166 WeakPolarHBondContact O-CG1 3.2Å; L162-I166 PolarHBondContact O-N 3.31Å; L162-I166 VanDerWaalsContact O-N 3.08Å; G163-I166 WeakPolarHBondContact O-CB 3.19Å; G163-I166 PolarHBondContact O-N 2.98Å; G163-I166 VanDerWaalsContact O-N 3.08Å; I166-F169 PolarHBondContact O-N 2.82Å; I166-A170 PolarHBondContact O-N 3.15Å; I166-L239 HydrophobicContact CD1-CD2 3.6Å; I166-V242 HydrophobicContact CD1-CG1 4.32Å; I166-F262 HydrophobicContact CG2-CD1 3.63Å; I166-F262 HydrophobicContact CG2-CE1 4.41Å; I166-L266 HydrophobicContact CG2-CD1 4.01Å
167	N	85.4	Confident	90.2	Very high	28 Å²	28	13.8 Å²	13.8	15%	0.15	7%	0.071	C	C	.	.	H	α-helix	trans	-63.9	-43	175.8	-172	63.7	0	0	0	112.8	G163 K164 M165 F169 A170 V171 T257 V259	G163-N167 PolarHBondContact O-N 3.34Å; K164-N167 WeakPolarHBondContact O-CB 3.49Å; K164-N167 PolarHBondContact O-N 2.69Å; M165-N167 VanDerWaalsContact C-N 3.29Å; M165-N167 PolarHBondContact O-N 3Å; N167-F169 VanDerWaalsContact C-N 3.27Å; N167-F169 PolarHBondContact O-N 3.09Å; N167-A170 WeakPolarHBondContact O-CB 3.36Å; N167-A170 PolarHBondContact O-N 3.05Å; N167-A170 VanDerWaalsContact O-N 3.07Å; N167-V171 WeakPolarHBondContact O-CG2 3.41Å; N167-V171 PolarHBondContact O-N 2.9Å; N167-T257 HydrophobicContact CB-CG2 4.07Å; N167-T257 VanDerWaalsContact CG-CG2 3.42Å; N167-T257 WeakPolarHBondContact ND2-CG2 3.26Å; N167-T257 WeakPolarHBondContact OD1-CG2 3.44Å; N167-V259 HydrophobicContact CB-CG2 3.77Å
168	M	91.2	Very high	90.3	Very high	13 Å²	13	13.2 Å²	13.2	6%	0.064	7%	0.066	C	C	.	.	H	α-helix	trans	-56.2	-43.5	177	178	-166	72.2	0	0	110.8	L74 F129 A133 K164 M165 A170 V171 L172	L74-M168 HydrophobicContact CD2-CB 4.05Å; L74-M168 HydrophobicContact CD2-SD 4.1Å; F129-M168 HydrophobicContact CE1-CE 4.37Å; F129-M168 HydrophobicContact CE1-SD 4.32Å; F129-M168 HydrophobicContact CZ-CE 4.16Å; F129-M168 HydrophobicContact CZ-SD 3.97Å; A133-M168 HydrophobicContact CB-CE 4.11Å; K164-M168 WeakPolarHBondContact O-CB 3.44Å; K164-M168 PolarHBondContact O-N 3.18Å; M165-M168 HydrophobicContact CE-CE 3.78Å; M165-M168 WeakPolarHBondContact O-CB 3.41Å; M165-M168 PolarHBondContact O-N 3Å; M165-M168 HydrophobicContact SD-CE 3.83Å; M165-M168 HydrophobicContact SD-SD 4.31Å; M168-A170 PolarHBondContact O-N 3.29Å; M168-V171 PolarHBondContact O-N 2.91Å; M168-L172 HydrophobicContact CG-CD1 3.87Å; M168-L172 HydrophobicContact CG-CG 4.44Å; M168-L172 WeakPolarHBondContact O-CB 3.19Å; M168-L172 VanDerWaalsContact O-CG 3.23Å; M168-L172 WeakPolarHBondContact O-CG 3.29Å; M168-L172 PolarHBondContact O-N 3.15Å
169	F	93.8	Very high	90.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.3	-41.9	175	-63.6	-55.3	0	0	0	112.5	A133 F137 M165 I166 N167 D173 I221 L225 F262	A133-F169 HydrophobicContact CB-CE1 3.82Å; A133-F169 HydrophobicContact CB-CZ 4.09Å; F137-F169 HydrophobicContact CB-CE2 4.01Å; F137-F169 HydrophobicContact CB-CZ 4.07Å; F137-F169 HydrophobicContact CD1-CE2 4.09Å; F137-F169 HydrophobicContact CD2-CE2 4.34Å; F137-F169 AromaticContact CG-CE2 3.89Å; F137-F169 HydrophobicContact CG-CE2 3.89Å; F137-F169 HydrophobicContact CG-CZ 4.45Å; M165-F169 HydrophobicContact CB-CE2 4.43Å; M165-F169 HydrophobicContact CE-CZ 4.29Å; M165-F169 WeakPolarHBondContact O-CD2 3.29Å; M165-F169 PolarHBondContact O-N 3.35Å; I166-F169 PolarHBondContact O-N 2.82Å; N167-F169 VanDerWaalsContact C-N 3.27Å; N167-F169 PolarHBondContact O-N 3.09Å; F169-D173 WeakPolarHBondContact O-CB 3.4Å; F169-D173 PolarHBondContact O-N 3.34Å; F169-I221 HydrophobicContact CB-CG2 4.15Å; F169-I221 HydrophobicContact CD1-CG2 3.88Å; F169-I221 HydrophobicContact CG-CG2 4.38Å; F169-L225 HydrophobicContact CB-CD2 4.13Å; F169-L225 HydrophobicContact CD2-CD1 4.42Å; F169-L225 HydrophobicContact CD2-CD2 3.6Å; F169-L225 HydrophobicContact CE2-CD1 4.26Å; F169-L225 HydrophobicContact CE2-CD2 4.26Å; F169-L225 HydrophobicContact CG-CD2 4.01Å; F169-F262 HydrophobicContact CB-CE1 4.46Å
170	A	88.7	Confident	90.5	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-48	176.6	0	0	0	0	0	112	I166 N167 M168 L172 D173 E174 F262	I166-A170 PolarHBondContact O-N 3.15Å; N167-A170 WeakPolarHBondContact O-CB 3.36Å; N167-A170 PolarHBondContact O-N 3.05Å; N167-A170 VanDerWaalsContact O-N 3.07Å; M168-A170 PolarHBondContact O-N 3.29Å; A170-L172 PolarHBondContact O-N 2.99Å; A170-D173 PolarHBondContact O-N 3.21Å; A170-E174 WeakPolarHBondContact O-CB 3.42Å; A170-E174 WeakPolarHBondContact O-CG 3.03Å; A170-E174 PolarHBondContact O-N 3.17Å; A170-F262 HydrophobicContact CB-CB 4.25Å; A170-F262 HydrophobicContact CB-CD1 3.85Å; A170-F262 HydrophobicContact CB-CD2 3.77Å; A170-F262 HydrophobicContact CB-CE1 4.05Å; A170-F262 HydrophobicContact CB-CE2 3.97Å; A170-F262 HydrophobicContact CB-CG 3.71Å; A170-F262 HydrophobicContact CB-CZ 4.09Å
171	V	89.5	Confident	90.9	Very high	11 Å²	11	14.3 Å²	14.3	7%	0.067	8%	0.079	C	C	.	.	H	α-helix	trans	-57.8	-50.1	177.6	169.2	0	0	0	0	110.8	A81 N167 M168 D173 L175 L320 F321	A81-V171 HydrophobicContact CB-CG1 3.87Å; N167-V171 WeakPolarHBondContact O-CG2 3.41Å; N167-V171 PolarHBondContact O-N 2.9Å; M168-V171 PolarHBondContact O-N 2.91Å; V171-D173 PolarHBondContact O-N 3.2Å; V171-L175 HydrophobicContact CG1-CD1 3.61Å; V171-L175 HydrophobicContact CG1-CG 4.34Å; V171-L175 VanDerWaalsContact O-CB 3.26Å; V171-L175 WeakPolarHBondContact O-CB 3.11Å; V171-L175 VanDerWaalsContact O-CG 3.24Å; V171-L175 WeakPolarHBondContact O-CG 3.27Å; V171-L175 PolarHBondContact O-N 3.14Å; V171-L320 HydrophobicContact CB-CD1 4.48Å; V171-L320 HydrophobicContact CG2-CD1 3.5Å; V171-L320 HydrophobicContact CG2-CG 4.09Å; V171-F321 HydrophobicContact CG1-CB 4.14Å; V171-F321 HydrophobicContact CG1-CD2 3.81Å; V171-F321 HydrophobicContact CG1-CG 4.25Å
172	L	94.8	Very high	91.2	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-38.6	-178.2	-70	172.5	0	0	0	112.5	H80 A81 L84 F126 F129 M168 A170 K176 I221	H80-L172 HydrophobicContact CB-CD2 3.88Å; A81-L172 HydrophobicContact CB-CD2 3.95Å; L84-L172 HydrophobicContact CD1-CD2 4Å; F126-L172 HydrophobicContact CE2-CB 4.12Å; F126-L172 HydrophobicContact CE2-CD1 4.25Å; F126-L172 HydrophobicContact CE2-CD2 3.93Å; F126-L172 HydrophobicContact CE2-CG 4.33Å; F126-L172 HydrophobicContact CZ-CB 4.32Å; F129-L172 HydrophobicContact CD1-CD1 4.39Å; F129-L172 HydrophobicContact CE1-CD1 3.8Å; M168-L172 HydrophobicContact CG-CD1 3.87Å; M168-L172 HydrophobicContact CG-CG 4.44Å; M168-L172 WeakPolarHBondContact O-CB 3.19Å; M168-L172 VanDerWaalsContact O-CG 3.23Å; M168-L172 WeakPolarHBondContact O-CG 3.29Å; M168-L172 PolarHBondContact O-N 3.15Å; A170-L172 PolarHBondContact O-N 2.99Å; L172-K176 VanDerWaalsContact O-CB 3.24Å; L172-K176 WeakPolarHBondContact O-CB 3.45Å; L172-K176 PolarHBondContact O-N 3.22Å; L172-I221 HydrophobicContact CB-CD1 4Å
173	D	93.4	Very high	91.2	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.011	10%	0.097	C	C	.	.	H	α-helix	trans	-73.2	-41.9	-179	-149.8	17.4	0	0	0	111.6	F169 A170 V171 K176 N177 N219 K220 I221 K222	F169-D173 WeakPolarHBondContact O-CB 3.4Å; F169-D173 PolarHBondContact O-N 3.34Å; A170-D173 PolarHBondContact O-N 3.21Å; V171-D173 PolarHBondContact O-N 3.2Å; D173-K176 PolarHBondContact O-N 3.46Å; D173-N177 WeakPolarHBondContact O-CB 3.06Å; D173-N177 PolarHBondContact O-N 3.32Å; D173-N177 PolarHBondContact O-ND2 3.37Å; D173-N177 PolarHBondContact O-OD1 2.81Å; D173-N219 WeakPolarHBondContact OD2-CA 3.18Å; D173-K220 PolarHBondContact OD1-N 3.03Å; D173-I221 HydrophobicContact CB-CB 3.94Å; D173-I221 HydrophobicContact CB-CD1 4.31Å; D173-I221 HydrophobicContact CB-CG1 4.44Å; D173-I221 PolarHBondContact OD1-N 2.62Å; D173-I221 PolarHBondContact OD2-N 3.46Å; D173-K222 WeakPolarHBondContact OD2-CB 3.25Å; D173-K222 PolarHBondContact OD2-N 3.46Å
174	E	90.5	Very high	91.4	Very high	30 Å²	30	21.9 Å²	21.9	14%	0.14	11%	0.114	C	C	.	.	H	α-helix	trans	-68.5	-41.2	176.7	-66.3	-62.4	164.6	0	0	111.8	A170 K176 N177 M178 L320 M324 F331 R334	A170-E174 WeakPolarHBondContact O-CB 3.42Å; A170-E174 WeakPolarHBondContact O-CG 3.03Å; A170-E174 PolarHBondContact O-N 3.17Å; E174-K176 VanDerWaalsContact C-N 3.32Å; E174-K176 PolarHBondContact O-N 2.91Å; E174-N177 PolarHBondContact O-N 2.98Å; E174-N177 VanDerWaalsContact O-N 3.15Å; E174-M178 PolarHBondContact O-N 3.05Å; E174-L320 HydrophobicContact CB-CD2 3.72Å; E174-L320 HydrophobicContact CG-CD2 3.86Å; E174-M324 HydrophobicContact CB-CE 4.14Å; E174-M324 HydrophobicContact CB-SD 4Å; E174-F331 HydrophobicContact CG-CE1 4.37Å; E174-F331 HydrophobicContact CG-CZ 4.38Å; E174-F331 WeakPolarHBondContact OE1-CE1 3.35Å; E174-R334 IonicContact OE1-NH1 3.66Å; E174-R334 PolarHBondContact OE1-NH1 3.39Å
175	L	93.1	Very high	91.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.6	-41.3	171.2	-75.5	171.6	0	0	0	112.1	A81 L84 Y85 V171 M178 K179 F321 M324	A81-L175 HydrophobicContact CB-CD1 3.68Å; A81-L175 WeakPolarHBondContact O-CD1 3.07Å; L84-L175 HydrophobicContact CB-CB 3.98Å; L84-L175 HydrophobicContact CB-CD1 4.39Å; L84-L175 HydrophobicContact CD1-CB 4.1Å; Y85-L175 HydrophobicContact CD2-CD2 4.01Å; Y85-L175 HydrophobicContact CG-CD2 4.44Å; V171-L175 HydrophobicContact CG1-CD1 3.61Å; V171-L175 HydrophobicContact CG1-CG 4.34Å; V171-L175 VanDerWaalsContact O-CB 3.26Å; V171-L175 WeakPolarHBondContact O-CB 3.11Å; V171-L175 VanDerWaalsContact O-CG 3.24Å; V171-L175 WeakPolarHBondContact O-CG 3.27Å; V171-L175 PolarHBondContact O-N 3.14Å; L175-M178 HydrophobicContact CD2-CE 3.61Å; L175-M178 HydrophobicContact CD2-SD 3.96Å; L175-M178 HydrophobicContact CG-CE 4.4Å; L175-M178 WeakPolarHBondContact O-CG 3.43Å; L175-K179 WeakPolarHBondContact O-CB 3.24Å; L175-K179 WeakPolarHBondContact O-CG 3.3Å; L175-K179 PolarHBondContact O-N 3.38Å; L175-F321 HydrophobicContact CD1-CB 4.26Å; L175-F321 HydrophobicContact CD1-CD1 4.23Å; L175-F321 HydrophobicContact CD1-CD2 4.42Å; L175-F321 HydrophobicContact CD1-CG 4.04Å; L175-F321 HydrophobicContact CD2-CB 4.32Å; L175-F321 HydrophobicContact CD2-CD1 4.32Å; L175-M324 HydrophobicContact CD2-CE 3.9Å; L175-M324 HydrophobicContact CG-CE 3.94Å
176	K	94.8	Very high	91.9	Very high	7 Å²	7	18.8 Å²	18.8	3%	0.03	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-40.9	174.1	-174.6	-163.5	124.7	-64.4	0	111.5	F126 L172 D173 E174 I182 F214 T217	F126-K176 HydrophobicContact CE1-CB 4.36Å; F126-K176 HydrophobicContact CE1-CD 4.29Å; F126-K176 HydrophobicContact CE1-CG 4.26Å; F126-K176 HydrophobicContact CZ-CB 4.49Å; L172-K176 VanDerWaalsContact O-CB 3.24Å; L172-K176 WeakPolarHBondContact O-CB 3.45Å; L172-K176 PolarHBondContact O-N 3.22Å; D173-K176 PolarHBondContact O-N 3.46Å; E174-K176 VanDerWaalsContact C-N 3.32Å; E174-K176 PolarHBondContact O-N 2.91Å; K176-I182 HydrophobicContact CG-CD1 4.11Å; K176-F214 HydrophobicContact CD-CE1 3.96Å; K176-F214 HydrophobicContact CD-CE2 4.05Å; K176-F214 HydrophobicContact CD-CZ 3.66Å; K176-F214 WeakPolarHBondContact CE-O 3.48Å; K176-T217 WeakPolarHBondContact CE-O 3.49Å; K176-T217 PolarHBondContact NZ-O 3.26Å
177	N	92	Very high	92	Very high	31 Å²	31	20.9 Å²	20.9	17%	0.166	12%	0.115	C	C	.	.	H	α-helix	trans	-68.1	-38.5	-177.5	-69.9	-23.2	0	0	0	112	D173 E174 Q218 N219	D173-N177 WeakPolarHBondContact O-CB 3.06Å; D173-N177 PolarHBondContact O-N 3.32Å; D173-N177 PolarHBondContact O-ND2 3.37Å; D173-N177 PolarHBondContact O-OD1 2.81Å; E174-N177 PolarHBondContact O-N 2.98Å; E174-N177 VanDerWaalsContact O-N 3.15Å; N177-Q218 WeakPolarHBondContact OD1-CA 3.21Å; N177-N219 PolarHBondContact OD1-N 2.76Å
178	M	87.8	Confident	92.3	Very high	34 Å²	34	19.9 Å²	19.9	17%	0.167	11%	0.11	C	C	.	.	H	α-helix	trans	-71.4	-33.1	179.2	69.5	162.3	74.7	0	0	112.9	E174 L175 A180 M324 F629	E174-M178 PolarHBondContact O-N 3.05Å; L175-M178 HydrophobicContact CD2-CE 3.61Å; L175-M178 HydrophobicContact CD2-SD 3.96Å; L175-M178 HydrophobicContact CG-CE 4.4Å; L175-M178 WeakPolarHBondContact O-CG 3.43Å; M178-A180 PolarHBondContact O-N 3.03Å; M178-M324 HydrophobicContact CE-CB 3.65Å; M178-M324 HydrophobicContact CE-CE 3.32Å; M178-M324 HydrophobicContact CE-CG 3.61Å; M178-M324 HydrophobicContact CE-SD 2.95Å; M178-M324 WeakPolarHBondContact CE-SD 3.4Å; M178-F629 HydrophobicContact CB-CD2 4.33Å; M178-F629 HydrophobicContact CB-CE2 4.42Å; M178-F629 HydrophobicContact CE-CD2 3.81Å; M178-F629 HydrophobicContact SD-CB 4.39Å; M178-F629 HydrophobicContact SD-CD2 3.82Å
179	K	92.2	Very high	92.4	Very high	6 Å²	6	20 Å²	20	3%	0.026	11%	0.11	C	C	.	.			trans	-82.6	94.7	-167.4	-80.2	-69.3	175.4	175.7	0	109.9	L84 Y85 W87 L175 I182 E632	L84-K179 WeakPolarHBondContact O-CE 3.48Å; L84-K179 WeakPolarHBondContact O-CG 3.49Å; Y85-K179 WeakPolarHBondContact O-CE 3.3Å; Y85-K179 PolarHBondContact O-NZ 2.68Å; W87-K179 PolarHBondContact O-NZ 3.23Å; L175-K179 WeakPolarHBondContact O-CB 3.24Å; L175-K179 WeakPolarHBondContact O-CG 3.3Å; L175-K179 PolarHBondContact O-N 3.38Å; K179-I182 HydrophobicContact CB-CD1 4.09Å; K179-I182 HydrophobicContact CB-CG1 3.94Å; K179-I182 HydrophobicContact CB-CG2 4.27Å; K179-I182 WeakPolarHBondContact O-CG1 3.38Å; K179-E632 HydrophobicContact CD-CG 4.15Å; K179-E632 WeakPolarHBondContact CD-OE2 3.33Å; K179-E632 IonicContact NZ-OE2 3.3Å; K179-E632 PolarHBondContact NZ-OE2 3.46Å
180	A	91.8	Very high	92.2	Very high	50 Å²	50	22.8 Å²	22.8	41%	0.413	12%	0.12	S	C	.	.	H	α-helix	trans	-67.7	-31.8	168	0	0	0	0	0	110.9	M178 I182 K183 N184 E632	M178-A180 PolarHBondContact O-N 3.03Å; A180-I182 PolarHBondContact O-N 3.23Å; A180-K183 WeakPolarHBondContact O-CB 2.99Å; A180-K183 PolarHBondContact O-N 2.87Å; A180-K183 VanDerWaalsContact O-N 3.1Å; A180-N184 PolarHBondContact O-N 3.03Å; A180-N184 PolarHBondContact O-ND2 3.15Å; A180-E632 WeakPolarHBondContact CA-OE1 3.32Å; A180-E632 PolarHBondContact N-OE1 3.25Å
181	S	94	Very high	92.3	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-49.7	-49.3	178.1	-66.8	0	0	0	0	113.6	C89 K183 N184 D185 E632	C89-S181 WeakPolarHBondContact CB-OG 3.32Å; S181-K183 VanDerWaalsContact C-N 3.3Å; S181-K183 PolarHBondContact O-N 3.45Å; S181-N184 PolarHBondContact O-N 2.92Å; S181-D185 WeakPolarHBondContact O-CB 3.42Å; S181-D185 VanDerWaalsContact O-CG 3.29Å; S181-D185 PolarHBondContact O-N 3.26Å; S181-E632 PolarHBondContact N-OE1 3.42Å; S181-E632 PolarHBondContact OG-OE1 3.19Å; S181-E632 PolarHBondContact OG-OE2 3.11Å
182	I	94.7	Very high	92.3	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-35.7	-179.6	60.8	177.8	0	0	0	112.4	L84 W87 L123 K176 K179 A180 Y186 L215	L84-I182 HydrophobicContact CD2-CD1 4Å; L84-I182 HydrophobicContact CD2-CG2 4.43Å; W87-I182 HydrophobicContact CB-CG2 4.07Å; W87-I182 HydrophobicContact CD2-CG2 3.49Å; W87-I182 VanDerWaalsContact CD2-CG2 3.49Å; W87-I182 HydrophobicContact CE3-CG2 3.95Å; W87-I182 HydrophobicContact CG-CG2 3.52Å; W87-I182 HydrophobicContact CZ2-CG2 4.43Å; L123-I182 HydrophobicContact CD1-CB 4.48Å; L123-I182 HydrophobicContact CD2-CB 4.1Å; L123-I182 HydrophobicContact CD2-CG2 4.07Å; K176-I182 HydrophobicContact CG-CD1 4.11Å; K179-I182 HydrophobicContact CB-CD1 4.09Å; K179-I182 HydrophobicContact CB-CG1 3.94Å; K179-I182 HydrophobicContact CB-CG2 4.27Å; K179-I182 WeakPolarHBondContact O-CG1 3.38Å; A180-I182 PolarHBondContact O-N 3.23Å; I182-Y186 WeakPolarHBondContact O-CB 3.33Å; I182-Y186 PolarHBondContact O-N 2.96Å; I182-Y186 VanDerWaalsContact O-N 3.16Å; I182-L215 HydrophobicContact CD1-CD2 3.84Å; I182-L215 HydrophobicContact CG1-CD2 4.26Å
183	K	91.9	Very high	92	Very high	100 Å²	100	28 Å²	28	44%	0.435	14%	0.139	S	C	.	.	H	α-helix	trans	-70.9	-41.7	178	-176.8	-178.4	174.9	-175.3	0	110.8	A180 S181 S187	A180-K183 WeakPolarHBondContact O-CB 2.99Å; A180-K183 PolarHBondContact O-N 2.87Å; A180-K183 VanDerWaalsContact O-N 3.1Å; S181-K183 VanDerWaalsContact C-N 3.3Å; S181-K183 PolarHBondContact O-N 3.45Å; K183-S187 VanDerWaalsContact O-CB 3.3Å; K183-S187 WeakPolarHBondContact O-CB 3.41Å; K183-S187 PolarHBondContact O-N 3.23Å; K183-S187 PolarHBondContact O-OG 3.27Å
184	N	91.9	Very high	91.8	Very high	66 Å²	66	33 Å²	33	35%	0.353	16%	0.162	S	C	.	.	H	α-helix	trans	-68.4	-43.8	-179.4	-68.1	-18.8	0	0	0	111.9	A180 S181 S187 T188	A180-N184 PolarHBondContact O-N 3.03Å; A180-N184 PolarHBondContact O-ND2 3.15Å; S181-N184 PolarHBondContact O-N 2.92Å; N184-S187 PolarHBondContact O-N 3.36Å; N184-T188 WeakPolarHBondContact O-CB 3.49Å; N184-T188 PolarHBondContact O-N 2.87Å; N184-T188 PolarHBondContact O-OG1 2.93Å
185	D	94.5	Very high	91.6	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.011	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-48.2	178.2	-69.4	-12	0	0	0	110.6	W87 C89 C90 S91 L116 S181 S187 T188 Y189	W87-D185 PolarHBondContact NE1-OD2 3.14Å; C89-D185 WeakPolarHBondContact CA-OD2 3.49Å; C89-D185 PolarHBondContact SG-OD1 3.18Å; C90-D185 PolarHBondContact N-OD1 3Å; C90-D185 VanDerWaalsContact N-OD1 3.13Å; C90-D185 PolarHBondContact N-OD2 3.4Å; S91-D185 WeakPolarHBondContact CB-OD1 3.41Å; S91-D185 PolarHBondContact N-OD1 3.38Å; S91-D185 PolarHBondContact OG-OD1 3.01Å; L116-D185 HydrophobicContact CD2-CB 4.18Å; S181-D185 WeakPolarHBondContact O-CB 3.42Å; S181-D185 VanDerWaalsContact O-CG 3.29Å; S181-D185 PolarHBondContact O-N 3.26Å; D185-S187 VanDerWaalsContact C-N 3.34Å; D185-S187 PolarHBondContact O-N 2.87Å; D185-T188 PolarHBondContact O-N 3.29Å; D185-T188 VanDerWaalsContact O-N 3.11Å; D185-Y189 PolarHBondContact O-N 3.39Å
186	Y	94.4	Very high	91.3	Very high	6 Å²	6	37.7 Å²	37.7	2%	0.024	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-40.9	176	-178.2	-111.6	0	0	0	112.8	V120 I182 T188 Y189 R190 S208 L211 L215	V120-Y186 HydrophobicContact CG1-CD2 3.81Å; V120-Y186 HydrophobicContact CG1-CE2 3.81Å; V120-Y186 HydrophobicContact CG2-CD2 3.92Å; I182-Y186 WeakPolarHBondContact O-CB 3.33Å; I182-Y186 PolarHBondContact O-N 2.96Å; I182-Y186 VanDerWaalsContact O-N 3.16Å; Y186-T188 VanDerWaalsContact C-N 3.25Å; Y186-T188 PolarHBondContact O-N 2.98Å; Y186-Y189 HydrophobicContact CD2-CD1 4.41Å; Y186-Y189 HydrophobicContact CE2-CD1 4.31Å; Y186-Y189 PolarHBondContact O-N 3.01Å; Y186-R190 WeakPolarHBondContact O-CB 3.42Å; Y186-R190 PolarHBondContact O-N 3.18Å; Y186-S208 VanDerWaalsContact OH-C 3.23Å; Y186-S208 WeakPolarHBondContact OH-CA 3.48Å; Y186-S208 WeakPolarHBondContact OH-CB 3.39Å; Y186-S208 PolarHBondContact OH-O 3.4Å; Y186-S208 PolarHBondContact OH-OG 2.98Å; Y186-L211 HydrophobicContact CD2-CD2 3.74Å; Y186-L211 HydrophobicContact CD2-CG 4.39Å; Y186-L211 HydrophobicContact CE1-CB 4.42Å; Y186-L211 HydrophobicContact CE1-CD2 4.43Å; Y186-L211 HydrophobicContact CE1-CG 4.21Å; Y186-L211 HydrophobicContact CE2-CD2 3.44Å; Y186-L211 VanDerWaalsContact CE2-CD2 3.44Å; Y186-L211 HydrophobicContact CE2-CG 4.1Å; Y186-L211 HydrophobicContact CG-CD2 4.36Å; Y186-L215 HydrophobicContact CD1-CD1 3.86Å; Y186-L215 HydrophobicContact CG-CD1 3.86Å
187	S	91.9	Very high	90.6	Very high	46 Å²	46	45.1 Å²	45.1	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-64.6	-31.6	176.5	-59.2	0	0	0	0	112.3	K183 N184 D185 R191	K183-S187 VanDerWaalsContact O-CB 3.3Å; K183-S187 WeakPolarHBondContact O-CB 3.41Å; K183-S187 PolarHBondContact O-N 3.23Å; K183-S187 PolarHBondContact O-OG 3.27Å; N184-S187 PolarHBondContact O-N 3.36Å; D185-S187 VanDerWaalsContact C-N 3.34Å; D185-S187 PolarHBondContact O-N 2.87Å; S187-R191 WeakPolarHBondContact O-CG 3.47Å; S187-R191 PolarHBondContact O-N 3.05Å; S187-R191 PolarHBondContact O-NE 2.9Å
188	T	92.1	Very high	89.6	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-75	-44.9	176.9	-58.9	0	0	0	0	111.1	S91 M96 I112 L116 N184 D185 Y186 R190 R191 A192	S91-T188 WeakPolarHBondContact CB-OG1 3.48Å; M96-T188 HydrophobicContact CE-CG2 3.89Å; M96-T188 HydrophobicContact SD-CG2 4.25Å; I112-T188 HydrophobicContact CD1-CG2 4.45Å; I112-T188 HydrophobicContact CG2-CG2 4.05Å; L116-T188 HydrophobicContact CD1-CG2 4.38Å; N184-T188 WeakPolarHBondContact O-CB 3.49Å; N184-T188 PolarHBondContact O-N 2.87Å; N184-T188 PolarHBondContact O-OG1 2.93Å; D185-T188 PolarHBondContact O-N 3.29Å; D185-T188 VanDerWaalsContact O-N 3.11Å; Y186-T188 VanDerWaalsContact C-N 3.25Å; Y186-T188 PolarHBondContact O-N 2.98Å; T188-R190 PolarHBondContact O-N 3.45Å; T188-R191 PolarHBondContact O-N 3.39Å; T188-R191 PolarHBondContact OG1-NH2 3.3Å; T188-R191 VanDerWaalsContact OG1-NH2 3.1Å; T188-A192 PolarHBondContact O-N 3.02Å; T188-A192 VanDerWaalsContact O-N 3.09Å
189	Y	92.6	Very high	88.6	Confident	17 Å²	17	47.7 Å²	47.7	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-46.5	171.7	174	-99.3	0	0	0	112.5	V113 L116 Q117 V120 D185 Y186 R191 A192 T193 M199	V113-Y189 HydrophobicContact CB-CE2 4.48Å; V113-Y189 HydrophobicContact CG1-CE2 4.04Å; V113-Y189 HydrophobicContact CG2-CE2 4.46Å; L116-Y189 HydrophobicContact CB-CD2 3.83Å; L116-Y189 HydrophobicContact CB-CG 4.31Å; Q117-Y189 HydrophobicContact CB-CE2 3.8Å; Q117-Y189 HydrophobicContact CG-CE2 4.35Å; V120-Y189 HydrophobicContact CB-CD1 4.3Å; V120-Y189 HydrophobicContact CB-CE1 4.34Å; V120-Y189 HydrophobicContact CG1-CD1 4.1Å; V120-Y189 HydrophobicContact CG1-CE1 3.98Å; V120-Y189 HydrophobicContact CG2-CD1 3.73Å; V120-Y189 HydrophobicContact CG2-CD2 4.24Å; V120-Y189 HydrophobicContact CG2-CE1 4.27Å; V120-Y189 HydrophobicContact CG2-CG 3.7Å; D185-Y189 PolarHBondContact O-N 3.39Å; Y186-Y189 HydrophobicContact CD2-CD1 4.41Å; Y186-Y189 HydrophobicContact CE2-CD1 4.31Å; Y186-Y189 PolarHBondContact O-N 3.01Å; Y189-R191 VanDerWaalsContact C-N 3.31Å; Y189-R191 PolarHBondContact O-N 3.5Å; Y189-A192 PolarHBondContact O-N 2.89Å; Y189-T193 HydrophobicContact CD1-CG2 4.25Å; Y189-T193 HydrophobicContact CD2-CG2 4.12Å; Y189-T193 HydrophobicContact CE1-CG2 3.76Å; Y189-T193 HydrophobicContact CE2-CG2 3.63Å; Y189-T193 HydrophobicContact CG-CG2 4.42Å; Y189-T193 VanDerWaalsContact CZ-CG2 3.43Å; Y189-T193 PolarHBondContact O-N 3.44Å; Y189-T193 PolarHBondContact O-OG1 3.08Å; Y189-M199 HydrophobicContact CE1-CE 4.31Å
190	R	90.9	Very high	87.4	Confident	57 Å²	57	52.4 Å²	52.4	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-40.4	179.1	-174.2	179.2	177.8	175.7	7.5	111.7	Y186 T188 T193 Q194 S212	Y186-R190 WeakPolarHBondContact O-CB 3.42Å; Y186-R190 PolarHBondContact O-N 3.18Å; T188-R190 PolarHBondContact O-N 3.45Å; R190-T193 WeakPolarHBondContact CA-OG1 3.14Å; R190-T193 PolarHBondContact O-OG1 2.99Å; R190-T193 VanDerWaalsContact O-OG1 3.05Å; R190-Q194 HydrophobicContact CG-CG 4.47Å; R190-Q194 VanDerWaalsContact O-CB 3.29Å; R190-Q194 WeakPolarHBondContact O-CB 3.38Å; R190-Q194 WeakPolarHBondContact O-CG 3.47Å; R190-Q194 PolarHBondContact O-N 3.4Å; R190-S212 PolarHBondContact NH1-OG 3.32Å; R190-S212 VanDerWaalsContact NH1-OG 3.13Å
191	R	88.9	Confident	86.8	Confident	124 Å²	124	53.4 Å²	53.4	47%	0.468	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-42.1	176.3	-76.2	-178.4	-66.8	158.3	0.6	112.2	S187 T188 Y189 F195	S187-R191 WeakPolarHBondContact O-CG 3.47Å; S187-R191 PolarHBondContact O-N 3.05Å; S187-R191 PolarHBondContact O-NE 2.9Å; T188-R191 PolarHBondContact O-N 3.39Å; T188-R191 PolarHBondContact OG1-NH2 3.3Å; T188-R191 VanDerWaalsContact OG1-NH2 3.1Å; Y189-R191 VanDerWaalsContact C-N 3.31Å; Y189-R191 PolarHBondContact O-N 3.5Å; R191-F195 PolarHBondContact O-N 3.4Å; R191-F195 VanDerWaalsContact O-N 3.13Å
192	A	89.9	Confident	86.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.9	-48.5	179.1	0	0	0	0	0	111.9	Y109 I112 V113 T188 Y189 Q194 F195 L196	Y109-A192 HydrophobicContact CD1-CB 3.5Å; Y109-A192 VanDerWaalsContact CD1-CB 3.5Å; Y109-A192 HydrophobicContact CE1-CB 4.33Å; Y109-A192 HydrophobicContact CG-CB 4.06Å; I112-A192 HydrophobicContact CB-CB 4.02Å; I112-A192 HydrophobicContact CG2-CB 3.6Å; V113-A192 HydrophobicContact CG2-CB 3.72Å; T188-A192 PolarHBondContact O-N 3.02Å; T188-A192 VanDerWaalsContact O-N 3.09Å; Y189-A192 PolarHBondContact O-N 2.89Å; A192-Q194 VanDerWaalsContact C-N 3.35Å; A192-Q194 PolarHBondContact O-N 2.67Å; A192-F195 WeakPolarHBondContact O-CB 3.17Å; A192-F195 PolarHBondContact O-N 2.87Å; A192-F195 VanDerWaalsContact O-N 3.17Å; A192-L196 WeakPolarHBondContact O-CG 3.45Å; A192-L196 PolarHBondContact O-N 3.12Å
193	T	89.4	Confident	85.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-36.1	178.1	46.3	0	0	0	0	113.5	V113 Y189 R190 Q197 V198	V113-T193 HydrophobicContact CG1-CG2 4.18Å; V113-T193 HydrophobicContact CG2-CG2 3.62Å; Y189-T193 HydrophobicContact CD1-CG2 4.25Å; Y189-T193 HydrophobicContact CD2-CG2 4.12Å; Y189-T193 HydrophobicContact CE1-CG2 3.76Å; Y189-T193 HydrophobicContact CE2-CG2 3.63Å; Y189-T193 HydrophobicContact CG-CG2 4.42Å; Y189-T193 VanDerWaalsContact CZ-CG2 3.43Å; Y189-T193 PolarHBondContact O-N 3.44Å; Y189-T193 PolarHBondContact O-OG1 3.08Å; R190-T193 WeakPolarHBondContact CA-OG1 3.14Å; R190-T193 PolarHBondContact O-OG1 2.99Å; R190-T193 VanDerWaalsContact O-OG1 3.05Å; T193-Q197 PolarHBondContact O-N 2.97Å; T193-Q197 VanDerWaalsContact O-N 3.12Å; T193-V198 PolarHBondContact O-N 2.97Å; T193-V198 VanDerWaalsContact O-N 3.13Å
194	Q	87.9	Confident	85.2	Confident	106 Å²	106	62.2 Å²	62.2	50%	0.495	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-39.4	173.3	-77.3	174.5	-16.2	0	0	112.1	R190 A192 Q197	R190-Q194 HydrophobicContact CG-CG 4.47Å; R190-Q194 VanDerWaalsContact O-CB 3.29Å; R190-Q194 WeakPolarHBondContact O-CB 3.38Å; R190-Q194 WeakPolarHBondContact O-CG 3.47Å; R190-Q194 PolarHBondContact O-N 3.4Å; A192-Q194 VanDerWaalsContact C-N 3.35Å; A192-Q194 PolarHBondContact O-N 2.67Å; Q194-Q197 PolarHBondContact O-N 3.29Å
195	F	86.8	Confident	84.9	Confident	86 Å²	86	63.2 Å²	63.2	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-45	177.1	179	-91.4	0	0	0	111.9	R105 A106 Y109 R191 A192 Q197	R105-F195 HydrophobicContact CG-CZ 4.44Å; A106-F195 HydrophobicContact CB-CE1 4.39Å; Y109-F195 HydrophobicContact CD2-CB 3.95Å; Y109-F195 AromaticContact CD2-CD1 3.31Å; Y109-F195 HydrophobicContact CD2-CD1 3.31Å; Y109-F195 HydrophobicContact CD2-CD2 4.28Å; Y109-F195 AromaticContact CD2-CE1 3.81Å; Y109-F195 HydrophobicContact CD2-CE1 3.81Å; Y109-F195 AromaticContact CD2-CG 3.57Å; Y109-F195 HydrophobicContact CD2-CG 3.57Å; Y109-F195 HydrophobicContact CD2-CZ 4.47Å; Y109-F195 HydrophobicContact CE2-CB 4Å; Y109-F195 AromaticContact CE2-CD1 3.85Å; Y109-F195 HydrophobicContact CE2-CD1 3.85Å; Y109-F195 AromaticContact CE2-CD2 3.96Å; Y109-F195 HydrophobicContact CE2-CD2 3.96Å; Y109-F195 HydrophobicContact CE2-CE1 4.31Å; Y109-F195 HydrophobicContact CE2-CE2 4.41Å; Y109-F195 AromaticContact CE2-CG 3.64Å; Y109-F195 HydrophobicContact CE2-CG 3.64Å; Y109-F195 HydrophobicContact CG-CD1 4.23Å; R191-F195 PolarHBondContact O-N 3.4Å; R191-F195 VanDerWaalsContact O-N 3.13Å; A192-F195 WeakPolarHBondContact O-CB 3.17Å; A192-F195 PolarHBondContact O-N 2.87Å; A192-F195 VanDerWaalsContact O-N 3.17Å; F195-Q197 PolarHBondContact O-N 3.24Å
196	L	86.3	Confident	84.5	Confident	42 Å²	42	68.7 Å²	68.7	22%	0.22	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-2.4	-179.5	-64.7	167.5	0	0	0	113.7	D110 V113 A192 V198	D110-L196 WeakPolarHBondContact OD1-CD1 3.24Å; D110-L196 VanDerWaalsContact OD1-CD2 3.28Å; D110-L196 WeakPolarHBondContact OD1-CD2 3.42Å; V113-L196 HydrophobicContact CB-CD1 4.43Å; V113-L196 HydrophobicContact CG2-CD1 3.77Å; A192-L196 WeakPolarHBondContact O-CG 3.45Å; A192-L196 PolarHBondContact O-N 3.12Å; L196-V198 HydrophobicContact CB-CG2 3.62Å; L196-V198 PolarHBondContact O-N 2.88Å
197	Q	80.8	Confident	84.3	Confident	163 Å²	163	71.2 Å²	71.2	76%	0.762	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	28.7	-177.4	-57.1	-176.4	-11	0	0	114.2	T193 Q194 F195 M199	T193-Q197 PolarHBondContact O-N 2.97Å; T193-Q197 VanDerWaalsContact O-N 3.12Å; Q194-Q197 PolarHBondContact O-N 3.29Å; F195-Q197 PolarHBondContact O-N 3.24Å; Q197-M199 VanDerWaalsContact C-N 3.32Å; Q197-M199 PolarHBondContact O-N 3.36Å
198	V	71.9	Confident	84.1	Confident	77 Å²	77	69.4 Å²	69.4	47%	0.467	35%	0.354	S	S	.	.			trans	-72	-27.3	-178.3	179.1	0	0	0	0	111.7	T193 L196 S200	T193-V198 PolarHBondContact O-N 2.97Å; T193-V198 VanDerWaalsContact O-N 3.13Å; L196-V198 HydrophobicContact CB-CG2 3.62Å; L196-V198 PolarHBondContact O-N 2.88Å; V198-S200 PolarHBondContact O-N 3.15Å
199	M	66.9	Low	84.1	Confident	43 Å²	43	72.7 Å²	72.7	21%	0.212	37%	0.368	C	S	.	.			trans	-96.4	84.6	178.7	-68.9	-178.4	138.1	0	0	111.2	Y189 Q197	Y189-M199 HydrophobicContact CE1-CE 4.31Å; Q197-M199 VanDerWaalsContact C-N 3.32Å; Q197-M199 PolarHBondContact O-N 3.36Å
200	S	65.6	Low	84.1	Confident	104 Å²	104	75.5 Å²	75.5	73%	0.727	39%	0.385	S	S	*	.			trans	-108.5	-17.5	-176.6	51.3	0	0	0	0	114.5	V198	V198-S200 PolarHBondContact O-N 3.15Å
201	D	78.7	Confident	84.2	Confident	72 Å²	72	72.8 Å²	72.8	39%	0.385	38%	0.375	S	S	.	.	S	Bend	trans	-88.1	140.9	179.8	67.3	-66.4	0	0	0	112.5	Q203 T204 L205	D201-Q203 PolarHBondContact O-N 3.3Å; D201-Q203 VanDerWaalsContact O-N 3.14Å; D201-T204 PolarHBondContact O-N 3.44Å; D201-T204 PolarHBondContact O-OG1 3.44Å; D201-T204 VanDerWaalsContact O-OG1 3.1Å; D201-T204 WeakPolarHBondContact OD1-CB 3.4Å; D201-T204 WeakPolarHBondContact OD1-CG2 3.45Å; D201-T204 PolarHBondContact OD1-OG1 3.05Å; D201-T204 WeakPolarHBondContact OD2-CB 3.4Å; D201-T204 WeakPolarHBondContact OD2-CG2 3.36Å; D201-T204 PolarHBondContact OD2-N 3.18Å; D201-T204 PolarHBondContact OD2-OG1 3.26Å; D201-L205 PolarHBondContact O-N 3.17Å
202	S	81.4	Confident	84.4	Confident	105 Å²	105	68.3 Å²	68.3	73%	0.734	36%	0.362	S	S	*	.	H	α-helix	trans	-61.3	-26.4	-175.3	-176	0	0	0	0	113.4	Q206	S202-Q206 PolarHBondContact O-N 2.79Å
203	Q	84.3	Confident	84.5	Confident	141 Å²	141	73.2 Å²	73.2	66%	0.659	39%	0.386	S	S	*	.	H	α-helix	trans	-76.3	-48.3	-178	-174.1	172.4	-6.1	0	0	111.3	D201 L205 Q206 E207	D201-Q203 PolarHBondContact O-N 3.3Å; D201-Q203 VanDerWaalsContact O-N 3.14Å; Q203-L205 VanDerWaalsContact C-N 3.28Å; Q203-L205 PolarHBondContact O-N 2.97Å; Q203-Q206 PolarHBondContact O-N 3.22Å; Q203-E207 PolarHBondContact O-N 3.04Å
204	T	82.7	Confident	84.8	Confident	43 Å²	43	73.7 Å²	73.7	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-34.6	176.1	60.7	0	0	0	0	112.4	D201 E207 S208	D201-T204 PolarHBondContact O-N 3.44Å; D201-T204 PolarHBondContact O-OG1 3.44Å; D201-T204 VanDerWaalsContact O-OG1 3.1Å; D201-T204 WeakPolarHBondContact OD1-CB 3.4Å; D201-T204 WeakPolarHBondContact OD1-CG2 3.45Å; D201-T204 PolarHBondContact OD1-OG1 3.05Å; D201-T204 WeakPolarHBondContact OD2-CB 3.4Å; D201-T204 WeakPolarHBondContact OD2-CG2 3.36Å; D201-T204 PolarHBondContact OD2-N 3.18Å; D201-T204 PolarHBondContact OD2-OG1 3.26Å; T204-E207 PolarHBondContact O-N 3.45Å; T204-S208 WeakPolarHBondContact O-CB 3.05Å; T204-S208 PolarHBondContact O-N 2.88Å
205	L	84	Confident	85.1	Confident	88 Å²	88	69.3 Å²	69.3	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-60.9	-44	173.6	-99.9	142.3	0	0	0	112	D201 Q203 S208 Q209	D201-L205 PolarHBondContact O-N 3.17Å; Q203-L205 VanDerWaalsContact C-N 3.28Å; Q203-L205 PolarHBondContact O-N 2.97Å; L205-S208 PolarHBondContact O-N 3.48Å; L205-Q209 PolarHBondContact O-N 3.43Å
206	Q	87.3	Confident	85.3	Confident	117 Å²	117	67.7 Å²	67.7	55%	0.547	37%	0.371	S	S	.	.	H	α-helix	trans	-67.5	-43.6	177.2	-169.9	69.4	5.1	0	0	111.8	S202 Q203 S208 Q209 N210	S202-Q206 PolarHBondContact O-N 2.79Å; Q203-Q206 PolarHBondContact O-N 3.22Å; Q206-S208 VanDerWaalsContact C-N 3.32Å; Q206-S208 PolarHBondContact O-N 3.49Å; Q206-Q209 PolarHBondContact O-N 3.35Å; Q206-N210 VanDerWaalsContact O-CG 3.27Å; Q206-N210 PolarHBondContact O-N 3.38Å; Q206-N210 PolarHBondContact O-ND2 3.06Å
207	E	89.1	Confident	85.6	Confident	59 Å²	59	67.9 Å²	67.9	28%	0.276	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-42.4	174.8	-74.5	-169.6	157.3	0	0	111.9	Y128 Q203 T204 Q209 N210 L211	Y128-E207 PolarHBondContact OH-OE1 3.07Å; Y128-E207 PolarHBondContact OH-OE2 2.88Å; Q203-E207 PolarHBondContact O-N 3.04Å; T204-E207 PolarHBondContact O-N 3.45Å; E207-Q209 VanDerWaalsContact C-N 3.32Å; E207-Q209 PolarHBondContact O-N 3.19Å; E207-N210 PolarHBondContact O-N 3.2Å; E207-L211 PolarHBondContact O-N 2.86Å
208	S	89.2	Confident	86.1	Confident	8 Å²	8	66.4 Å²	66.4	6%	0.056	37%	0.367	C	S	.	.	H	α-helix	trans	-59.8	-43.1	175.6	178.6	0	0	0	0	111.7	Y186 T204 L205 Q206 S212	Y186-S208 VanDerWaalsContact OH-C 3.23Å; Y186-S208 WeakPolarHBondContact OH-CA 3.48Å; Y186-S208 WeakPolarHBondContact OH-CB 3.39Å; Y186-S208 PolarHBondContact OH-O 3.4Å; Y186-S208 PolarHBondContact OH-OG 2.98Å; T204-S208 WeakPolarHBondContact O-CB 3.05Å; T204-S208 PolarHBondContact O-N 2.88Å; L205-S208 PolarHBondContact O-N 3.48Å; Q206-S208 VanDerWaalsContact C-N 3.32Å; Q206-S208 PolarHBondContact O-N 3.49Å; S208-S212 WeakPolarHBondContact O-CB 3.48Å; S208-S212 PolarHBondContact O-N 3.27Å
209	Q	90.7	Very high	87	Confident	74 Å²	74	64.3 Å²	64.3	35%	0.346	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-41.7	177.2	-173.6	59.3	24.5	0	0	111.8	L205 Q206 E207 S212 M213	L205-Q209 PolarHBondContact O-N 3.43Å; Q206-Q209 PolarHBondContact O-N 3.35Å; E207-Q209 VanDerWaalsContact C-N 3.32Å; E207-Q209 PolarHBondContact O-N 3.19Å; Q209-S212 WeakPolarHBondContact O-CB 3.46Å; Q209-S212 PolarHBondContact O-N 3Å; Q209-M213 WeakPolarHBondContact O-CG 3.26Å; Q209-M213 PolarHBondContact O-N 3.47Å
210	N	93	Very high	88.2	Confident	76 Å²	76	66.1 Å²	66.1	41%	0.406	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-46	176.4	-72.1	-23.1	0	0	0	111.8	M127 Q206 E207 S212 M213 F214	M127-N210 HydrophobicContact CE-CB 4.33Å; M127-N210 HydrophobicContact SD-CB 4.16Å; Q206-N210 VanDerWaalsContact O-CG 3.27Å; Q206-N210 PolarHBondContact O-N 3.38Å; Q206-N210 PolarHBondContact O-ND2 3.06Å; E207-N210 PolarHBondContact O-N 3.2Å; N210-S212 VanDerWaalsContact C-N 3.33Å; N210-S212 PolarHBondContact O-N 3.34Å; N210-M213 PolarHBondContact O-N 3.02Å; N210-F214 WeakPolarHBondContact O-CB 3.49Å; N210-F214 PolarHBondContact O-N 3.08Å
211	L	93.4	Very high	89.6	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-41.4	177.6	-178.8	58.8	0	0	0	111.4	V120 L123 L124 M127 Y186 E207 M213 F214 L215	V120-L211 HydrophobicContact CG1-CD2 4.1Å; L123-L211 HydrophobicContact CB-CD1 4.16Å; L123-L211 HydrophobicContact CB-CD2 4.14Å; L124-L211 HydrophobicContact CD2-CB 4.16Å; L124-L211 HydrophobicContact CD2-CD2 3.75Å; L124-L211 HydrophobicContact CD2-CG 4.43Å; L124-L211 HydrophobicContact CG-CD2 3.94Å; M127-L211 HydrophobicContact CB-CD1 4.24Å; M127-L211 HydrophobicContact SD-CB 4.11Å; M127-L211 HydrophobicContact SD-CD1 4.22Å; Y186-L211 HydrophobicContact CD2-CD2 3.74Å; Y186-L211 HydrophobicContact CD2-CG 4.39Å; Y186-L211 HydrophobicContact CE1-CB 4.42Å; Y186-L211 HydrophobicContact CE1-CD2 4.43Å; Y186-L211 HydrophobicContact CE1-CG 4.21Å; Y186-L211 HydrophobicContact CE2-CD2 3.44Å; Y186-L211 VanDerWaalsContact CE2-CD2 3.44Å; Y186-L211 HydrophobicContact CE2-CG 4.1Å; Y186-L211 HydrophobicContact CG-CD2 4.36Å; E207-L211 PolarHBondContact O-N 2.86Å; L211-M213 VanDerWaalsContact C-N 3.33Å; L211-M213 PolarHBondContact O-N 3.21Å; L211-F214 HydrophobicContact CD1-CD1 4.19Å; L211-F214 PolarHBondContact O-N 3.08Å; L211-L215 HydrophobicContact CD1-CD1 4.02Å; L211-L215 HydrophobicContact CD1-CD2 4.44Å; L211-L215 HydrophobicContact CD1-CG 3.98Å; L211-L215 HydrophobicContact CG-CD1 4.04Å; L211-L215 HydrophobicContact CG-CG 4.4Å; L211-L215 WeakPolarHBondContact O-CG 3.39Å; L211-L215 PolarHBondContact O-N 3.03Å
212	S	92.9	Very high	90.1	Very high	29 Å²	29	58.8 Å²	58.8	20%	0.203	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-45.2	175.9	-164.1	0	0	0	0	112	R190 S208 Q209 N210 A216	R190-S212 PolarHBondContact NH1-OG 3.32Å; R190-S212 VanDerWaalsContact NH1-OG 3.13Å; S208-S212 WeakPolarHBondContact O-CB 3.48Å; S208-S212 PolarHBondContact O-N 3.27Å; Q209-S212 WeakPolarHBondContact O-CB 3.46Å; Q209-S212 PolarHBondContact O-N 3Å; N210-S212 VanDerWaalsContact C-N 3.33Å; N210-S212 PolarHBondContact O-N 3.34Å; S212-A216 VanDerWaalsContact O-CB 3.23Å; S212-A216 WeakPolarHBondContact O-CB 3.46Å; S212-A216 PolarHBondContact O-N 2.79Å; S212-A216 VanDerWaalsContact O-N 3.09Å
213	M	92.8	Very high	90.5	Very high	104 Å²	104	57.2 Å²	57.2	51%	0.512	30%	0.295	S	S	.	.	H	α-helix	trans	-68.7	-38.9	178.9	-71.8	-58.2	-58.7	0	0	112	Q209 N210 L211 A216 T217	Q209-M213 WeakPolarHBondContact O-CG 3.26Å; Q209-M213 PolarHBondContact O-N 3.47Å; N210-M213 PolarHBondContact O-N 3.02Å; L211-M213 VanDerWaalsContact C-N 3.33Å; L211-M213 PolarHBondContact O-N 3.21Å; M213-A216 PolarHBondContact O-N 2.92Å; M213-T217 WeakPolarHBondContact O-CB 2.95Å; M213-T217 PolarHBondContact O-N 2.94Å; M213-T217 VanDerWaalsContact O-N 3.11Å; M213-T217 PolarHBondContact O-OG1 2.98Å
214	F	95.2	Very high	90.9	Very high	9 Å²	9	52 Å²	52	4%	0.039	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-49.4	177.1	172.6	-111	0	0	0	111.8	F126 M127 Q130 K176 N210 L211 K220 I221	F126-F214 AromaticContact CD1-CE1 3.66Å; F126-F214 HydrophobicContact CD1-CE1 3.66Å; F126-F214 HydrophobicContact CD1-CZ 4.04Å; F126-F214 AromaticContact CE1-CE1 3.5Å; F126-F214 HydrophobicContact CE1-CE1 3.5Å; F126-F214 VanDerWaalsContact CE1-CE1 3.5Å; F126-F214 AromaticContact CE1-CZ 3.52Å; F126-F214 HydrophobicContact CE1-CZ 3.52Å; F126-F214 HydrophobicContact CZ-CE1 4.33Å; F126-F214 AromaticContact CZ-CZ 3.89Å; F126-F214 HydrophobicContact CZ-CZ 3.89Å; M127-F214 HydrophobicContact CB-CD1 4.07Å; M127-F214 HydrophobicContact CB-CE1 4.24Å; M127-F214 HydrophobicContact CG-CB 4.32Å; M127-F214 HydrophobicContact CG-CD1 4.08Å; M127-F214 HydrophobicContact CG-CG 4.07Å; M127-F214 HydrophobicContact SD-CB 4.17Å; Q130-F214 HydrophobicContact CG-CE2 3.84Å; Q130-F214 HydrophobicContact CG-CZ 3.87Å; K176-F214 HydrophobicContact CD-CE1 3.96Å; K176-F214 HydrophobicContact CD-CE2 4.05Å; K176-F214 HydrophobicContact CD-CZ 3.66Å; K176-F214 WeakPolarHBondContact CE-O 3.48Å; N210-F214 WeakPolarHBondContact O-CB 3.49Å; N210-F214 PolarHBondContact O-N 3.08Å; L211-F214 HydrophobicContact CD1-CD1 4.19Å; L211-F214 PolarHBondContact O-N 3.08Å; F214-K220 HydrophobicContact CD2-CB 4.35Å; F214-K220 HydrophobicContact CD2-CG 3.86Å; F214-K220 HydrophobicContact CE2-CG 4.35Å; F214-I221 HydrophobicContact CE2-CD1 4.48Å; F214-I221 HydrophobicContact CE2-CG1 4Å; F214-I221 HydrophobicContact CZ-CD1 4.33Å; F214-I221 HydrophobicContact CZ-CG1 4.34Å
215	L	93.9	Very high	91.4	Very high	15 Å²	15	50 Å²	50	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-68.8	-33.6	179.8	-63.7	176	0	0	0	112.5	L123 I182 Y186 L211	L123-L215 HydrophobicContact CD1-CD1 4.18Å; I182-L215 HydrophobicContact CD1-CD2 3.84Å; I182-L215 HydrophobicContact CG1-CD2 4.26Å; Y186-L215 HydrophobicContact CD1-CD1 3.86Å; Y186-L215 HydrophobicContact CG-CD1 3.86Å; L211-L215 HydrophobicContact CD1-CD1 4.02Å; L211-L215 HydrophobicContact CD1-CD2 4.44Å; L211-L215 HydrophobicContact CD1-CG 3.98Å; L211-L215 HydrophobicContact CG-CD1 4.04Å; L211-L215 HydrophobicContact CG-CG 4.4Å; L211-L215 WeakPolarHBondContact O-CG 3.39Å; L211-L215 PolarHBondContact O-N 3.03Å
216	A	90.7	Very high	91.6	Very high	52 Å²	52	47 Å²	47	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-76.4	-27.5	-178.6	0	0	0	0	0	114	S212 M213	S212-A216 VanDerWaalsContact O-CB 3.23Å; S212-A216 WeakPolarHBondContact O-CB 3.46Å; S212-A216 PolarHBondContact O-N 2.79Å; S212-A216 VanDerWaalsContact O-N 3.09Å; M213-A216 PolarHBondContact O-N 2.92Å
217	T	92.9	Very high	91.8	Very high	46 Å²	46	48 Å²	48	28%	0.282	25%	0.245	S	C	.	.	S	Bend	trans	-85.6	117.5	-175.6	-50.8	0	0	0	0	110.2	K176 M213 K220	K176-T217 WeakPolarHBondContact CE-O 3.49Å; K176-T217 PolarHBondContact NZ-O 3.26Å; M213-T217 WeakPolarHBondContact O-CB 2.95Å; M213-T217 PolarHBondContact O-N 2.94Å; M213-T217 VanDerWaalsContact O-N 3.11Å; M213-T217 PolarHBondContact O-OG1 2.98Å; T217-K220 HydrophobicContact CG2-CB 4.22Å; T217-K220 HydrophobicContact CG2-CD 4.02Å
218	Q	90.8	Very high	92	Very high	132 Å²	132	47.9 Å²	47.9	62%	0.617	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	147.2	171.7	-72.8	-158.4	-9.4	0	0	111	N177 K220	N177-Q218 WeakPolarHBondContact OD1-CA 3.21Å; Q218-K220 PolarHBondContact O-N 3.31Å
219	N	90.4	Very high	92.1	Very high	33 Å²	33	47.5 Å²	47.5	18%	0.176	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	22.2	177.9	-57.8	-79.1	0	0	0	115.3	D173 N177 I221 K222 D223	D173-N219 WeakPolarHBondContact OD2-CA 3.18Å; N177-N219 PolarHBondContact OD1-N 2.76Å; N219-I221 VanDerWaalsContact C-N 3.29Å; N219-I221 PolarHBondContact O-N 3.07Å; N219-K222 PolarHBondContact O-N 3.12Å; N219-K222 PolarHBondContact OD1-NZ 3.45Å; N219-D223 WeakPolarHBondContact O-CB 3.37Å; N219-D223 VanDerWaalsContact O-CG 3.25Å; N219-D223 PolarHBondContact O-N 2.88Å
220	K	93.4	Very high	92	Very high	81 Å²	81	47.9 Å²	47.9	35%	0.352	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-37.3	-170.9	-176.3	58.1	-179.5	-179.8	0	112.6	D173 F214 T217 Q218 T224	D173-K220 PolarHBondContact OD1-N 3.03Å; F214-K220 HydrophobicContact CD2-CB 4.35Å; F214-K220 HydrophobicContact CD2-CG 3.86Å; F214-K220 HydrophobicContact CE2-CG 4.35Å; T217-K220 HydrophobicContact CG2-CB 4.22Å; T217-K220 HydrophobicContact CG2-CD 4.02Å; Q218-K220 PolarHBondContact O-N 3.31Å; K220-T224 VanDerWaalsContact O-CB 3.32Å; K220-T224 WeakPolarHBondContact O-CB 2.91Å; K220-T224 PolarHBondContact O-N 2.92Å; K220-T224 VanDerWaalsContact O-N 3.08Å; K220-T224 PolarHBondContact O-OG1 3.27Å
221	I	94.2	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.9	-49.2	-179.4	-59	176.5	0	0	0	109.1	F126 Q130 F169 L172 D173 F214 N219 D223 T224 L225	F126-I221 HydrophobicContact CE2-CD1 4.2Å; F126-I221 HydrophobicContact CZ-CD1 3.77Å; Q130-I221 HydrophobicContact CB-CD1 4.09Å; Q130-I221 HydrophobicContact CB-CG1 4.32Å; Q130-I221 HydrophobicContact CG-CD1 4.28Å; Q130-I221 HydrophobicContact CG-CG1 4.19Å; F169-I221 HydrophobicContact CB-CG2 4.15Å; F169-I221 HydrophobicContact CD1-CG2 3.88Å; F169-I221 HydrophobicContact CG-CG2 4.38Å; L172-I221 HydrophobicContact CB-CD1 4Å; D173-I221 HydrophobicContact CB-CB 3.94Å; D173-I221 HydrophobicContact CB-CD1 4.31Å; D173-I221 HydrophobicContact CB-CG1 4.44Å; D173-I221 PolarHBondContact OD1-N 2.62Å; D173-I221 PolarHBondContact OD2-N 3.46Å; F214-I221 HydrophobicContact CE2-CD1 4.48Å; F214-I221 HydrophobicContact CE2-CG1 4Å; F214-I221 HydrophobicContact CZ-CD1 4.33Å; F214-I221 HydrophobicContact CZ-CG1 4.34Å; N219-I221 VanDerWaalsContact C-N 3.29Å; N219-I221 PolarHBondContact O-N 3.07Å; I221-D223 PolarHBondContact O-N 3.16Å; I221-T224 PolarHBondContact O-N 3.19Å; I221-L225 WeakPolarHBondContact O-CB 3.31Å; I221-L225 PolarHBondContact O-N 2.69Å
222	K	89.5	Confident	91.8	Very high	22 Å²	22	51.8 Å²	51.8	10%	0.096	26%	0.26	C	S	.	.	H	α-helix	trans	-55.3	-48.1	176.1	-178.5	-172.9	76.1	-160.2	0	112.2	D173 N219 T224 L225 R226 F262	D173-K222 WeakPolarHBondContact OD2-CB 3.25Å; D173-K222 PolarHBondContact OD2-N 3.46Å; N219-K222 PolarHBondContact O-N 3.12Å; N219-K222 PolarHBondContact OD1-NZ 3.45Å; K222-T224 VanDerWaalsContact C-N 3.35Å; K222-T224 PolarHBondContact O-N 3.22Å; K222-L225 PolarHBondContact O-N 3.42Å; K222-R226 WeakPolarHBondContact O-CB 3.25Å; K222-R226 PolarHBondContact O-N 3.02Å; K222-F262 HydrophobicContact CB-CE2 4.25Å; K222-F262 HydrophobicContact CB-CZ 3.88Å; K222-F262 HydrophobicContact CD-CE2 3.8Å; K222-F262 HydrophobicContact CD-CZ 4.18Å; K222-F262 HydrophobicContact CG-CE2 3.85Å; K222-F262 HydrophobicContact CG-CZ 3.69Å
223	D	90.4	Very high	91.5	Very high	72 Å²	72	57.6 Å²	57.6	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-68.5	-36.9	-176.1	-66.8	-16.9	0	0	0	111.7	N219 I221 K227	N219-D223 WeakPolarHBondContact O-CB 3.37Å; N219-D223 VanDerWaalsContact O-CG 3.25Å; N219-D223 PolarHBondContact O-N 2.88Å; I221-D223 PolarHBondContact O-N 3.16Å; D223-K227 WeakPolarHBondContact O-CB 3.32Å; D223-K227 PolarHBondContact O-N 3.48Å
224	T	92.3	Very high	91.2	Very high	31 Å²	31	53.1 Å²	53.1	19%	0.19	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-45.9	175.3	-55.4	0	0	0	0	111	K220 I221 K222 K227 Q228	K220-T224 VanDerWaalsContact O-CB 3.32Å; K220-T224 WeakPolarHBondContact O-CB 2.91Å; K220-T224 PolarHBondContact O-N 2.92Å; K220-T224 VanDerWaalsContact O-N 3.08Å; K220-T224 PolarHBondContact O-OG1 3.27Å; I221-T224 PolarHBondContact O-N 3.19Å; K222-T224 VanDerWaalsContact C-N 3.35Å; K222-T224 PolarHBondContact O-N 3.22Å; T224-K227 PolarHBondContact O-N 3.15Å; T224-Q228 WeakPolarHBondContact O-CG 3.37Å; T224-Q228 PolarHBondContact O-N 2.93Å; T224-Q228 VanDerWaalsContact O-N 3.08Å
225	L	92.9	Very high	91	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-47.7	176.5	176.9	64.6	0	0	0	111.2	T134 F137 F169 I221 K222 K227 Q228 L229 F262 L266	T134-L225 HydrophobicContact CG2-CB 4.13Å; T134-L225 HydrophobicContact CG2-CD1 3.88Å; F137-L225 HydrophobicContact CD1-CD1 3.7Å; F137-L225 HydrophobicContact CE1-CD1 4.02Å; F169-L225 HydrophobicContact CB-CD2 4.13Å; F169-L225 HydrophobicContact CD2-CD1 4.42Å; F169-L225 HydrophobicContact CD2-CD2 3.6Å; F169-L225 HydrophobicContact CE2-CD1 4.26Å; F169-L225 HydrophobicContact CE2-CD2 4.26Å; F169-L225 HydrophobicContact CG-CD2 4.01Å; I221-L225 WeakPolarHBondContact O-CB 3.31Å; I221-L225 PolarHBondContact O-N 2.69Å; K222-L225 PolarHBondContact O-N 3.42Å; L225-K227 PolarHBondContact O-N 3.04Å; L225-Q228 PolarHBondContact O-N 3.44Å; L225-L229 HydrophobicContact CD1-CD1 3.92Å; L225-L229 HydrophobicContact CD1-CG 4.17Å; L225-L229 HydrophobicContact CG-CD1 3.83Å; L225-L229 HydrophobicContact CG-CG 4.46Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 VanDerWaalsContact O-CG 3.25Å; L225-L229 WeakPolarHBondContact O-CG 3.5Å; L225-L229 PolarHBondContact O-N 3.31Å; L225-F262 HydrophobicContact CD2-CE1 4.47Å; L225-L266 HydrophobicContact CD2-CD1 3.83Å; L225-L266 HydrophobicContact CD2-CD2 4.28Å; L225-L266 HydrophobicContact CG-CD2 4.48Å
226	R	89.6	Confident	90.7	Very high	27 Å²	27	53.9 Å²	53.9	10%	0.102	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-48.7	177.3	179.9	-177.2	-74.2	161.4	-7.3	111.3	K222 Q228 L229 Q230 C265 L266	K222-R226 WeakPolarHBondContact O-CB 3.25Å; K222-R226 PolarHBondContact O-N 3.02Å; R226-Q228 PolarHBondContact O-N 3.16Å; R226-L229 PolarHBondContact O-N 3.03Å; R226-Q230 HydrophobicContact CG-CG 4.45Å; R226-Q230 WeakPolarHBondContact O-CG 3.35Å; R226-Q230 PolarHBondContact O-N 3.5Å; R226-C265 PolarHBondContact NH2-O 3.14Å; R226-C265 PolarHBondContact NH2-SG 3.14Å; R226-C265 VanDerWaalsContact NH2-SG 3.35Å; R226-L266 HydrophobicContact CB-CD2 4.24Å
227	K	90.2	Very high	90.4	Very high	137 Å²	137	52.1 Å²	52.1	60%	0.596	26%	0.255	S	S	*	.	H	α-helix	trans	-59.3	-46.7	-179.7	-173.7	-179.7	176.2	-176.7	0	111.8	D223 T224 L225 L229 Q230 E231	D223-K227 WeakPolarHBondContact O-CB 3.32Å; D223-K227 PolarHBondContact O-N 3.48Å; T224-K227 PolarHBondContact O-N 3.15Å; L225-K227 PolarHBondContact O-N 3.04Å; K227-L229 VanDerWaalsContact C-N 3.34Å; K227-L229 PolarHBondContact O-N 3.45Å; K227-Q230 PolarHBondContact O-N 2.93Å; K227-E231 PolarHBondContact O-N 3.47Å
228	Q	93.2	Very high	90.2	Very high	57 Å²	57	50.6 Å²	50.6	27%	0.266	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-33.2	178.9	-69.8	-173.9	17.6	0	0	112.9	C138 T224 L225 R226 E231	C138-Q228 HydrophobicContact CB-CB 4.45Å; T224-Q228 WeakPolarHBondContact O-CG 3.37Å; T224-Q228 PolarHBondContact O-N 2.93Å; T224-Q228 VanDerWaalsContact O-N 3.08Å; L225-Q228 PolarHBondContact O-N 3.44Å; R226-Q228 PolarHBondContact O-N 3.16Å; Q228-E231 PolarHBondContact O-N 3.12Å
229	L	91.6	Very high	90.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-40.4	175.1	-74.4	170	0	0	0	112.1	F137 V141 L225 R226 K227 E231 I232 Y235 L239 L266	F137-L229 HydrophobicContact CE1-CD2 4.15Å; V141-L229 HydrophobicContact CB-CD2 4.2Å; V141-L229 HydrophobicContact CG1-CD2 3.86Å; V141-L229 HydrophobicContact CG2-CD2 4.07Å; L225-L229 HydrophobicContact CD1-CD1 3.92Å; L225-L229 HydrophobicContact CD1-CG 4.17Å; L225-L229 HydrophobicContact CG-CD1 3.83Å; L225-L229 HydrophobicContact CG-CG 4.46Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 VanDerWaalsContact O-CG 3.25Å; L225-L229 WeakPolarHBondContact O-CG 3.5Å; L225-L229 PolarHBondContact O-N 3.31Å; R226-L229 PolarHBondContact O-N 3.03Å; K227-L229 VanDerWaalsContact C-N 3.34Å; K227-L229 PolarHBondContact O-N 3.45Å; L229-E231 PolarHBondContact O-N 3.49Å; L229-I232 WeakPolarHBondContact O-CB 3.36Å; L229-I232 PolarHBondContact O-N 2.92Å; L229-Y235 HydrophobicContact CB-CD2 3.79Å; L229-Y235 HydrophobicContact CB-CE2 4.09Å; L229-Y235 HydrophobicContact CB-CG 4.17Å; L229-Y235 HydrophobicContact CD2-CD2 4.36Å; L229-Y235 HydrophobicContact CG-CD2 4.47Å; L229-Y235 WeakPolarHBondContact O-CD1 3.36Å; L229-L239 HydrophobicContact CD1-CD1 4.28Å; L229-L266 HydrophobicContact CD1-CD1 4.31Å
230	Q	89.1	Confident	89.9	Confident	82 Å²	82	42.9 Å²	42.9	38%	0.383	21%	0.208	S	C	.	.	H	α-helix	trans	-64.7	-20.7	178.3	-74.3	175.5	-28.6	0	0	113.6	R226 K227 I232 Y235 D269	R226-Q230 HydrophobicContact CG-CG 4.45Å; R226-Q230 WeakPolarHBondContact O-CG 3.35Å; R226-Q230 PolarHBondContact O-N 3.5Å; K227-Q230 PolarHBondContact O-N 2.93Å; Q230-I232 PolarHBondContact O-N 3.48Å; Q230-Y235 HydrophobicContact CG-CE1 4.4Å; Q230-D269 VanDerWaalsContact NE2-CB 3.33Å
231	E	90.3	Very high	89.6	Confident	142 Å²	142	40.6 Å²	40.6	66%	0.664	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.9	173.1	-67.6	172.1	-171	0	0	112.9	K227 Q228 L229	K227-E231 PolarHBondContact O-N 3.47Å; Q228-E231 PolarHBondContact O-N 3.12Å; L229-E231 PolarHBondContact O-N 3.49Å
232	I	90.8	Very high	89.2	Confident	16 Å²	16	40.7 Å²	40.7	8%	0.082	20%	0.2	C	C	.	.	S	Bend	trans	-105.3	118.1	-176.8	-59.8	166.5	0	0	0	110.2	C138 V141 K142 L229 Q230 G234 Y235	C138-I232 HydrophobicContact CB-CD1 4.08Å; C138-I232 VanDerWaalsContact O-CD1 3.31Å; C138-I232 WeakPolarHBondContact O-CD1 3.23Å; V141-I232 HydrophobicContact CB-CD1 4.32Å; V141-I232 HydrophobicContact CG1-CD1 4.15Å; V141-I232 HydrophobicContact CG1-CG2 4.39Å; K142-I232 HydrophobicContact CB-CD1 3.96Å; K142-I232 HydrophobicContact CB-CG1 4.13Å; K142-I232 HydrophobicContact CB-CG2 4.06Å; K142-I232 HydrophobicContact CG-CG1 4.44Å; K142-I232 HydrophobicContact CG-CG2 4.27Å; L229-I232 WeakPolarHBondContact O-CB 3.36Å; L229-I232 PolarHBondContact O-N 2.92Å; Q230-I232 PolarHBondContact O-N 3.48Å; I232-G234 PolarHBondContact O-N 3.33Å; I232-G234 VanDerWaalsContact O-N 3.14Å; I232-Y235 WeakPolarHBondContact O-CD1 3.43Å; I232-Y235 PolarHBondContact O-N 3.04Å
233	D	87.8	Confident	88.9	Confident	151 Å²	151	39.7 Å²	39.7	81%	0.807	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	117.2	178.3	-75.9	-32	0	0	0	113	R150	R150-D233 PolarHBondContact NH2-O 3.09Å; R150-D233 VanDerWaalsContact NH2-O 3.09Å
234	G	86	Confident	88.6	Confident	10 Å²	10	37.9 Å²	37.9	10%	0.103	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	35.5	178.9	0	0	0	0	0	115.2	S145 R150 I232 E236	S145-G234 PolarHBondContact OG-O 3.29Å; R150-G234 PolarHBondContact NH2-O 3.31Å; I232-G234 PolarHBondContact O-N 3.33Å; I232-G234 VanDerWaalsContact O-N 3.14Å; G234-E236 WeakPolarHBondContact CA-OE1 3.36Å; G234-E236 WeakPolarHBondContact CA-OE2 3.21Å
235	Y	90.9	Very high	88.1	Confident	7 Å²	7	36.4 Å²	36.4	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-59.3	-36.2	166.3	80.6	-83.6	0	0	0	111.7	L229 Q230 I232 E237 L238 L239 L266	L229-Y235 HydrophobicContact CB-CD2 3.79Å; L229-Y235 HydrophobicContact CB-CE2 4.09Å; L229-Y235 HydrophobicContact CB-CG 4.17Å; L229-Y235 HydrophobicContact CD2-CD2 4.36Å; L229-Y235 HydrophobicContact CG-CD2 4.47Å; L229-Y235 WeakPolarHBondContact O-CD1 3.36Å; Q230-Y235 HydrophobicContact CG-CE1 4.4Å; I232-Y235 WeakPolarHBondContact O-CD1 3.43Å; I232-Y235 PolarHBondContact O-N 3.04Å; Y235-E237 VanDerWaalsContact C-N 3.25Å; Y235-E237 PolarHBondContact O-N 3.43Å; Y235-L238 PolarHBondContact O-N 3.48Å; Y235-L238 VanDerWaalsContact O-N 3.15Å; Y235-L239 HydrophobicContact CD2-CD1 3.73Å; Y235-L239 HydrophobicContact CD2-CG 4.37Å; Y235-L239 HydrophobicContact CE2-CD1 4Å; Y235-L239 PolarHBondContact O-N 3.22Å; Y235-L266 PolarHBondContact OH-O 2.99Å
236	E	87.2	Confident	87.3	Confident	34 Å²	34	36.6 Å²	36.6	16%	0.159	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-32.2	-176	71.8	-69.8	165	0	0	112.1	G234 A240 I267 N273 L277	G234-E236 WeakPolarHBondContact CA-OE1 3.36Å; G234-E236 WeakPolarHBondContact CA-OE2 3.21Å; E236-A240 VanDerWaalsContact O-CB 3.25Å; E236-A240 WeakPolarHBondContact O-CB 3.3Å; E236-A240 PolarHBondContact O-N 3.02Å; E236-I267 HydrophobicContact CB-CG2 4.37Å; E236-N273 HydrophobicContact CG-CB 4.46Å; E236-L277 HydrophobicContact CB-CD1 4.39Å; E236-L277 HydrophobicContact CG-CD1 4.39Å
237	E	85.8	Confident	86.7	Confident	15 Å²	15	35.6 Å²	35.6	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-72.6	-34.4	178.2	-64.6	-82.5	-175.5	0	0	111.2	Y235 D241 L277 K280 R282	Y235-E237 VanDerWaalsContact C-N 3.25Å; Y235-E237 PolarHBondContact O-N 3.43Å; E237-D241 PolarHBondContact O-N 3.45Å; E237-L277 HydrophobicContact CG-CD2 4.46Å; E237-K280 IonicContact OE1-NZ 3.36Å; E237-K280 PolarHBondContact OE1-NZ 3.13Å; E237-R282 WeakPolarHBondContact OE2-CD 3.3Å; E237-R282 IonicContact OE2-CZ 3.42Å; E237-R282 IonicContact OE2-NE 3.05Å; E237-R282 PolarHBondContact OE2-NE 3.37Å; E237-R282 IonicContact OE2-NH1 2.69Å; E237-R282 PolarHBondContact OE2-NH1 2.84Å
238	L	88.9	Confident	86.1	Confident	13 Å²	13	31.7 Å²	31.7	7%	0.068	16%	0.164	C	C	.	.	H	α-helix	trans	-74.3	-44.1	174	177.4	68.2	0	0	0	111.5	V141 L144 L159 Y235 A240 D241 V242	V141-L238 HydrophobicContact CB-CD2 4.18Å; V141-L238 HydrophobicContact CG1-CD2 4.02Å; V141-L238 HydrophobicContact CG2-CD2 4.11Å; L144-L238 HydrophobicContact CB-CD1 4.11Å; L144-L238 HydrophobicContact CB-CD2 3.71Å; L144-L238 HydrophobicContact CD1-CD1 4.24Å; L144-L238 HydrophobicContact CD1-CD2 4Å; L159-L238 HydrophobicContact CD2-CD1 4.09Å; Y235-L238 PolarHBondContact O-N 3.48Å; Y235-L238 VanDerWaalsContact O-N 3.15Å; L238-A240 PolarHBondContact O-N 2.92Å; L238-D241 WeakPolarHBondContact O-CA 3.34Å; L238-D241 WeakPolarHBondContact O-CB 3.45Å; L238-D241 PolarHBondContact O-N 3.31Å; L238-V242 PolarHBondContact O-N 2.93Å
239	L	88.1	Confident	85.1	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-34	174.9	-68.1	-174.5	0	0	0	111.1	F137 I166 L229 Y235 D241 V242 V243 L266 I267	F137-L239 HydrophobicContact CZ-CD2 4.44Å; I166-L239 HydrophobicContact CD1-CD2 3.6Å; L229-L239 HydrophobicContact CD1-CD1 4.28Å; Y235-L239 HydrophobicContact CD2-CD1 3.73Å; Y235-L239 HydrophobicContact CD2-CG 4.37Å; Y235-L239 HydrophobicContact CE2-CD1 4Å; Y235-L239 PolarHBondContact O-N 3.22Å; L239-D241 VanDerWaalsContact C-N 3.3Å; L239-D241 PolarHBondContact O-N 2.96Å; L239-V242 WeakPolarHBondContact O-CB 3.48Å; L239-V242 PolarHBondContact O-N 3.42Å; L239-V243 WeakPolarHBondContact O-CG2 3.33Å; L239-V243 PolarHBondContact O-N 3.36Å; L239-L266 HydrophobicContact CD1-CB 4.13Å; L239-I267 HydrophobicContact CB-CD1 3.78Å; L239-I267 HydrophobicContact CB-CG1 3.61Å; L239-I267 HydrophobicContact CD1-CG1 4.07Å
240	A	86.2	Confident	84	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-36.7	171.3	0	0	0	0	0	112.6	E236 L238 V243 S244 L277 L283	E236-A240 VanDerWaalsContact O-CB 3.25Å; E236-A240 WeakPolarHBondContact O-CB 3.3Å; E236-A240 PolarHBondContact O-N 3.02Å; L238-A240 PolarHBondContact O-N 2.92Å; A240-V243 PolarHBondContact O-N 3.28Å; A240-S244 WeakPolarHBondContact O-CB 3.38Å; A240-S244 PolarHBondContact O-N 3.36Å; A240-L277 HydrophobicContact CB-CD1 4.15Å; A240-L277 HydrophobicContact CB-CD2 4.4Å; A240-L283 HydrophobicContact CB-CD1 3.57Å; A240-L283 HydrophobicContact CB-CG 3.92Å
241	D	86	Confident	83	Confident	33 Å²	33	31 Å²	31	18%	0.176	16%	0.162	C	C	.	.	H	α-helix	trans	-67.3	-40.7	173.3	-71.3	-36	0	0	0	112	L159 E237 L238 L239 S244 V245 R282	L159-D241 HydrophobicContact CD1-CB 4.44Å; E237-D241 PolarHBondContact O-N 3.45Å; L238-D241 WeakPolarHBondContact O-CA 3.34Å; L238-D241 WeakPolarHBondContact O-CB 3.45Å; L238-D241 PolarHBondContact O-N 3.31Å; L239-D241 VanDerWaalsContact C-N 3.3Å; L239-D241 PolarHBondContact O-N 2.96Å; D241-S244 PolarHBondContact O-N 3.33Å; D241-V245 WeakPolarHBondContact O-CB 3.48Å; D241-V245 VanDerWaalsContact O-CG2 3.23Å; D241-V245 WeakPolarHBondContact O-CG2 3.32Å; D241-V245 PolarHBondContact O-N 2.67Å; D241-R282 IonicContact OD1-CZ 2.92Å; D241-R282 IonicContact OD1-NH2 3.71Å; D241-R282 PolarHBondContact OD1-NH2 2.57Å; D241-R282 IonicContact OD2-CZ 3.88Å; D241-R282 IonicContact OD2-NH2 2.86Å; D241-R282 PolarHBondContact OD2-NH2 3.42Å
242	V	87	Confident	82	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-50.2	173.3	175	0	0	0	0	110.4	L159 L162 I166 L238 L239 S244 C246 V259	L159-V242 HydrophobicContact CB-CG2 4.47Å; L159-V242 HydrophobicContact CD2-CG2 3.96Å; L162-V242 HydrophobicContact CB-CG2 4.16Å; I166-V242 HydrophobicContact CD1-CG1 4.32Å; L238-V242 PolarHBondContact O-N 2.93Å; L239-V242 WeakPolarHBondContact O-CB 3.48Å; L239-V242 PolarHBondContact O-N 3.42Å; V242-S244 VanDerWaalsContact C-N 3.32Å; V242-S244 PolarHBondContact O-N 3.42Å; V242-C246 WeakPolarHBondContact O-CB 3.18Å; V242-C246 PolarHBondContact O-N 2.97Å; V242-C246 PolarHBondContact O-SG 3.42Å; V242-V259 HydrophobicContact CG1-CG1 4.23Å
243	V	83.2	Confident	80.5	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-34.8	178.2	174.7	0	0	0	0	111.7	L239 A240 C246 V247 V260 I264 I267 L283 L288	L239-V243 WeakPolarHBondContact O-CG2 3.33Å; L239-V243 PolarHBondContact O-N 3.36Å; A240-V243 PolarHBondContact O-N 3.28Å; V243-C246 VanDerWaalsContact O-CB 3.24Å; V243-C246 WeakPolarHBondContact O-CB 3.47Å; V243-C246 PolarHBondContact O-N 2.66Å; V243-V247 HydrophobicContact CG1-CG2 4.42Å; V243-V247 WeakPolarHBondContact O-CG2 3.45Å; V243-V247 PolarHBondContact O-N 3.14Å; V243-V260 HydrophobicContact CG1-CG1 4.22Å; V243-I264 HydrophobicContact CG1-CG1 4.45Å; V243-I267 HydrophobicContact CG2-CD1 4.1Å; V243-L283 HydrophobicContact CB-CD2 4.12Å; V243-L283 HydrophobicContact CG1-CD2 3.77Å; V243-L288 HydrophobicContact CG1-CD2 4.14Å
244	S	83.7	Confident	78.8	Confident	34 Å²	34	27.2 Å²	27.2	24%	0.238	14%	0.135	C	C	.	.	H	α-helix	trans	-72.8	-42.9	179.1	-175.3	0	0	0	0	112.4	A240 D241 V242 C246 V247 N248	A240-S244 WeakPolarHBondContact O-CB 3.38Å; A240-S244 PolarHBondContact O-N 3.36Å; D241-S244 PolarHBondContact O-N 3.33Å; V242-S244 VanDerWaalsContact C-N 3.32Å; V242-S244 PolarHBondContact O-N 3.42Å; S244-C246 PolarHBondContact O-N 3.47Å; S244-V247 PolarHBondContact O-N 3.49Å; S244-N248 WeakPolarHBondContact O-CB 3.48Å; S244-N248 PolarHBondContact O-N 3.02Å
245	V	80.7	Confident	77.4	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-55.1	-46.5	169.9	169.4	0	0	0	0	109.1	E156 L159 L160 D241 N248 Y249	E156-V245 HydrophobicContact CG-CG1 4.32Å; L159-V245 HydrophobicContact CB-CG2 4.05Å; L159-V245 HydrophobicContact CD1-CG2 3.52Å; L159-V245 HydrophobicContact CG-CG2 4.41Å; L160-V245 HydrophobicContact CD2-CG1 3.94Å; L160-V245 HydrophobicContact CG-CG1 3.93Å; D241-V245 WeakPolarHBondContact O-CB 3.48Å; D241-V245 VanDerWaalsContact O-CG2 3.23Å; D241-V245 WeakPolarHBondContact O-CG2 3.32Å; D241-V245 PolarHBondContact O-N 2.67Å; V245-N248 PolarHBondContact O-N 3.09Å; V245-Y249 HydrophobicContact CG1-CD2 3.97Å; V245-Y249 HydrophobicContact CG1-CE2 4.1Å; V245-Y249 WeakPolarHBondContact O-CB 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.47Å; V245-Y249 PolarHBondContact O-N 2.94Å
246	C	77	Confident	74.9	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.02	14%	0.138	C	C	.	.	H	α-helix	trans	-55.4	-62.9	174.7	-75	0	0	0	0	111	V242 V243 S244 N248 Y249 F250 I256 V260	V242-C246 WeakPolarHBondContact O-CB 3.18Å; V242-C246 PolarHBondContact O-N 2.97Å; V242-C246 PolarHBondContact O-SG 3.42Å; V243-C246 VanDerWaalsContact O-CB 3.24Å; V243-C246 WeakPolarHBondContact O-CB 3.47Å; V243-C246 PolarHBondContact O-N 2.66Å; S244-C246 PolarHBondContact O-N 3.47Å; C246-N248 PolarHBondContact O-N 2.83Å; C246-Y249 PolarHBondContact O-N 3.41Å; C246-F250 PolarHBondContact O-N 2.62Å; C246-I256 VanDerWaalsContact CA-CD1 3.42Å; C246-I256 HydrophobicContact CB-CB 4.21Å; C246-I256 HydrophobicContact CB-CD1 4.06Å; C246-I256 HydrophobicContact CB-CG1 3.71Å; C246-I256 HydrophobicContact CB-CG2 3.67Å; C246-I256 WeakPolarHBondContact O-CD1 3.43Å; C246-I256 VanDerWaalsContact SG-CG2 3.59Å; C246-V260 HydrophobicContact CB-CG2 4.06Å
247	V	76.4	Confident	72.8	Confident	7 Å²	7	27.6 Å²	27.6	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-50.9	-38.7	178.5	166.2	0	0	0	0	113.5	V243 S244 F250 D251 R287 L288 I291	V243-V247 HydrophobicContact CG1-CG2 4.42Å; V243-V247 WeakPolarHBondContact O-CG2 3.45Å; V243-V247 PolarHBondContact O-N 3.14Å; S244-V247 PolarHBondContact O-N 3.49Å; V247-F250 WeakPolarHBondContact O-CB 3.35Å; V247-F250 PolarHBondContact O-N 2.87Å; V247-D251 PolarHBondContact O-N 2.88Å; V247-R287 HydrophobicContact CG1-CG 4.17Å; V247-R287 VanDerWaalsContact CG1-CZ 3.5Å; V247-R287 VanDerWaalsContact CG1-NE 3.33Å; V247-L288 HydrophobicContact CG2-CD2 3.49Å; V247-L288 VanDerWaalsContact CG2-CD2 3.49Å; V247-I291 HydrophobicContact CB-CD1 4.22Å; V247-I291 HydrophobicContact CG1-CD1 3.56Å; V247-I291 HydrophobicContact CG2-CD1 4.02Å
248	N	77.7	Confident	71	Confident	54 Å²	54	27.5 Å²	27.5	29%	0.289	14%	0.136	S	C	.	.	H	α-helix	trans	-67.8	-41.4	176.8	-169.3	35.5	0	0	0	113.3	S244 V245 C246 F250 N252	S244-N248 WeakPolarHBondContact O-CB 3.48Å; S244-N248 PolarHBondContact O-N 3.02Å; V245-N248 PolarHBondContact O-N 3.09Å; C246-N248 PolarHBondContact O-N 2.83Å; N248-F250 VanDerWaalsContact C-N 3.32Å; N248-N252 WeakPolarHBondContact O-CB 3.18Å; N248-N252 PolarHBondContact O-N 3.49Å; N248-N252 VanDerWaalsContact O-N 3.07Å; N248-N252 PolarHBondContact O-ND2 3.2Å; N248-N252 PolarHBondContact OD1-ND2 3.41Å
249	Y	72.7	Confident	69.5	Low	16 Å²	16	26.9 Å²	26.9	6%	0.063	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-38.8	175.5	-100.5	-119.6	0	0	0	110	E156 L160 V245 C246 N252 R253 R254	E156-Y249 HydrophobicContact CB-CE2 4.22Å; E156-Y249 VanDerWaalsContact CD-CE2 3.49Å; E156-Y249 HydrophobicContact CG-CE2 4.03Å; E156-Y249 WeakPolarHBondContact OE2-CE2 3.26Å; E156-Y249 PolarHBondContact OE2-OH 2.94Å; L160-Y249 HydrophobicContact CD1-CD1 3.9Å; L160-Y249 HydrophobicContact CD1-CE1 3.5Å; L160-Y249 HydrophobicContact CD1-CE2 4.38Å; V245-Y249 HydrophobicContact CG1-CD2 3.97Å; V245-Y249 HydrophobicContact CG1-CE2 4.1Å; V245-Y249 WeakPolarHBondContact O-CB 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.47Å; V245-Y249 PolarHBondContact O-N 2.94Å; C246-Y249 PolarHBondContact O-N 3.41Å; Y249-N252 PolarHBondContact O-N 3.15Å; Y249-R253 PolarHBondContact O-N 2.97Å; Y249-R254 CarbonylContact C-O 3.48Å; Y249-R254 WeakPolarHBondContact CB-O 3.41Å; Y249-R254 HydrophobicContact CD1-CB 3.47Å; Y249-R254 VanDerWaalsContact CD1-CB 3.47Å; Y249-R254 WeakPolarHBondContact CD1-O 3.44Å; Y249-R254 HydrophobicContact CE1-CB 4.09Å; Y249-R254 HydrophobicContact CG-CB 3.89Å; Y249-R254 CarbonylContact O-C 3.18Å; Y249-R254 VanDerWaalsContact O-CA 3.24Å; Y249-R254 WeakPolarHBondContact O-CA 3.26Å; Y249-R254 WeakPolarHBondContact O-CB 3.39Å; Y249-R254 PolarHBondContact O-N 2.93Å
250	F	67.8	Low	68.2	Low	37 Å²	37	27.3 Å²	27.3	16%	0.162	14%	0.136	C	C	.	.	H	α-helix	trans	-59.3	-54.5	172.8	-179.1	-90.3	0	0	0	112.2	C246 V247 N248 N252 R253 I256 I291 Q314	C246-F250 PolarHBondContact O-N 2.62Å; V247-F250 WeakPolarHBondContact O-CB 3.35Å; V247-F250 PolarHBondContact O-N 2.87Å; N248-F250 VanDerWaalsContact C-N 3.32Å; F250-N252 PolarHBondContact O-N 3.07Å; F250-R253 PolarHBondContact O-N 2.87Å; F250-I256 HydrophobicContact CB-CD1 4.07Å; F250-I256 VanDerWaalsContact N-CD1 3.28Å; F250-I291 HydrophobicContact CD1-CD1 4.05Å; F250-I291 HydrophobicContact CD1-CG1 3.88Å; F250-I291 HydrophobicContact CD1-CG2 3.91Å; F250-I291 HydrophobicContact CD2-CG2 4.29Å; F250-I291 HydrophobicContact CE1-CB 4.33Å; F250-I291 HydrophobicContact CE1-CG1 3.88Å; F250-I291 HydrophobicContact CE1-CG2 3.87Å; F250-I291 HydrophobicContact CE2-CG2 4.24Å; F250-I291 HydrophobicContact CG-CG2 4.13Å; F250-I291 HydrophobicContact CZ-CG2 4.04Å; F250-Q314 HydrophobicContact CE2-CB 4.49Å; F250-Q314 HydrophobicContact CE2-CG 4.01Å
251	D	69.7	Low	66.9	Low	72 Å²	72	27.3 Å²	27.3	39%	0.385	14%	0.135	S	C	.	.	H	α-helix	trans	-62.7	-32.2	-177	-76.7	-19.9	0	0	0	112.5	V247 R253 R287	V247-D251 PolarHBondContact O-N 2.88Å; D251-R253 VanDerWaalsContact C-N 3.3Å; D251-R253 PolarHBondContact O-N 2.86Å; D251-R287 IonicContact OD2-CZ 3.5Å; D251-R287 IonicContact OD2-NE 3.99Å; D251-R287 PolarHBondContact OD2-NE 3.08Å; D251-R287 IonicContact OD2-NH2 3.52Å; D251-R287 PolarHBondContact OD2-NH2 2.93Å
252	N	68.4	Low	66	Low	85 Å²	85	25.9 Å²	25.9	46%	0.455	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	14	177.3	-66.3	-59.2	0	0	0	114.1	N248 Y249 F250 R254	N248-N252 WeakPolarHBondContact O-CB 3.18Å; N248-N252 PolarHBondContact O-N 3.49Å; N248-N252 VanDerWaalsContact O-N 3.07Å; N248-N252 PolarHBondContact O-ND2 3.2Å; N248-N252 PolarHBondContact OD1-ND2 3.41Å; Y249-N252 PolarHBondContact O-N 3.15Å; F250-N252 PolarHBondContact O-N 3.07Å; N252-R254 VanDerWaalsContact C-N 3.26Å; N252-R254 PolarHBondContact O-N 3.18Å
253	R	59.4	Low	65.3	Low	110 Å²	110	25.8 Å²	25.8	42%	0.415	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	34.2	177.1	-51.8	-179.2	-176.9	-151.1	-6.6	114	Y249 F250 D251 P303	Y249-R253 PolarHBondContact O-N 2.97Å; F250-R253 PolarHBondContact O-N 2.87Å; D251-R253 VanDerWaalsContact C-N 3.3Å; D251-R253 PolarHBondContact O-N 2.86Å; R253-P303 VanDerWaalsContact NH1-CB 3.29Å; R253-P303 PolarHBondContact NH1-O 2.74Å; R253-P303 VanDerWaalsContact NH2-CD 3.26Å
254	R	52.4	Low	64.9	Low	34 Å²	34	25.7 Å²	25.7	13%	0.128	13%	0.126	C	C	.	.			trans	-116.9	46.1	172.3	-55.2	172.5	-170.2	-151.7	-18.8	108.2	Y249 N252 K600 V603	Y249-R254 CarbonylContact C-O 3.48Å; Y249-R254 WeakPolarHBondContact CB-O 3.41Å; Y249-R254 HydrophobicContact CD1-CB 3.47Å; Y249-R254 VanDerWaalsContact CD1-CB 3.47Å; Y249-R254 WeakPolarHBondContact CD1-O 3.44Å; Y249-R254 HydrophobicContact CE1-CB 4.09Å; Y249-R254 HydrophobicContact CG-CB 3.89Å; Y249-R254 CarbonylContact O-C 3.18Å; Y249-R254 VanDerWaalsContact O-CA 3.24Å; Y249-R254 WeakPolarHBondContact O-CA 3.26Å; Y249-R254 WeakPolarHBondContact O-CB 3.39Å; Y249-R254 PolarHBondContact O-N 2.93Å; N252-R254 VanDerWaalsContact C-N 3.26Å; N252-R254 PolarHBondContact O-N 3.18Å; R254-K600 VanDerWaalsContact NH2-CG 3.29Å; R254-K600 PolarHBondContact NH2-O 2.94Å; R254-V603 VanDerWaalsContact NH1-CG2 3.34Å
255	Y	57.3	Low	64.6	Low	26 Å²	26	24.2 Å²	24.2	10%	0.102	12%	0.116	C	C	.	.			trans	2.2	151.4	172.3	73.3	-60.8	0	0	0	123.1	H308 F311 F312	Y255-H308 HydrophobicContact CD1-CB 3.44Å; Y255-H308 VanDerWaalsContact CD1-CB 3.44Å; Y255-H308 AromaticContact CD1-CG 3.98Å; Y255-H308 VanDerWaalsContact CD1-O 3.29Å; Y255-H308 WeakPolarHBondContact CD1-O 3.46Å; Y255-H308 WeakPolarHBondContact CD2-O 3.31Å; Y255-H308 HydrophobicContact CE1-CB 2.94Å; Y255-H308 AromaticContact CE1-CD2 3.93Å; Y255-H308 AromaticContact CE1-CE1 3.92Å; Y255-H308 AromaticContact CE1-CG 2.96Å; Y255-H308 AromaticContact CE1-ND1 3.04Å; Y255-H308 WeakPolarHBondContact CE1-ND1 3.18Å; Y255-H308 WeakPolarHBondContact CE1-O 3.45Å; Y255-H308 WeakPolarHBondContact CE2-O 3.45Å; Y255-H308 AromaticContact CZ-CD2 3.75Å; Y255-H308 AromaticContact CZ-CE1 3.9Å; Y255-H308 AromaticContact CZ-CG 3.25Å; Y255-H308 AromaticContact CZ-ND1 3.44Å; Y255-H308 PolarHBondContact OH-CD2 2.84Å; Y255-H308 PolarHBondContact OH-CE1 3.42Å; Y255-H308 PolarHBondContact OH-ND1 3.44Å; Y255-H308 PolarHBondContact OH-NE2 3.09Å; Y255-H308 PolarHBondContact OH-O 3.43Å; Y255-H308 VanDerWaalsContact OH-O 3.14Å; Y255-F311 HydrophobicContact CE2-CB 3.67Å; Y255-F312 HydrophobicContact CD2-CB 3.45Å; Y255-F312 VanDerWaalsContact CD2-CB 3.45Å; Y255-F312 AromaticContact CD2-CD2 3.17Å; Y255-F312 HydrophobicContact CD2-CD2 3.17Å; Y255-F312 HydrophobicContact CD2-CE2 4.21Å; Y255-F312 AromaticContact CD2-CG 3.64Å; Y255-F312 HydrophobicContact CD2-CG 3.64Å; Y255-F312 HydrophobicContact CE2-CB 4.05Å; Y255-F312 AromaticContact CE2-CD2 2.99Å; Y255-F312 HydrophobicContact CE2-CD2 2.99Å; Y255-F312 AromaticContact CE2-CE2 3.62Å; Y255-F312 HydrophobicContact CE2-CE2 3.62Å; Y255-F312 AromaticContact CE2-CG 3.73Å; Y255-F312 HydrophobicContact CE2-CG 3.73Å; Y255-F312 HydrophobicContact CG-CB 4.41Å; Y255-F312 HydrophobicContact CG-CD2 4.12Å; Y255-F312 AromaticContact CZ-CD2 3.85Å; Y255-F312 VanDerWaalsContact O-CD2 3.24Å; Y255-F312 WeakPolarHBondContact O-CD2 3.41Å
256	I	38.2	Very low	64.6	Low	15 Å²	15	24.3 Å²	24.3	8%	0.077	12%	0.117	C	C	.	.			trans	-148	147.9	-178.1	-72.7	101	0	0	0	115.9	L160 C246 F250 V259 V260 F312	L160-I256 HydrophobicContact CD2-CG1 4.47Å; C246-I256 VanDerWaalsContact CA-CD1 3.42Å; C246-I256 HydrophobicContact CB-CB 4.21Å; C246-I256 HydrophobicContact CB-CD1 4.06Å; C246-I256 HydrophobicContact CB-CG1 3.71Å; C246-I256 HydrophobicContact CB-CG2 3.67Å; C246-I256 WeakPolarHBondContact O-CD1 3.43Å; C246-I256 VanDerWaalsContact SG-CG2 3.59Å; F250-I256 HydrophobicContact CB-CD1 4.07Å; F250-I256 VanDerWaalsContact N-CD1 3.28Å; I256-V259 HydrophobicContact CG2-CB 4.38Å; I256-V260 HydrophobicContact CG2-CG2 4.01Å; I256-F312 VanDerWaalsContact CA-CB 3.45Å; I256-F312 VanDerWaalsContact CA-CG 3.4Å; I256-F312 WeakPolarHBondContact O-CB 3.28Å
257	T	42.5	Very low	64.8	Low	19 Å²	19	24.1 Å²	24.1	12%	0.117	12%	0.116	C	C	.	.			trans	-62.8	173.9	179.2	8.3	0	0	0	0	114.5	N167 V259 F312	N167-T257 HydrophobicContact CB-CG2 4.07Å; N167-T257 VanDerWaalsContact CG-CG2 3.42Å; N167-T257 WeakPolarHBondContact ND2-CG2 3.26Å; N167-T257 WeakPolarHBondContact OD1-CG2 3.44Å; T257-V259 HydrophobicContact CG2-CG2 4.49Å; T257-V259 PolarHBondContact O-N 2.98Å; T257-V259 WeakPolarHBondContact OG1-CG2 3.5Å; T257-F312 VanDerWaalsContact CB-CE1 3.49Å; T257-F312 HydrophobicContact CG2-CD1 3.17Å; T257-F312 HydrophobicContact CG2-CE1 3.3Å; T257-F312 HydrophobicContact CG2-CG 4.41Å; T257-F312 WeakPolarHBondContact OG1-CD1 3.2Å; T257-F312 WeakPolarHBondContact OG1-CE1 3.27Å
258	P	47.8	Very low	64.8	Low	12 Å²	12	24.2 Å²	24.2	8%	0.078	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	4.9	159	17.2	-30.1	0	0	0	116.7	V260 G261 F262 V318 L320 V326 P328	P258-V260 PolarHBondContact O-N 3.24Å; P258-V260 VanDerWaalsContact O-N 3.11Å; P258-G261 PolarHBondContact O-N 3.24Å; P258-F262 PolarHBondContact O-N 3.36Å; P258-F262 VanDerWaalsContact O-N 3.13Å; P258-V318 HydrophobicContact CB-CG2 4.3Å; P258-V318 HydrophobicContact CG-CG2 4.06Å; P258-L320 HydrophobicContact CG-CD1 4.44Å; P258-V326 HydrophobicContact CB-CG1 4.42Å; P258-V326 HydrophobicContact CG-CG1 4.43Å; P258-P328 HydrophobicContact CB-CB 4.41Å; P258-P328 HydrophobicContact CB-CG 4.27Å
259	V	57.3	Low	64.5	Low	1 Å²	1	22.3 Å²	22.3	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-49.5	-35.6	172.2	171.8	0	0	0	0	111.7	G163 N167 V242 I256 T257 G263	G163-V259 WeakPolarHBondContact O-CG2 3.43Å; N167-V259 HydrophobicContact CB-CG2 3.77Å; V242-V259 HydrophobicContact CG1-CG1 4.23Å; I256-V259 HydrophobicContact CG2-CB 4.38Å; T257-V259 HydrophobicContact CG2-CG2 4.49Å; T257-V259 PolarHBondContact O-N 2.98Å; T257-V259 WeakPolarHBondContact OG1-CG2 3.5Å; V259-G263 WeakPolarHBondContact O-CA 3.49Å; V259-G263 PolarHBondContact O-N 3.35Å
260	V	60.2	Low	64.3	Low	11 Å²	11	25.9 Å²	25.9	7%	0.067	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-49.2	178.2	180	0	0	0	0	110.4	V243 C246 I256 P258 I264 L288 L292	V243-V260 HydrophobicContact CG1-CG1 4.22Å; C246-V260 HydrophobicContact CB-CG2 4.06Å; I256-V260 HydrophobicContact CG2-CG2 4.01Å; P258-V260 PolarHBondContact O-N 3.24Å; P258-V260 VanDerWaalsContact O-N 3.11Å; V260-I264 HydrophobicContact CG1-CD1 3.63Å; V260-I264 VanDerWaalsContact O-CB 3.26Å; V260-I264 WeakPolarHBondContact O-CB 3.32Å; V260-I264 WeakPolarHBondContact O-CD1 3.26Å; V260-I264 WeakPolarHBondContact O-CG1 3.46Å; V260-I264 PolarHBondContact O-N 2.59Å; V260-L288 HydrophobicContact CG1-CD2 3.67Å; V260-L292 HydrophobicContact CG1-CD2 4.49Å
261	G	59.5	Low	64.3	Low	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-52.2	-179.4	0	0	0	0	0	112.9	P258 I264 C265	P258-G261 PolarHBondContact O-N 3.24Å; G261-I264 PolarHBondContact O-N 3.48Å; G261-C265 PolarHBondContact O-N 3.1Å
262	F	68.1	Low	64.4	Low	3 Å²	3	24.9 Å²	24.9	1%	0.013	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-39.1	-179.1	-164.6	-105.5	0	0	0	112	I166 F169 A170 K222 L225 P258 C265 L266 F331	I166-F262 HydrophobicContact CG2-CD1 3.63Å; I166-F262 HydrophobicContact CG2-CE1 4.41Å; F169-F262 HydrophobicContact CB-CE1 4.46Å; A170-F262 HydrophobicContact CB-CB 4.25Å; A170-F262 HydrophobicContact CB-CD1 3.85Å; A170-F262 HydrophobicContact CB-CD2 3.77Å; A170-F262 HydrophobicContact CB-CE1 4.05Å; A170-F262 HydrophobicContact CB-CE2 3.97Å; A170-F262 HydrophobicContact CB-CG 3.71Å; A170-F262 HydrophobicContact CB-CZ 4.09Å; K222-F262 HydrophobicContact CB-CE2 4.25Å; K222-F262 HydrophobicContact CB-CZ 3.88Å; K222-F262 HydrophobicContact CD-CE2 3.8Å; K222-F262 HydrophobicContact CD-CZ 4.18Å; K222-F262 HydrophobicContact CG-CE2 3.85Å; K222-F262 HydrophobicContact CG-CZ 3.69Å; L225-F262 HydrophobicContact CD2-CE1 4.47Å; P258-F262 PolarHBondContact O-N 3.36Å; P258-F262 VanDerWaalsContact O-N 3.13Å; F262-C265 WeakPolarHBondContact O-CB 3.48Å; F262-C265 PolarHBondContact O-N 3.03Å; F262-C265 VanDerWaalsContact O-N 3.15Å; F262-L266 HydrophobicContact CD1-CD1 3.96Å; F262-L266 HydrophobicContact CD1-CG 4.33Å; F262-L266 HydrophobicContact CE1-CD1 3.94Å; F262-L266 HydrophobicContact CE1-CD2 4.44Å; F262-L266 HydrophobicContact CE1-CG 4.29Å; F262-L266 WeakPolarHBondContact O-CG 3.15Å; F262-L266 PolarHBondContact O-N 2.94Å; F262-F331 HydrophobicContact CB-CD2 4.34Å; F262-F331 HydrophobicContact CB-CG 4.43Å; F262-F331 AromaticContact CD2-CD1 3.69Å; F262-F331 HydrophobicContact CD2-CD1 3.69Å; F262-F331 AromaticContact CD2-CE1 3.77Å; F262-F331 HydrophobicContact CD2-CE1 3.77Å; F262-F331 HydrophobicContact CD2-CG 4.14Å; F262-F331 HydrophobicContact CD2-CZ 4.27Å; F262-F331 HydrophobicContact CE2-CD1 4.38Å; F262-F331 HydrophobicContact CE2-CE1 4.28Å
263	G	71.2	Confident	65	Low	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-42	174.6	0	0	0	0	0	112.5	V259 C265 L266 I267	V259-G263 WeakPolarHBondContact O-CA 3.49Å; V259-G263 PolarHBondContact O-N 3.35Å; G263-C265 VanDerWaalsContact C-N 3.33Å; G263-C265 PolarHBondContact O-N 2.82Å; G263-L266 PolarHBondContact O-N 3.29Å; G263-I267 VanDerWaalsContact O-CG1 3.32Å; G263-I267 WeakPolarHBondContact O-CG1 3.37Å; G263-I267 PolarHBondContact O-N 3.49Å
264	I	75.6	Confident	65.9	Low	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.1	-41.7	171.9	-70.8	163.2	0	0	0	110.8	V243 V260 G261 L266 I267 D268 L274 L288 I332 W343	V243-I264 HydrophobicContact CG1-CG1 4.45Å; V260-I264 HydrophobicContact CG1-CD1 3.63Å; V260-I264 VanDerWaalsContact O-CB 3.26Å; V260-I264 WeakPolarHBondContact O-CB 3.32Å; V260-I264 WeakPolarHBondContact O-CD1 3.26Å; V260-I264 WeakPolarHBondContact O-CG1 3.46Å; V260-I264 PolarHBondContact O-N 2.59Å; G261-I264 PolarHBondContact O-N 3.48Å; I264-L266 PolarHBondContact O-N 3.05Å; I264-I267 PolarHBondContact O-N 3.01Å; I264-I267 VanDerWaalsContact O-N 3.15Å; I264-D268 WeakPolarHBondContact O-CB 3.5Å; I264-D268 PolarHBondContact O-N 2.69Å; I264-L274 HydrophobicContact CG2-CD1 4.23Å; I264-L274 HydrophobicContact CG2-CD2 3.68Å; I264-L288 HydrophobicContact CD1-CD1 3.75Å; I264-L288 HydrophobicContact CD1-CD2 4.01Å; I264-L288 HydrophobicContact CD1-CG 4.32Å; I264-L288 HydrophobicContact CG1-CD1 4.4Å; I264-I332 HydrophobicContact CB-CD1 4.22Å; I264-I332 HydrophobicContact CB-CG1 4.29Å; I264-I332 HydrophobicContact CD1-CD1 3.81Å; I264-I332 HydrophobicContact CG2-CD1 3.97Å; I264-I332 HydrophobicContact CG2-CG1 4.02Å; I264-W343 HydrophobicContact CD1-CH2 4.49Å
265	C	77.7	Confident	67	Low	3 Å²	3	16 Å²	16	2%	0.02	10%	0.103	C	C	.	.	H	α-helix	trans	-63.8	-25	176.5	-167.9	0	0	0	0	113.6	R226 G261 F262 G263 F331	R226-C265 PolarHBondContact NH2-O 3.14Å; R226-C265 PolarHBondContact NH2-SG 3.14Å; R226-C265 VanDerWaalsContact NH2-SG 3.35Å; G261-C265 PolarHBondContact O-N 3.1Å; F262-C265 WeakPolarHBondContact O-CB 3.48Å; F262-C265 PolarHBondContact O-N 3.03Å; F262-C265 VanDerWaalsContact O-N 3.15Å; G263-C265 VanDerWaalsContact C-N 3.33Å; G263-C265 PolarHBondContact O-N 2.82Å; C265-F331 HydrophobicContact CB-CB 4.22Å; C265-F331 PolarHBondContact SG-O 2.9Å
266	L	80	Confident	68.1	Low	2 Å²	2	19.2 Å²	19.2	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-82.2	-33.3	172.9	-66.6	174.3	0	0	0	112.4	I166 L225 R226 L229 Y235 L239 F262 G263 I264	I166-L266 HydrophobicContact CG2-CD1 4.01Å; L225-L266 HydrophobicContact CD2-CD1 3.83Å; L225-L266 HydrophobicContact CD2-CD2 4.28Å; L225-L266 HydrophobicContact CG-CD2 4.48Å; R226-L266 HydrophobicContact CB-CD2 4.24Å; L229-L266 HydrophobicContact CD1-CD1 4.31Å; Y235-L266 PolarHBondContact OH-O 2.99Å; L239-L266 HydrophobicContact CD1-CB 4.13Å; F262-L266 HydrophobicContact CD1-CD1 3.96Å; F262-L266 HydrophobicContact CD1-CG 4.33Å; F262-L266 HydrophobicContact CE1-CD1 3.94Å; F262-L266 HydrophobicContact CE1-CD2 4.44Å; F262-L266 HydrophobicContact CE1-CG 4.29Å; F262-L266 WeakPolarHBondContact O-CG 3.15Å; F262-L266 PolarHBondContact O-N 2.94Å; G263-L266 PolarHBondContact O-N 3.29Å; I264-L266 PolarHBondContact O-N 3.05Å
267	I	80.4	Confident	70.1	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-71.4	-46.6	175.2	-68.7	166.4	0	0	0	110.9	E236 L239 V243 G263 I264 D269 N273 L277 L283	E236-I267 HydrophobicContact CB-CG2 4.37Å; L239-I267 HydrophobicContact CB-CD1 3.78Å; L239-I267 HydrophobicContact CB-CG1 3.61Å; L239-I267 HydrophobicContact CD1-CG1 4.07Å; V243-I267 HydrophobicContact CG2-CD1 4.1Å; G263-I267 VanDerWaalsContact O-CG1 3.32Å; G263-I267 WeakPolarHBondContact O-CG1 3.37Å; G263-I267 PolarHBondContact O-N 3.49Å; I264-I267 PolarHBondContact O-N 3.01Å; I264-I267 VanDerWaalsContact O-N 3.15Å; I267-D269 PolarHBondContact O-N 2.73Å; I267-D269 VanDerWaalsContact O-N 3.09Å; I267-N273 HydrophobicContact CG2-CB 4.44Å; I267-N273 WeakPolarHBondContact O-CB 2.96Å; I267-L277 HydrophobicContact CG2-CD1 3.59Å; I267-L283 HydrophobicContact CD1-CD1 4.19Å
268	D	76.5	Confident	71.9	Confident	9 Å²	9	20.4 Å²	20.4	5%	0.048	12%	0.123	C	C	.	.			trans	-86.7	81.2	-170.2	-154.5	31.2	0	0	0	111.7	I264 L274	I264-D268 WeakPolarHBondContact O-CB 3.5Å; I264-D268 PolarHBondContact O-N 2.69Å; D268-L274 HydrophobicContact CB-CB 3.86Å; D268-L274 HydrophobicContact CB-CD2 4.46Å; D268-L274 VanDerWaalsContact CG-CB 3.48Å; D268-L274 WeakPolarHBondContact OD1-CB 3.49Å; D268-L274 PolarHBondContact OD1-N 3.17Å
269	D	72.8	Confident	73.4	Confident	14 Å²	14	27.4 Å²	27.4	8%	0.075	15%	0.154	C	C	.	.			trans	-86.9	-174.9	175.3	69.7	5.3	0	0	0	112.8	Q230 I267 T271 G272 N273 A337	Q230-D269 VanDerWaalsContact NE2-CB 3.33Å; I267-D269 PolarHBondContact O-N 2.73Å; I267-D269 VanDerWaalsContact O-N 3.09Å; D269-T271 PolarHBondContact O-N 2.72Å; D269-T271 WeakPolarHBondContact OD1-CA 3.13Å; D269-T271 WeakPolarHBondContact OD1-CB 3.49Å; D269-T271 PolarHBondContact OD1-N 3.19Å; D269-T271 PolarHBondContact OD1-OG1 2.92Å; D269-G272 PolarHBondContact O-N 2.66Å; D269-N273 PolarHBondContact OD1-ND2 3.44Å; D269-N273 PolarHBondContact OD2-ND2 3.23Å; D269-A337 WeakPolarHBondContact O-CB 3.13Å
270	S	67	Low	74.4	Confident	90 Å²	90	33.5 Å²	33.5	63%	0.629	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.2	177.7	54.4	0	0	0	0	114.4
271	T	69	Low	75.1	Confident	71 Å²	71	42.2 Å²	42.2	44%	0.436	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-2	179.8	78.9	0	0	0	0	113.8	D269 N273 K276	D269-T271 PolarHBondContact O-N 2.72Å; D269-T271 WeakPolarHBondContact OD1-CA 3.13Å; D269-T271 WeakPolarHBondContact OD1-CB 3.49Å; D269-T271 PolarHBondContact OD1-N 3.19Å; D269-T271 PolarHBondContact OD1-OG1 2.92Å; T271-N273 PolarHBondContact OG1-ND2 2.84Å; T271-N273 PolarHBondContact OG1-OD1 3.43Å; T271-K276 VanDerWaalsContact O-CE 3.29Å; T271-K276 WeakPolarHBondContact O-CE 3.46Å; T271-K276 PolarHBondContact O-NZ 3.34Å; T271-K276 PolarHBondContact OG1-NZ 3.41Å
272	G	72	Confident	75.7	Confident	18 Å²	18	46.1 Å²	46.1	19%	0.186	23%	0.232	C	C	.	.			trans	67.3	37.9	177	0	0	0	0	0	113.6	D269 L274 A275 K276	D269-G272 PolarHBondContact O-N 2.66Å; G272-L274 PolarHBondContact O-N 2.52Å; G272-A275 PolarHBondContact O-N 3.33Å; G272-A275 VanDerWaalsContact O-N 3.14Å; G272-K276 PolarHBondContact O-N 3.1Å
273	N	79.2	Confident	76.1	Confident	19 Å²	19	46.4 Å²	46.4	10%	0.102	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-30.4	-176.1	-75.8	-29.3	0	0	0	113.5	E236 I267 D269 T271 A275 K276 L277	E236-N273 HydrophobicContact CG-CB 4.46Å; I267-N273 HydrophobicContact CG2-CB 4.44Å; I267-N273 WeakPolarHBondContact O-CB 2.96Å; D269-N273 PolarHBondContact OD1-ND2 3.44Å; D269-N273 PolarHBondContact OD2-ND2 3.23Å; T271-N273 PolarHBondContact OG1-ND2 2.84Å; T271-N273 PolarHBondContact OG1-OD1 3.43Å; N273-A275 VanDerWaalsContact C-N 3.33Å; N273-A275 PolarHBondContact O-N 3.43Å; N273-K276 PolarHBondContact O-N 3.36Å; N273-K276 PolarHBondContact OD1-NZ 3.05Å; N273-K276 VanDerWaalsContact OD1-NZ 3.17Å; N273-L277 WeakPolarHBondContact O-CG 3.33Å; N273-L277 PolarHBondContact O-N 3.01Å
274	L	78.2	Confident	76.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-41.7	177.2	-173	68.1	0	0	0	111.9	I264 D268 G272 K276 L277 D278 L283 I285 W343	I264-L274 HydrophobicContact CG2-CD1 4.23Å; I264-L274 HydrophobicContact CG2-CD2 3.68Å; D268-L274 HydrophobicContact CB-CB 3.86Å; D268-L274 HydrophobicContact CB-CD2 4.46Å; D268-L274 VanDerWaalsContact CG-CB 3.48Å; D268-L274 WeakPolarHBondContact OD1-CB 3.49Å; D268-L274 PolarHBondContact OD1-N 3.17Å; G272-L274 PolarHBondContact O-N 2.52Å; L274-K276 VanDerWaalsContact C-N 3.33Å; L274-K276 PolarHBondContact O-N 3.04Å; L274-L277 PolarHBondContact O-N 3.3Å; L274-D278 WeakPolarHBondContact O-CB 3.34Å; L274-D278 PolarHBondContact O-N 2.65Å; L274-L283 HydrophobicContact CD1-CD1 4.13Å; L274-I285 HydrophobicContact CD2-CD1 4.35Å; L274-I285 HydrophobicContact CD2-CG1 4.23Å; L274-I285 HydrophobicContact CG-CD1 4.2Å; L274-I285 HydrophobicContact CG-CG1 4.12Å; L274-W343 HydrophobicContact CD2-CZ2 3.89Å
275	A	75.8	Confident	76.8	Confident	22 Å²	22	49 Å²	49	18%	0.182	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-35.8	177.3	0	0	0	0	0	112	G272 N273 D278 Q279	G272-A275 PolarHBondContact O-N 3.33Å; G272-A275 VanDerWaalsContact O-N 3.14Å; N273-A275 VanDerWaalsContact C-N 3.33Å; N273-A275 PolarHBondContact O-N 3.43Å; A275-D278 PolarHBondContact O-N 2.96Å; A275-Q279 WeakPolarHBondContact O-CG 3.23Å; A275-Q279 PolarHBondContact O-N 3.41Å
276	K	81	Confident	76.9	Confident	93 Å²	93	52.6 Å²	52.6	40%	0.404	28%	0.276	S	S	.	.	H	α-helix	trans	-66.4	-42.4	174.4	-62	175.5	-165.3	153.2	0	111.3	T271 G272 N273 L274 D278 Q279 K280	T271-K276 VanDerWaalsContact O-CE 3.29Å; T271-K276 WeakPolarHBondContact O-CE 3.46Å; T271-K276 PolarHBondContact O-NZ 3.34Å; T271-K276 PolarHBondContact OG1-NZ 3.41Å; G272-K276 PolarHBondContact O-N 3.1Å; N273-K276 PolarHBondContact O-N 3.36Å; N273-K276 PolarHBondContact OD1-NZ 3.05Å; N273-K276 VanDerWaalsContact OD1-NZ 3.17Å; L274-K276 VanDerWaalsContact C-N 3.33Å; L274-K276 PolarHBondContact O-N 3.04Å; K276-D278 VanDerWaalsContact C-N 3.31Å; K276-Q279 PolarHBondContact O-N 3.04Å; K276-K280 WeakPolarHBondContact O-CG 3.46Å; K276-K280 PolarHBondContact O-N 3.25Å
277	L	79.3	Confident	76.9	Confident	2 Å²	2	57 Å²	57	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-33.1	177.7	-71.7	166.2	0	0	0	112.2	E236 E237 A240 I267 N273 L274 K280 K281 R282 L283	E236-L277 HydrophobicContact CB-CD1 4.39Å; E236-L277 HydrophobicContact CG-CD1 4.39Å; E237-L277 HydrophobicContact CG-CD2 4.46Å; A240-L277 HydrophobicContact CB-CD1 4.15Å; A240-L277 HydrophobicContact CB-CD2 4.4Å; I267-L277 HydrophobicContact CG2-CD1 3.59Å; N273-L277 WeakPolarHBondContact O-CG 3.33Å; N273-L277 PolarHBondContact O-N 3.01Å; L274-L277 PolarHBondContact O-N 3.3Å; L277-K280 PolarHBondContact O-N 3.24Å; L277-K281 PolarHBondContact O-N 3Å; L277-R282 HydrophobicContact CD2-CB 4.31Å; L277-R282 PolarHBondContact O-N 2.79Å; L277-L283 HydrophobicContact CB-CB 4.48Å; L277-L283 HydrophobicContact CB-CD1 4.4Å; L277-L283 HydrophobicContact CD1-CD1 4.17Å; L277-L283 PolarHBondContact O-N 3.1Å
278	D	80.5	Confident	76.8	Confident	56 Å²	56	57.1 Å²	57.1	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-47.9	171.5	-168.1	57.6	0	0	0	111.7	L274 A275 K276 K280 K281 L283 S284 I285	L274-D278 WeakPolarHBondContact O-CB 3.34Å; L274-D278 PolarHBondContact O-N 2.65Å; A275-D278 PolarHBondContact O-N 2.96Å; K276-D278 VanDerWaalsContact C-N 3.31Å; D278-K280 VanDerWaalsContact C-N 3.31Å; D278-K280 PolarHBondContact O-N 2.78Å; D278-K281 WeakPolarHBondContact O-CA 3.29Å; D278-K281 PolarHBondContact O-N 3.11Å; D278-L283 VanDerWaalsContact CA-O 3.32Å; D278-L283 WeakPolarHBondContact CA-O 3.1Å; D278-S284 VanDerWaalsContact OD1-CA 3.23Å; D278-S284 WeakPolarHBondContact OD1-CA 3.45Å; D278-I285 HydrophobicContact CB-CD1 3.78Å; D278-I285 HydrophobicContact CB-CG1 3.91Å; D278-I285 PolarHBondContact OD1-N 2.86Å
279	Q	79.8	Confident	76.8	Confident	159 Å²	159	56.9 Å²	56.9	74%	0.743	29%	0.292	S	S	*	.	H	α-helix	trans	-61.2	-37.9	174.7	-72	174.4	9	0	0	112.6	A275 K276 K281	A275-Q279 WeakPolarHBondContact O-CG 3.23Å; A275-Q279 PolarHBondContact O-N 3.41Å; K276-Q279 PolarHBondContact O-N 3.04Å; Q279-K281 PolarHBondContact O-N 3.48Å
280	K	77.9	Confident	77	Confident	129 Å²	129	63.7 Å²	63.7	56%	0.561	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-0.9	173.5	-69.9	-178	-170.6	-180	0	113.6	E237 K276 L277 D278 R282	E237-K280 IonicContact OE1-NZ 3.36Å; E237-K280 PolarHBondContact OE1-NZ 3.13Å; K276-K280 WeakPolarHBondContact O-CG 3.46Å; K276-K280 PolarHBondContact O-N 3.25Å; L277-K280 PolarHBondContact O-N 3.24Å; D278-K280 VanDerWaalsContact C-N 3.31Å; D278-K280 PolarHBondContact O-N 2.78Å; K280-R282 HydrophobicContact CB-CG 4.46Å; K280-R282 PolarHBondContact O-N 2.78Å; K280-R282 VanDerWaalsContact O-N 3.16Å
281	K	74.8	Confident	77.2	Confident	194 Å²	194	60.3 Å²	60.3	84%	0.843	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	24.7	-175.3	-58.8	-176	177.4	-179.7	0	114.3	L277 D278 Q279	L277-K281 PolarHBondContact O-N 3Å; D278-K281 WeakPolarHBondContact O-CA 3.29Å; D278-K281 PolarHBondContact O-N 3.11Å; Q279-K281 PolarHBondContact O-N 3.48Å
282	R	72.4	Confident	77.4	Confident	82 Å²	82	57.8 Å²	57.8	31%	0.309	28%	0.275	S	S	.	.	S	Bend	trans	-82.7	-37.7	174.1	-74.7	-157.9	79.7	170.5	-0	111.9	E237 D241 L277 K280	E237-R282 WeakPolarHBondContact OE2-CD 3.3Å; E237-R282 IonicContact OE2-CZ 3.42Å; E237-R282 IonicContact OE2-NE 3.05Å; E237-R282 PolarHBondContact OE2-NE 3.37Å; E237-R282 IonicContact OE2-NH1 2.69Å; E237-R282 PolarHBondContact OE2-NH1 2.84Å; D241-R282 IonicContact OD1-CZ 2.92Å; D241-R282 IonicContact OD1-NH2 3.71Å; D241-R282 PolarHBondContact OD1-NH2 2.57Å; D241-R282 IonicContact OD2-CZ 3.88Å; D241-R282 IonicContact OD2-NH2 2.86Å; D241-R282 PolarHBondContact OD2-NH2 3.42Å; L277-R282 HydrophobicContact CD2-CB 4.31Å; L277-R282 PolarHBondContact O-N 2.79Å; K280-R282 HydrophobicContact CB-CG 4.46Å; K280-R282 PolarHBondContact O-N 2.78Å; K280-R282 VanDerWaalsContact O-N 3.16Å
283	L	77.2	Confident	77.3	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.052	27%	0.27	C	S	.	.	S	Bend	trans	-121	158.6	168.5	-74.8	166.7	0	0	0	108.4	A240 V243 I267 L274 L277 D278	A240-L283 HydrophobicContact CB-CD1 3.57Å; A240-L283 HydrophobicContact CB-CG 3.92Å; V243-L283 HydrophobicContact CB-CD2 4.12Å; V243-L283 HydrophobicContact CG1-CD2 3.77Å; I267-L283 HydrophobicContact CD1-CD1 4.19Å; L274-L283 HydrophobicContact CD1-CD1 4.13Å; L277-L283 HydrophobicContact CB-CB 4.48Å; L277-L283 HydrophobicContact CB-CD1 4.4Å; L277-L283 HydrophobicContact CD1-CD1 4.17Å; L277-L283 PolarHBondContact O-N 3.1Å; D278-L283 VanDerWaalsContact CA-O 3.32Å; D278-L283 WeakPolarHBondContact CA-O 3.1Å
284	S	82.2	Confident	76.3	Confident	44 Å²	44	58 Å²	58	31%	0.308	27%	0.274	S	S	.	.			trans	-127	110.7	176.4	172.2	0	0	0	0	109.2	D278 S286 R287 L288	D278-S284 VanDerWaalsContact OD1-CA 3.23Å; D278-S284 WeakPolarHBondContact OD1-CA 3.45Å; S284-S286 VanDerWaalsContact C-N 3.26Å; S284-S286 PolarHBondContact O-N 3.38Å; S284-S286 PolarHBondContact OG-OG 3.4Å; S284-S286 VanDerWaalsContact OG-OG 3.14Å; S284-R287 PolarHBondContact O-N 3Å; S284-R287 VanDerWaalsContact O-N 3.16Å; S284-R287 PolarHBondContact OG-N 3.16Å; S284-L288 VanDerWaalsContact O-CG 3.3Å; S284-L288 WeakPolarHBondContact O-CG 3.38Å; S284-L288 PolarHBondContact O-N 3.25Å
285	I	79.6	Confident	74.9	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.056	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-40	-179.4	-65.8	171.1	0	0	0	110.1	L274 D278 R287 L288 D289 K342 W343	L274-I285 HydrophobicContact CD2-CD1 4.35Å; L274-I285 HydrophobicContact CD2-CG1 4.23Å; L274-I285 HydrophobicContact CG-CD1 4.2Å; L274-I285 HydrophobicContact CG-CG1 4.12Å; D278-I285 HydrophobicContact CB-CD1 3.78Å; D278-I285 HydrophobicContact CB-CG1 3.91Å; D278-I285 PolarHBondContact OD1-N 2.86Å; I285-R287 PolarHBondContact O-N 3.34Å; I285-L288 PolarHBondContact O-N 3.45Å; I285-D289 WeakPolarHBondContact O-CB 3.25Å; I285-D289 PolarHBondContact O-N 2.83Å; I285-K342 HydrophobicContact CD1-CD 4.47Å; I285-K342 HydrophobicContact CG2-CB 4.34Å; I285-W343 HydrophobicContact CG2-CD2 4.27Å; I285-W343 HydrophobicContact CG2-CE3 4.48Å; I285-W343 HydrophobicContact CG2-CH2 4.11Å; I285-W343 HydrophobicContact CG2-CZ2 3.88Å; I285-W343 HydrophobicContact CG2-CZ3 4.4Å
286	S	80.4	Confident	73.6	Confident	77 Å²	77	69.6 Å²	69.6	54%	0.538	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-33.3	177.5	61.8	0	0	0	0	113.7	S284 R290	S284-S286 VanDerWaalsContact C-N 3.26Å; S284-S286 PolarHBondContact O-N 3.38Å; S284-S286 PolarHBondContact OG-OG 3.4Å; S284-S286 VanDerWaalsContact OG-OG 3.14Å; S286-R290 PolarHBondContact O-N 3.28Å
287	R	79.2	Confident	71.4	Confident	95 Å²	95	74.9 Å²	74.9	36%	0.358	34%	0.341	S	S	.	.	H	α-helix	trans	-70	-41.2	172.6	-169.6	175.4	177.8	-167.8	-1.2	110.8	V247 D251 S284 I285 R290 I291	V247-R287 HydrophobicContact CG1-CG 4.17Å; V247-R287 VanDerWaalsContact CG1-CZ 3.5Å; V247-R287 VanDerWaalsContact CG1-NE 3.33Å; D251-R287 IonicContact OD2-CZ 3.5Å; D251-R287 IonicContact OD2-NE 3.99Å; D251-R287 PolarHBondContact OD2-NE 3.08Å; D251-R287 IonicContact OD2-NH2 3.52Å; D251-R287 PolarHBondContact OD2-NH2 2.93Å; S284-R287 PolarHBondContact O-N 3Å; S284-R287 VanDerWaalsContact O-N 3.16Å; S284-R287 PolarHBondContact OG-N 3.16Å; I285-R287 PolarHBondContact O-N 3.34Å; R287-R290 PolarHBondContact O-N 3.24Å; R287-I291 HydrophobicContact CG-CD1 4.19Å; R287-I291 WeakPolarHBondContact O-CG1 3.26Å; R287-I291 PolarHBondContact O-N 3.13Å; R287-I291 VanDerWaalsContact O-N 3.15Å
288	L	78.5	Confident	69.2	Low	2 Å²	2	77.5 Å²	77.5	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-64.7	-45	176.9	-68.7	168.4	0	0	0	112.1	V243 V247 V260 I264 S284 I285 R290 I291 L292 W343	V243-L288 HydrophobicContact CG1-CD2 4.14Å; V247-L288 HydrophobicContact CG2-CD2 3.49Å; V247-L288 VanDerWaalsContact CG2-CD2 3.49Å; V260-L288 HydrophobicContact CG1-CD2 3.67Å; I264-L288 HydrophobicContact CD1-CD1 3.75Å; I264-L288 HydrophobicContact CD1-CD2 4.01Å; I264-L288 HydrophobicContact CD1-CG 4.32Å; I264-L288 HydrophobicContact CG1-CD1 4.4Å; S284-L288 VanDerWaalsContact O-CG 3.3Å; S284-L288 WeakPolarHBondContact O-CG 3.38Å; S284-L288 PolarHBondContact O-N 3.25Å; I285-L288 PolarHBondContact O-N 3.45Å; L288-R290 VanDerWaalsContact C-N 3.26Å; L288-R290 PolarHBondContact O-N 3.31Å; L288-I291 PolarHBondContact O-N 2.98Å; L288-I291 VanDerWaalsContact O-N 3.11Å; L288-L292 WeakPolarHBondContact O-CG 3.2Å; L288-L292 PolarHBondContact O-N 2.73Å; L288-W343 HydrophobicContact CB-CH2 3.86Å; L288-W343 HydrophobicContact CB-CZ3 3.87Å; L288-W343 HydrophobicContact CD1-CH2 4.49Å
289	D	76.5	Confident	66.8	Low	4 Å²	4	78.3 Å²	78.3	2%	0.021	39%	0.389	C	S	.	.	H	α-helix	trans	-59.4	-39.9	178.6	-170.9	33.4	0	0	0	111.2	I285 K293 W343 P344 Q345 S346	I285-D289 WeakPolarHBondContact O-CB 3.25Å; I285-D289 PolarHBondContact O-N 2.83Å; D289-K293 WeakPolarHBondContact O-CB 3.04Å; D289-K293 PolarHBondContact O-N 3.2Å; D289-W343 HydrophobicContact CB-CE3 3.57Å; D289-W343 HydrophobicContact CB-CZ3 3.94Å; D289-P344 VanDerWaalsContact OD2-CD 3.26Å; D289-P344 WeakPolarHBondContact OD2-CD 3.23Å; D289-Q345 WeakPolarHBondContact OD2-CB 3.24Å; D289-Q345 WeakPolarHBondContact OD2-CG 3.35Å; D289-Q345 PolarHBondContact OD2-N 3.37Å; D289-S346 PolarHBondContact O-OG 2.94Å; D289-S346 VanDerWaalsContact O-OG 3.06Å; D289-S346 WeakPolarHBondContact OD1-CB 3.33Å; D289-S346 PolarHBondContact OD1-N 3.37Å; D289-S346 PolarHBondContact OD1-OG 2.96Å
290	R	77	Confident	64.4	Low	157 Å²	157	79.6 Å²	79.6	59%	0.592	39%	0.393	S	S	*	.	H	α-helix	trans	-66.2	-40.2	175.6	-167	-172.1	-55.4	168.1	3	112.7	S286 R287 L288 A294	S286-R290 PolarHBondContact O-N 3.28Å; R287-R290 PolarHBondContact O-N 3.24Å; L288-R290 VanDerWaalsContact C-N 3.26Å; L288-R290 PolarHBondContact O-N 3.31Å; R290-A294 WeakPolarHBondContact O-CA 3.45Å; R290-A294 VanDerWaalsContact O-CB 3.32Å; R290-A294 WeakPolarHBondContact O-CB 3.44Å; R290-A294 PolarHBondContact O-N 3.16Å
291	I	71.7	Confident	62.1	Low	19 Å²	19	79.4 Å²	79.4	10%	0.097	41%	0.406	C	S	.	.	H	α-helix	trans	-70.7	-42.4	-178.9	-70.7	168.9	0	0	0	110.6	V247 F250 R287 L288 A294	V247-I291 HydrophobicContact CB-CD1 4.22Å; V247-I291 HydrophobicContact CG1-CD1 3.56Å; V247-I291 HydrophobicContact CG2-CD1 4.02Å; F250-I291 HydrophobicContact CD1-CD1 4.05Å; F250-I291 HydrophobicContact CD1-CG1 3.88Å; F250-I291 HydrophobicContact CD1-CG2 3.91Å; F250-I291 HydrophobicContact CD2-CG2 4.29Å; F250-I291 HydrophobicContact CE1-CB 4.33Å; F250-I291 HydrophobicContact CE1-CG1 3.88Å; F250-I291 HydrophobicContact CE1-CG2 3.87Å; F250-I291 HydrophobicContact CE2-CG2 4.24Å; F250-I291 HydrophobicContact CG-CG2 4.13Å; F250-I291 HydrophobicContact CZ-CG2 4.04Å; R287-I291 HydrophobicContact CG-CD1 4.19Å; R287-I291 WeakPolarHBondContact O-CG1 3.26Å; R287-I291 PolarHBondContact O-N 3.13Å; R287-I291 VanDerWaalsContact O-N 3.15Å; L288-I291 PolarHBondContact O-N 2.98Å; L288-I291 VanDerWaalsContact O-N 3.11Å; I291-A294 WeakPolarHBondContact O-CB 3.17Å; I291-A294 PolarHBondContact O-N 3.18Å
292	L	71.7	Confident	60.5	Low	19 Å²	19	72.8 Å²	72.8	10%	0.099	38%	0.377	C	S	.	.	H	α-helix	trans	-70.9	-33.7	-179.1	-69.2	170.4	0	0	0	112.7	V260 L288 P328 F329 I332 W343	V260-L292 HydrophobicContact CG1-CD2 4.49Å; L288-L292 WeakPolarHBondContact O-CG 3.2Å; L288-L292 PolarHBondContact O-N 2.73Å; L292-P328 HydrophobicContact CD2-CB 3.92Å; L292-F329 HydrophobicContact CD1-CD2 4.22Å; L292-I332 HydrophobicContact CD1-CD1 3.37Å; L292-W343 HydrophobicContact CD1-CH2 4.37Å; L292-W343 HydrophobicContact CD1-CZ3 3.85Å
293	K	70.3	Confident	58.8	Low	17 Å²	17	72.6 Å²	72.6	7%	0.074	39%	0.387	C	S	.	.	H	α-helix	trans	-88.7	-18.7	175	-165.4	49.8	161.5	177.5	0	114.3	D289 R295 E316 Q345 V348 S350	D289-K293 WeakPolarHBondContact O-CB 3.04Å; D289-K293 PolarHBondContact O-N 3.2Å; K293-R295 PolarHBondContact O-N 3Å; K293-E316 IonicContact NZ-OE1 3Å; K293-E316 PolarHBondContact NZ-OE1 2.9Å; K293-E316 IonicContact NZ-OE2 3.58Å; K293-E316 PolarHBondContact NZ-OE2 3.29Å; K293-E316 VanDerWaalsContact NZ-OE2 3.11Å; K293-Q345 HydrophobicContact CB-CB 3.81Å; K293-Q345 VanDerWaalsContact CE-O 3.26Å; K293-Q345 WeakPolarHBondContact CE-O 3.32Å; K293-Q345 HydrophobicContact CG-CB 3.88Å; K293-Q345 WeakPolarHBondContact CG-O 3.27Å; K293-V348 WeakPolarHBondContact CE-O 3.39Å; K293-V348 PolarHBondContact NZ-O 3.5Å; K293-S350 PolarHBondContact NZ-OG 2.8Å
294	A	58	Low	56.9	Low	23 Å²	23	77.9 Å²	77.9	19%	0.19	41%	0.409	C	S	.	.			trans	-21.7	92.7	-162.1	0	0	0	0	0	113.3	R290 I291 H315	R290-A294 WeakPolarHBondContact O-CA 3.45Å; R290-A294 VanDerWaalsContact O-CB 3.32Å; R290-A294 WeakPolarHBondContact O-CB 3.44Å; R290-A294 PolarHBondContact O-N 3.16Å; I291-A294 WeakPolarHBondContact O-CB 3.17Å; I291-A294 PolarHBondContact O-N 3.18Å; A294-H315 PolarHBondContact O-CE1 2.8Å; A294-H315 PolarHBondContact O-ND1 2.74Å
295	R	50.2	Low	54.8	Low	169 Å²	169	76.5 Å²	76.5	64%	0.638	40%	0.402	S	S	*	.			trans	-93.7	113.8	175.2	-138.4	-177.6	-174	-179.4	1	105.3	K293 K297	K293-R295 PolarHBondContact O-N 3Å; R295-K297 PolarHBondContact O-N 2.82Å
296	E	47.8	Very low	53.3	Low	99 Å²	99	77.9 Å²	77.9	46%	0.463	41%	0.406	S	S	.	.			trans	-71.3	107.4	176.5	-131.9	-163.3	-175.8	0	0	109.6	G298 F302 R360	E296-G298 PolarHBondContact O-N 3.28Å; E296-G298 VanDerWaalsContact O-N 3.08Å; E296-F302 HydrophobicContact CG-CZ 4.33Å; E296-F302 WeakPolarHBondContact OE1-CE1 3.41Å; E296-F302 WeakPolarHBondContact OE1-CE2 3.34Å; E296-F302 WeakPolarHBondContact OE1-CZ 3.35Å; E296-F302 WeakPolarHBondContact OE2-CE2 3.41Å; E296-F302 WeakPolarHBondContact OE2-CZ 3.4Å; E296-R360 IonicContact OE2-CZ 2.74Å; E296-R360 IonicContact OE2-NH2 3.26Å; E296-R360 PolarHBondContact OE2-NH2 3.36Å
297	K	35.2	Very low	51.3	Low	205 Å²	205	74.2 Å²	74.2	89%	0.891	38%	0.381	S	S	*	.			trans	-76.7	90.7	170.1	-78.4	-173.3	175	-177.9	0	108.7	R295	R295-K297 PolarHBondContact O-N 2.82Å
298	G	32.5	Very low	49.5	Very low	57 Å²	57	71.4 Å²	71.4	59%	0.588	37%	0.372	S	S	*	.	S	Bend	trans	79.6	109.6	152.8	0	0	0	0	0	117.3	E296 K300	E296-G298 PolarHBondContact O-N 3.28Å; E296-G298 VanDerWaalsContact O-N 3.08Å; G298-K300 VanDerWaalsContact C-N 3.27Å; G298-K300 PolarHBondContact O-N 2.68Å
299	G	30	Very low	47.6	Very low	72 Å²	72	72.3 Å²	72.3	74%	0.742	38%	0.378	S	S	*	.				56.2	5.2	123.3	0	0	0	0	0	121.6
300	K	28.3	Very low	45.6	Very low	187 Å²	187	75.4 Å²	75.4	81%	0.813	39%	0.391	S	S	*	.			trans	-115.4	105.2	177.7	-74.8	-170.8	177.3	-178	0	111.4	G298	G298-K300 VanDerWaalsContact C-N 3.27Å; G298-K300 PolarHBondContact O-N 2.68Å
301	C	30.3	Very low	43.7	Very low	124 Å²	124	73.1 Å²	73.1	84%	0.838	39%	0.386	S	S	*	.			trans	18.3	107.5	164.9	-65.6	0	0	0	0	116	P303	C301-P303 WeakPolarHBondContact O-CD 3.23Å
302	F	40.9	Very low	42.2	Very low	55 Å²	55	73.3 Å²	73.3	24%	0.241	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-66.1	123.6	163.1	-82.7	-102.2	0	0	0	109.8	E296 K304 R360	E296-F302 HydrophobicContact CG-CZ 4.33Å; E296-F302 WeakPolarHBondContact OE1-CE1 3.41Å; E296-F302 WeakPolarHBondContact OE1-CE2 3.34Å; E296-F302 WeakPolarHBondContact OE1-CZ 3.35Å; E296-F302 WeakPolarHBondContact OE2-CE2 3.41Å; E296-F302 WeakPolarHBondContact OE2-CZ 3.4Å; F302-K304 PolarHBondContact O-N 3.08Å; F302-R360 VanDerWaalsContact CD2-NH1 3.26Å; F302-R360 VanDerWaalsContact CE2-CZ 3.41Å
303	P	37	Very low	40.8	Very low	79 Å²	79	74.3 Å²	74.3	51%	0.513	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-62.4	132.4	166.2	-13.6	20.9	0	0	0	110.9	R253 C301	R253-P303 VanDerWaalsContact NH1-CB 3.29Å; R253-P303 PolarHBondContact NH1-O 2.74Å; R253-P303 VanDerWaalsContact NH2-CD 3.26Å; C301-P303 WeakPolarHBondContact O-CD 3.23Å
304	K	37.6	Very low	39.8	Very low	121 Å²	121	75.8 Å²	75.8	53%	0.526	40%	0.397	S	S	.	.	S	Bend	trans	-54.1	131.1	176.3	-63.7	168	176.3	179	0	110.1	F302	F302-K304 PolarHBondContact O-N 3.08Å
305	G	39.1	Very low	39.9	Very low	14 Å²	14	76.7 Å²	76.7	14%	0.144	40%	0.397	C	S	.	.			trans	164.8	14.5	-176.3	0	0	0	0	0	121.7	Q408	G305-Q408 VanDerWaalsContact C-CD 3.4Å
306	R	46.9	Very low	40.7	Very low	40 Å²	40	69.8 Å²	69.8	15%	0.151	37%	0.372	C	S	.	.			trans	-101.4	69.7	-170.4	-67.6	-170.5	-170.6	-176.4	-7.5	115.8	H308 Q408 S411 S412	R306-H308 PolarHBondContact O-N 3.19Å; R306-H308 VanDerWaalsContact O-N 3.16Å; R306-Q408 VanDerWaalsContact N-CG 3.3Å; R306-Q408 VanDerWaalsContact O-CA 3.24Å; R306-Q408 WeakPolarHBondContact O-CA 3.17Å; R306-S411 WeakPolarHBondContact O-CB 3.49Å; R306-S411 PolarHBondContact O-OG 3.04Å; R306-S412 WeakPolarHBondContact CD-OG 3.33Å; R306-S412 PolarHBondContact NH1-OG 3.07Å
307	L	39.5	Very low	42.1	Very low	1 Å²	1	65.3 Å²	65.3	1%	0.005	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.2	-171.1	-158.1	90.2	0	0	0	113.2	L404 L407 Q408 F604 P607	L307-L404 HydrophobicContact CB-CD1 4.26Å; L307-L404 HydrophobicContact CD1-CB 4.27Å; L307-L404 HydrophobicContact CD1-CD1 3.33Å; L307-L404 HydrophobicContact CD1-CG 3.78Å; L307-L404 WeakPolarHBondContact CD1-O 3.12Å; L307-L404 HydrophobicContact CD2-CD1 3.49Å; L307-L404 VanDerWaalsContact CD2-CD1 3.49Å; L307-L404 HydrophobicContact CG-CD1 3.88Å; L307-L407 HydrophobicContact CD1-CB 3.18Å; L307-L407 HydrophobicContact CD1-CD1 3.89Å; L307-L407 HydrophobicContact CD1-CG 4.18Å; L307-L407 HydrophobicContact CD2-CD1 4.32Å; L307-L407 HydrophobicContact CG-CB 3.9Å; L307-L407 HydrophobicContact CG-CD1 4.26Å; L307-Q408 HydrophobicContact CB-CG 3.75Å; L307-Q408 HydrophobicContact CD1-CG 3.64Å; L307-Q408 HydrophobicContact CG-CG 4.35Å; L307-Q408 VanDerWaalsContact N-CG 3.31Å; L307-F604 HydrophobicContact CB-CD1 3.76Å; L307-F604 HydrophobicContact CB-CE1 3.94Å; L307-F604 HydrophobicContact CD2-CB 4.22Å; L307-F604 HydrophobicContact CD2-CD1 3.95Å; L307-F604 HydrophobicContact CG-CD1 4.48Å; L307-P607 HydrophobicContact CD2-CB 3.42Å; L307-P607 VanDerWaalsContact CD2-CB 3.42Å; L307-P607 HydrophobicContact CD2-CG 4.09Å
308	H	39.6	Very low	43.9	Very low	36 Å²	36	55.8 Å²	55.8	17%	0.167	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135	12.4	-148.6	-144.7	-160	0	0	0	108.6	Y255 R306 F310 F614	Y255-H308 HydrophobicContact CD1-CB 3.44Å; Y255-H308 VanDerWaalsContact CD1-CB 3.44Å; Y255-H308 AromaticContact CD1-CG 3.98Å; Y255-H308 VanDerWaalsContact CD1-O 3.29Å; Y255-H308 WeakPolarHBondContact CD1-O 3.46Å; Y255-H308 WeakPolarHBondContact CD2-O 3.31Å; Y255-H308 HydrophobicContact CE1-CB 2.94Å; Y255-H308 AromaticContact CE1-CD2 3.93Å; Y255-H308 AromaticContact CE1-CE1 3.92Å; Y255-H308 AromaticContact CE1-CG 2.96Å; Y255-H308 AromaticContact CE1-ND1 3.04Å; Y255-H308 WeakPolarHBondContact CE1-ND1 3.18Å; Y255-H308 WeakPolarHBondContact CE1-O 3.45Å; Y255-H308 WeakPolarHBondContact CE2-O 3.45Å; Y255-H308 AromaticContact CZ-CD2 3.75Å; Y255-H308 AromaticContact CZ-CE1 3.9Å; Y255-H308 AromaticContact CZ-CG 3.25Å; Y255-H308 AromaticContact CZ-ND1 3.44Å; Y255-H308 PolarHBondContact OH-CD2 2.84Å; Y255-H308 PolarHBondContact OH-CE1 3.42Å; Y255-H308 PolarHBondContact OH-ND1 3.44Å; Y255-H308 PolarHBondContact OH-NE2 3.09Å; Y255-H308 PolarHBondContact OH-O 3.43Å; Y255-H308 VanDerWaalsContact OH-O 3.14Å; R306-H308 PolarHBondContact O-N 3.19Å; R306-H308 VanDerWaalsContact O-N 3.16Å; H308-F310 PolarHBondContact O-N 3.25Å; H308-F614 AromaticContact CD2-CE1 3.75Å; H308-F614 AromaticContact NE2-CE1 3.92Å
309	C	39.6	Very low	46	Very low	20 Å²	20	54.5 Å²	54.5	14%	0.135	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	1	178.6	-46	0	0	0	0	116.2	F311 F312 S411 S415	C309-F311 VanDerWaalsContact C-N 3.31Å; C309-F311 PolarHBondContact O-N 2.87Å; C309-F312 PolarHBondContact O-N 3.05Å; C309-S411 WeakPolarHBondContact CA-OG 3.43Å; C309-S411 WeakPolarHBondContact CB-OG 3.26Å; C309-S411 PolarHBondContact N-OG 3.48Å; C309-S411 PolarHBondContact SG-OG 2.97Å; C309-S415 WeakPolarHBondContact CB-OG 3.24Å; C309-S415 PolarHBondContact SG-OG 3.44Å
310	F	35.3	Very low	48.5	Very low	70 Å²	70	51.8 Å²	51.8	31%	0.307	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.1	-178.9	-148.7	-116.4	0	0	0	115.7	H308 A617 D620	H308-F310 PolarHBondContact O-N 3.25Å; F310-A617 HydrophobicContact CB-CB 4.07Å; F310-A617 HydrophobicContact CD1-CB 3.29Å; F310-A617 VanDerWaalsContact CD2-CA 3.49Å; F310-A617 HydrophobicContact CD2-CB 3.59Å; F310-A617 WeakPolarHBondContact CD2-O 3.33Å; F310-A617 HydrophobicContact CE1-CB 3.47Å; F310-A617 VanDerWaalsContact CE1-CB 3.47Å; F310-A617 HydrophobicContact CE2-CB 3.87Å; F310-A617 WeakPolarHBondContact CE2-O 3.46Å; F310-A617 HydrophobicContact CG-CB 3.33Å; F310-A617 HydrophobicContact CZ-CB 3.77Å; F310-D620 HydrophobicContact CE2-CB 3.61Å; F310-D620 HydrophobicContact CZ-CB 3.62Å
311	F	36.3	Very low	51.2	Low	109 Å²	109	44.1 Å²	44.1	48%	0.478	23%	0.227	S	C	.	.	S	Bend	trans	-92.6	-26.3	174.5	-71.3	-85.3	0	0	0	113.2	Y255 C309	Y255-F311 HydrophobicContact CE2-CB 3.67Å; C309-F311 VanDerWaalsContact C-N 3.31Å; C309-F311 PolarHBondContact O-N 2.87Å
312	F	39.3	Very low	53.9	Low	22 Å²	22	38.5 Å²	38.5	10%	0.096	19%	0.19	C	C	.	.			trans	-154.9	126	-164.4	-35.6	-68.3	0	0	0	117.3	K164 Y255 I256 T257 C309	K164-F312 HydrophobicContact CG-CZ 4.43Å; Y255-F312 HydrophobicContact CD2-CB 3.45Å; Y255-F312 VanDerWaalsContact CD2-CB 3.45Å; Y255-F312 AromaticContact CD2-CD2 3.17Å; Y255-F312 HydrophobicContact CD2-CD2 3.17Å; Y255-F312 HydrophobicContact CD2-CE2 4.21Å; Y255-F312 AromaticContact CD2-CG 3.64Å; Y255-F312 HydrophobicContact CD2-CG 3.64Å; Y255-F312 HydrophobicContact CE2-CB 4.05Å; Y255-F312 AromaticContact CE2-CD2 2.99Å; Y255-F312 HydrophobicContact CE2-CD2 2.99Å; Y255-F312 AromaticContact CE2-CE2 3.62Å; Y255-F312 HydrophobicContact CE2-CE2 3.62Å; Y255-F312 AromaticContact CE2-CG 3.73Å; Y255-F312 HydrophobicContact CE2-CG 3.73Å; Y255-F312 HydrophobicContact CG-CB 4.41Å; Y255-F312 HydrophobicContact CG-CD2 4.12Å; Y255-F312 AromaticContact CZ-CD2 3.85Å; Y255-F312 VanDerWaalsContact O-CD2 3.24Å; Y255-F312 WeakPolarHBondContact O-CD2 3.41Å; I256-F312 VanDerWaalsContact CA-CB 3.45Å; I256-F312 VanDerWaalsContact CA-CG 3.4Å; I256-F312 WeakPolarHBondContact O-CB 3.28Å; T257-F312 VanDerWaalsContact CB-CE1 3.49Å; T257-F312 HydrophobicContact CG2-CD1 3.17Å; T257-F312 HydrophobicContact CG2-CE1 3.3Å; T257-F312 HydrophobicContact CG2-CG 4.41Å; T257-F312 WeakPolarHBondContact OG1-CD1 3.2Å; T257-F312 WeakPolarHBondContact OG1-CE1 3.27Å; C309-F312 PolarHBondContact O-N 3.05Å
313	Q	43.6	Very low	56.3	Low	41 Å²	41	35.9 Å²	35.9	19%	0.192	18%	0.179	C	C	.	.			trans	-96.5	149.1	-172.8	-63.5	-171.8	9.8	0	0	113.3	V318 E419	Q313-V318 HydrophobicContact CB-CB 4.26Å; Q313-V318 HydrophobicContact CB-CG1 3.85Å; Q313-E419 HydrophobicContact CB-CG 4.18Å
314	Q	48.7	Very low	58.7	Low	48 Å²	48	32.6 Å²	32.6	22%	0.224	16%	0.157	C	C	.	.			trans	-86.7	151.8	178.1	-57.8	-168.3	-66.3	0	0	109.1	F250 E419	F250-Q314 HydrophobicContact CE2-CB 4.49Å; F250-Q314 HydrophobicContact CE2-CG 4.01Å; Q314-E419 PolarHBondContact N-OE1 3.41Å
315	H	59.7	Low	61	Low	42 Å²	42	27.6 Å²	27.6	19%	0.194	14%	0.135	C	C	.	.	S	Bend	trans	95.5	178	163.3	-50.1	-66.1	0	0	0	118.5	A294 V317 E419	A294-H315 PolarHBondContact O-CE1 2.8Å; A294-H315 PolarHBondContact O-ND1 2.74Å; H315-V317 PolarHBondContact O-N 2.88Å; H315-V317 VanDerWaalsContact O-N 3.09Å; H315-E419 IonicContact CD2-OE2 2.8Å
316	E	68	Low	63	Low	23 Å²	23	27.7 Å²	27.7	11%	0.107	13%	0.133	C	C	.	.	S	Bend	trans	-53.1	-29.5	-167.1	-174.4	165.4	-165.5	0	0	113.7	K293 M327 P328 S350	K293-E316 IonicContact NZ-OE1 3Å; K293-E316 PolarHBondContact NZ-OE1 2.9Å; K293-E316 IonicContact NZ-OE2 3.58Å; K293-E316 PolarHBondContact NZ-OE2 3.29Å; K293-E316 VanDerWaalsContact NZ-OE2 3.11Å; E316-M327 VanDerWaalsContact O-CA 3.32Å; E316-M327 WeakPolarHBondContact O-CA 3.38Å; E316-M327 WeakPolarHBondContact O-CG 3.35Å; E316-P328 WeakPolarHBondContact O-CD 3.29Å; E316-S350 PolarHBondContact OE1-N 3.49Å; E316-S350 PolarHBondContact OE1-OG 3.28Å; E316-S350 VanDerWaalsContact OE2-CB 3.23Å; E316-S350 WeakPolarHBondContact OE2-CB 3.43Å; E316-S350 PolarHBondContact OE2-OG 3.3Å
317	V	75.9	Confident	64.6	Low	5 Å²	5	28.8 Å²	28.8	3%	0.03	14%	0.141	C	C	.	.			trans	-129.9	132.8	179.1	-178.7	0	0	0	0	109.3	H315 Q325 M327 A422 W423 L426	H315-V317 PolarHBondContact O-N 2.88Å; H315-V317 VanDerWaalsContact O-N 3.09Å; V317-Q325 HydrophobicContact CG1-CB 3.91Å; V317-M327 HydrophobicContact CG2-CG 3.97Å; V317-A422 HydrophobicContact CG1-CB 4.08Å; V317-A422 WeakPolarHBondContact CG1-O 3.4Å; V317-W423 HydrophobicContact CG2-CG 4.5Å; V317-L426 HydrophobicContact CB-CD1 4.22Å; V317-L426 HydrophobicContact CG1-CD1 3.37Å; V317-L426 HydrophobicContact CG1-CG 4Å; V317-L426 HydrophobicContact CG2-CD1 3.84Å
318	V	72.8	Confident	66.4	Low	5 Å²	5	29.2 Å²	29.2	3%	0.03	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.4	175.9	-61.2	0	0	0	0	110.9	P258 Q313 L320 V326 P328	P258-V318 HydrophobicContact CB-CG2 4.3Å; P258-V318 HydrophobicContact CG-CG2 4.06Å; Q313-V318 HydrophobicContact CB-CB 4.26Å; Q313-V318 HydrophobicContact CB-CG1 3.85Å; V318-L320 PolarHBondContact O-N 3.44Å; V318-V326 HydrophobicContact CG2-CG1 3.74Å; V318-V326 PolarHBondContact N-O 3.5Å; V318-V326 PolarHBondContact O-N 3.44Å; V318-P328 HydrophobicContact CG2-CG 3.81Å
319	P	77.2	Confident	68.4	Low	31 Å²	31	28.3 Å²	28.3	20%	0.201	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	125	167.8	-22	32.5	0	0	0	110.1	Q325 V418 A422	P319-Q325 VanDerWaalsContact CG-OE1 3.3Å; P319-Q325 VanDerWaalsContact N-OE1 3.14Å; P319-V418 HydrophobicContact CG-CG1 3.76Å; P319-A422 HydrophobicContact CG-CB 4.11Å
320	L	82.1	Confident	70.4	Confident	15 Å²	15	28.3 Å²	28.3	8%	0.079	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-51.3	173.5	-176.7	57.4	0	0	0	109.9	V171 E174 P258 V318 M324 V326	V171-L320 HydrophobicContact CB-CD1 4.48Å; V171-L320 HydrophobicContact CG2-CD1 3.5Å; V171-L320 HydrophobicContact CG2-CG 4.09Å; E174-L320 HydrophobicContact CB-CD2 3.72Å; E174-L320 HydrophobicContact CG-CD2 3.86Å; P258-L320 HydrophobicContact CG-CD1 4.44Å; V318-L320 PolarHBondContact O-N 3.44Å; L320-M324 HydrophobicContact CB-CE 3.91Å; L320-M324 HydrophobicContact CB-CG 4.5Å; L320-M324 HydrophobicContact CD2-CE 3.4Å; L320-M324 VanDerWaalsContact CD2-CE 3.4Å; L320-M324 HydrophobicContact CD2-SD 3.8Å; L320-M324 HydrophobicContact CG-CE 3.61Å; L320-M324 HydrophobicContact CG-SD 4.5Å; L320-M324 PolarHBondContact N-O 3.28Å; L320-V326 HydrophobicContact CB-CB 4.04Å; L320-V326 HydrophobicContact CB-CG1 3.84Å; L320-V326 HydrophobicContact CD1-CG1 4.2Å; L320-V326 HydrophobicContact CD2-CB 4.11Å; L320-V326 HydrophobicContact CD2-CG1 4.32Å; L320-V326 HydrophobicContact CD2-CG2 4.48Å; L320-V326 HydrophobicContact CG-CG1 4.36Å
321	F	86.1	Confident	72.5	Confident	25 Å²	25	25.2 Å²	25.2	11%	0.11	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	127	173.7	-161.8	-83.5	0	0	0	110.2	A81 V82 Y85 V171 L175 M324 F685	A81-F321 HydrophobicContact CB-CD2 4.07Å; A81-F321 HydrophobicContact CB-CE2 3.64Å; A81-F321 HydrophobicContact CB-CZ 4.05Å; V82-F321 HydrophobicContact CB-CZ 4.48Å; V82-F321 HydrophobicContact CG2-CZ 3.82Å; Y85-F321 VanDerWaalsContact CB-CE1 3.42Å; Y85-F321 HydrophobicContact CD1-CD1 4.05Å; Y85-F321 AromaticContact CD1-CE1 3.78Å; Y85-F321 HydrophobicContact CD1-CE1 3.78Å; Y85-F321 AromaticContact CD2-CD1 3.8Å; Y85-F321 HydrophobicContact CD2-CD1 3.8Å; Y85-F321 HydrophobicContact CD2-CE1 4.32Å; Y85-F321 AromaticContact CG-CD1 3.52Å; Y85-F321 HydrophobicContact CG-CD1 3.52Å; Y85-F321 AromaticContact CG-CE1 3.58Å; Y85-F321 HydrophobicContact CG-CE1 3.58Å; V171-F321 HydrophobicContact CG1-CB 4.14Å; V171-F321 HydrophobicContact CG1-CD2 3.81Å; V171-F321 HydrophobicContact CG1-CG 4.25Å; L175-F321 HydrophobicContact CD1-CB 4.26Å; L175-F321 HydrophobicContact CD1-CD1 4.23Å; L175-F321 HydrophobicContact CD1-CD2 4.42Å; L175-F321 HydrophobicContact CD1-CG 4.04Å; L175-F321 HydrophobicContact CD2-CB 4.32Å; L175-F321 HydrophobicContact CD2-CD1 4.32Å; F321-M324 HydrophobicContact CB-CE 4.22Å; F321-M324 PolarHBondContact N-O 2.9Å; F321-M324 VanDerWaalsContact O-CB 3.3Å; F321-M324 WeakPolarHBondContact O-CB 3.31Å; F321-M324 PolarHBondContact O-N 2.87Å; F321-F685 AromaticContact CE1-CE1 3.88Å; F321-F685 HydrophobicContact CE1-CE1 3.88Å; F321-F685 HydrophobicContact CE1-CZ 4.4Å; F321-F685 HydrophobicContact CZ-CE1 4.01Å
322	G	86.4	Confident	74.6	Confident	6 Å²	6	20.1 Å²	20.1	6%	0.062	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	-138.8	-177.3	0	0	0	0	0	112.2	M324	G322-M324 VanDerWaalsContact C-N 3.28Å
323	D	90.7	Very high	76.6	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-6.5	167.7	61.7	-43.5	0	0	0	114.1	Y85 Q325 L425 F626 R627 E628 F629 Y630	Y85-D323 WeakPolarHBondContact CE2-OD1 3.37Å; Y85-D323 VanDerWaalsContact CZ-OD1 3.25Å; Y85-D323 PolarHBondContact OH-N 3.45Å; Y85-D323 PolarHBondContact OH-OD1 3.37Å; D323-Q325 PolarHBondContact O-N 3.46Å; D323-Q325 PolarHBondContact O-NE2 2.9Å; D323-L425 HydrophobicContact CB-CD1 4.23Å; D323-F626 WeakPolarHBondContact CB-O 3.34Å; D323-R627 WeakPolarHBondContact OD2-CA 3.42Å; D323-E628 PolarHBondContact OD1-N 3.31Å; D323-F629 WeakPolarHBondContact OD1-CB 3.47Å; D323-F629 PolarHBondContact OD1-N 3.22Å; D323-F629 WeakPolarHBondContact OD2-CA 3.27Å; D323-F629 VanDerWaalsContact OD2-CB 3.29Å; D323-F629 WeakPolarHBondContact OD2-CB 3.35Å; D323-F629 PolarHBondContact OD2-N 3.03Å; D323-Y630 HydrophobicContact CB-CD2 4.41Å; D323-Y630 VanDerWaalsContact OD2-CD2 3.25Å; D323-Y630 WeakPolarHBondContact OD2-CD2 3.32Å; D323-Y630 PolarHBondContact OD2-N 3.17Å
324	M	88.4	Confident	78.3	Confident	11 Å²	11	27.7 Å²	27.7	5%	0.054	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.6	172	-178.6	-171.5	38.7	0	0	110	E174 L175 M178 L320 F321 G322 F629	E174-M324 HydrophobicContact CB-CE 4.14Å; E174-M324 HydrophobicContact CB-SD 4Å; L175-M324 HydrophobicContact CD2-CE 3.9Å; L175-M324 HydrophobicContact CG-CE 3.94Å; M178-M324 HydrophobicContact CE-CB 3.65Å; M178-M324 HydrophobicContact CE-CE 3.32Å; M178-M324 HydrophobicContact CE-CG 3.61Å; M178-M324 HydrophobicContact CE-SD 2.95Å; M178-M324 WeakPolarHBondContact CE-SD 3.4Å; L320-M324 HydrophobicContact CB-CE 3.91Å; L320-M324 HydrophobicContact CB-CG 4.5Å; L320-M324 HydrophobicContact CD2-CE 3.4Å; L320-M324 VanDerWaalsContact CD2-CE 3.4Å; L320-M324 HydrophobicContact CD2-SD 3.8Å; L320-M324 HydrophobicContact CG-CE 3.61Å; L320-M324 HydrophobicContact CG-SD 4.5Å; L320-M324 PolarHBondContact N-O 3.28Å; F321-M324 HydrophobicContact CB-CE 4.22Å; F321-M324 PolarHBondContact N-O 2.9Å; F321-M324 VanDerWaalsContact O-CB 3.3Å; F321-M324 WeakPolarHBondContact O-CB 3.31Å; F321-M324 PolarHBondContact O-N 2.87Å; G322-M324 VanDerWaalsContact C-N 3.28Å; M324-F629 HydrophobicContact CB-CB 4.24Å; M324-F629 HydrophobicContact CB-CD2 4.35Å; M324-F629 HydrophobicContact CB-CG 4.22Å; M324-F629 HydrophobicContact CG-CD2 4.41Å
325	Q	86.5	Confident	79.7	Confident	15 Å²	15	25.9 Å²	25.9	7%	0.07	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	154.9	175.4	-47	-51.3	-47.1	0	0	110.6	V317 P319 D323 A422 L425 L426	V317-Q325 HydrophobicContact CG1-CB 3.91Å; P319-Q325 VanDerWaalsContact CG-OE1 3.3Å; P319-Q325 VanDerWaalsContact N-OE1 3.14Å; D323-Q325 PolarHBondContact O-N 3.46Å; D323-Q325 PolarHBondContact O-NE2 2.9Å; Q325-A422 HydrophobicContact CG-CB 4.27Å; Q325-L425 HydrophobicContact CG-CB 3.97Å; Q325-L425 HydrophobicContact CG-CD1 4.08Å; Q325-L426 HydrophobicContact CB-CD1 3.82Å; Q325-L426 HydrophobicContact CB-CD2 3.95Å; Q325-L426 HydrophobicContact CB-CG 3.61Å; Q325-L426 HydrophobicContact CG-CG 4.27Å
326	V	80.9	Confident	80.3	Confident	17 Å²	17	30.4 Å²	30.4	10%	0.103	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.1	174.2	72.4	0	0	0	0	110.9	P258 V318 L320 P328 F331	P258-V326 HydrophobicContact CB-CG1 4.42Å; P258-V326 HydrophobicContact CG-CG1 4.43Å; V318-V326 HydrophobicContact CG2-CG1 3.74Å; V318-V326 PolarHBondContact N-O 3.5Å; V318-V326 PolarHBondContact O-N 3.44Å; L320-V326 HydrophobicContact CB-CB 4.04Å; L320-V326 HydrophobicContact CB-CG1 3.84Å; L320-V326 HydrophobicContact CD1-CG1 4.2Å; L320-V326 HydrophobicContact CD2-CB 4.11Å; L320-V326 HydrophobicContact CD2-CG1 4.32Å; L320-V326 HydrophobicContact CD2-CG2 4.48Å; L320-V326 HydrophobicContact CG-CG1 4.36Å; V326-P328 WeakPolarHBondContact O-CD 3.23Å; V326-F331 HydrophobicContact CG1-CE2 4.42Å; V326-F331 HydrophobicContact CG2-CD2 4.4Å; V326-F331 HydrophobicContact CG2-CE2 3.53Å; V326-F331 HydrophobicContact CG2-CZ 3.69Å
327	M	80.7	Confident	80.8	Confident	62 Å²	62	30.9 Å²	30.9	31%	0.305	15%	0.154	S	C	.	.			trans	-90.1	112.3	164.4	-70.4	-175.9	-84.6	0	0	108.4	E316 V317 F329 A330 L426	E316-M327 VanDerWaalsContact O-CA 3.32Å; E316-M327 WeakPolarHBondContact O-CA 3.38Å; E316-M327 WeakPolarHBondContact O-CG 3.35Å; V317-M327 HydrophobicContact CG2-CG 3.97Å; M327-F329 PolarHBondContact O-N 3.31Å; M327-F329 VanDerWaalsContact O-N 3.1Å; M327-A330 HydrophobicContact CB-CB 4.07Å; M327-A330 WeakPolarHBondContact O-CB 3.33Å; M327-A330 PolarHBondContact O-N 3.47Å; M327-L426 HydrophobicContact CG-CD1 3.98Å
328	P	77.2	Confident	81.1	Confident	11 Å²	11	33.2 Å²	33.2	7%	0.071	16%	0.164	C	C	.	.	H	α-helix	trans	-56.2	-32.9	-178.4	-26.5	35.5	0	0	0	113	P258 L292 E316 V318 V326 A330 F331	P258-P328 HydrophobicContact CB-CB 4.41Å; P258-P328 HydrophobicContact CB-CG 4.27Å; L292-P328 HydrophobicContact CD2-CB 3.92Å; E316-P328 WeakPolarHBondContact O-CD 3.29Å; V318-P328 HydrophobicContact CG2-CG 3.81Å; V326-P328 WeakPolarHBondContact O-CD 3.23Å; P328-A330 VanDerWaalsContact C-N 3.26Å; P328-A330 PolarHBondContact O-N 2.93Å; P328-F331 PolarHBondContact O-N 3.46Å
329	F	80.2	Confident	81.5	Confident	17 Å²	17	35.9 Å²	35.9	8%	0.075	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-23.1	175.8	-170.1	-114.3	0	0	0	113.5	L292 M327 F331 I332 K333 F338 W343 S346 N347	L292-F329 HydrophobicContact CD1-CD2 4.22Å; M327-F329 PolarHBondContact O-N 3.31Å; M327-F329 VanDerWaalsContact O-N 3.1Å; F329-F331 PolarHBondContact O-N 2.85Å; F329-I332 HydrophobicContact CD2-CB 4.15Å; F329-I332 HydrophobicContact CD2-CD1 4.17Å; F329-I332 HydrophobicContact CE2-CB 4.27Å; F329-I332 HydrophobicContact CE2-CG2 4.23Å; F329-I332 PolarHBondContact O-N 3.36Å; F329-K333 HydrophobicContact CD1-CD 4.04Å; F329-K333 HydrophobicContact CD1-CG 3.8Å; F329-K333 HydrophobicContact CE1-CD 3.96Å; F329-K333 HydrophobicContact CE1-CG 3.53Å; F329-K333 HydrophobicContact CZ-CG 4.22Å; F329-K333 PolarHBondContact O-N 3.01Å; F329-F338 HydrophobicContact CE2-CE2 4.44Å; F329-F338 AromaticContact CZ-CE2 3.8Å; F329-F338 HydrophobicContact CZ-CE2 3.8Å; F329-F338 HydrophobicContact CZ-CZ 4.17Å; F329-W343 HydrophobicContact CD2-CE3 4.49Å; F329-W343 HydrophobicContact CE2-CB 3.87Å; F329-W343 AromaticContact CE2-CD2 3.75Å; F329-W343 HydrophobicContact CE2-CD2 3.75Å; F329-W343 AromaticContact CE2-CE3 3.8Å; F329-W343 HydrophobicContact CE2-CE3 3.8Å; F329-W343 AromaticContact CE2-CG 3.78Å; F329-W343 HydrophobicContact CE2-CG 3.78Å; F329-W343 HydrophobicContact CZ-CB 3.68Å; F329-W343 HydrophobicContact CZ-CD2 4.43Å; F329-W343 AromaticContact CZ-CG 3.97Å; F329-W343 HydrophobicContact CZ-CG 3.97Å; F329-S346 VanDerWaalsContact CD1-O 3.3Å; F329-S346 WeakPolarHBondContact CD1-O 3.29Å; F329-S346 VanDerWaalsContact CD2-CB 3.41Å; F329-S346 WeakPolarHBondContact CE1-O 3.38Å; F329-S346 VanDerWaalsContact CE2-CB 3.43Å; F329-N347 HydrophobicContact CE1-CB 4.21Å; F329-N347 HydrophobicContact CZ-CB 4.33Å
330	A	82.3	Confident	81.8	Confident	20 Å²	20	37.4 Å²	37.4	17%	0.165	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-31.7	176	0	0	0	0	0	112.1	M327 P328 I332 K333 R334	M327-A330 HydrophobicContact CB-CB 4.07Å; M327-A330 WeakPolarHBondContact O-CB 3.33Å; M327-A330 PolarHBondContact O-N 3.47Å; P328-A330 VanDerWaalsContact C-N 3.26Å; P328-A330 PolarHBondContact O-N 2.93Å; A330-I332 VanDerWaalsContact C-N 3.3Å; A330-I332 PolarHBondContact O-N 2.94Å; A330-K333 PolarHBondContact O-N 3.12Å; A330-R334 VanDerWaalsContact O-CG 3.23Å; A330-R334 WeakPolarHBondContact O-CG 3.48Å; A330-R334 PolarHBondContact O-N 2.87Å; A330-R334 VanDerWaalsContact O-N 3.16Å
331	F	79.8	Confident	81.9	Confident	5 Å²	5	40.6 Å²	40.6	2%	0.022	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-36.6	173.1	-65.5	-62.1	0	0	0	112.2	E174 F262 C265 V326 P328 F329 R334 S335	E174-F331 HydrophobicContact CG-CE1 4.37Å; E174-F331 HydrophobicContact CG-CZ 4.38Å; E174-F331 WeakPolarHBondContact OE1-CE1 3.35Å; F262-F331 HydrophobicContact CB-CD2 4.34Å; F262-F331 HydrophobicContact CB-CG 4.43Å; F262-F331 AromaticContact CD2-CD1 3.69Å; F262-F331 HydrophobicContact CD2-CD1 3.69Å; F262-F331 AromaticContact CD2-CE1 3.77Å; F262-F331 HydrophobicContact CD2-CE1 3.77Å; F262-F331 HydrophobicContact CD2-CG 4.14Å; F262-F331 HydrophobicContact CD2-CZ 4.27Å; F262-F331 HydrophobicContact CE2-CD1 4.38Å; F262-F331 HydrophobicContact CE2-CE1 4.28Å; C265-F331 HydrophobicContact CB-CB 4.22Å; C265-F331 PolarHBondContact SG-O 2.9Å; V326-F331 HydrophobicContact CG1-CE2 4.42Å; V326-F331 HydrophobicContact CG2-CD2 4.4Å; V326-F331 HydrophobicContact CG2-CE2 3.53Å; V326-F331 HydrophobicContact CG2-CZ 3.69Å; P328-F331 PolarHBondContact O-N 3.46Å; F329-F331 PolarHBondContact O-N 2.85Å; F331-R334 PolarHBondContact O-N 3.23Å; F331-S335 PolarHBondContact O-N 3.42Å
332	I	80.1	Confident	81.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-73.8	-43.4	178.1	-55.7	-177.4	0	0	0	110.4	I264 L292 F329 A330 R334 S335 F338 W343	I264-I332 HydrophobicContact CB-CD1 4.22Å; I264-I332 HydrophobicContact CB-CG1 4.29Å; I264-I332 HydrophobicContact CD1-CD1 3.81Å; I264-I332 HydrophobicContact CG2-CD1 3.97Å; I264-I332 HydrophobicContact CG2-CG1 4.02Å; L292-I332 HydrophobicContact CD1-CD1 3.37Å; F329-I332 HydrophobicContact CD2-CB 4.15Å; F329-I332 HydrophobicContact CD2-CD1 4.17Å; F329-I332 HydrophobicContact CE2-CB 4.27Å; F329-I332 HydrophobicContact CE2-CG2 4.23Å; F329-I332 PolarHBondContact O-N 3.36Å; A330-I332 VanDerWaalsContact C-N 3.3Å; A330-I332 PolarHBondContact O-N 2.94Å; I332-R334 PolarHBondContact O-N 3.39Å; I332-R334 VanDerWaalsContact O-N 3.12Å; I332-S335 WeakPolarHBondContact O-CB 3.36Å; I332-S335 PolarHBondContact O-N 2.96Å; I332-S335 PolarHBondContact O-OG 3.22Å; I332-S335 VanDerWaalsContact O-OG 3.09Å; I332-F338 HydrophobicContact CG2-CD2 4.14Å; I332-W343 HydrophobicContact CD1-CH2 3.88Å; I332-W343 HydrophobicContact CD1-CZ2 4.18Å; I332-W343 HydrophobicContact CD1-CZ3 4.28Å; I332-W343 HydrophobicContact CG2-CZ2 3.97Å
333	K	81.7	Confident	81.5	Confident	75 Å²	75	43.7 Å²	43.7	33%	0.326	23%	0.229	S	C	.	.	H	α-helix	trans	-55.5	-29.6	173.3	-75.9	-172.8	175.6	-179.1	0	112.5	F329 A330 F338 N347 E349	F329-K333 HydrophobicContact CD1-CD 4.04Å; F329-K333 HydrophobicContact CD1-CG 3.8Å; F329-K333 HydrophobicContact CE1-CD 3.96Å; F329-K333 HydrophobicContact CE1-CG 3.53Å; F329-K333 HydrophobicContact CZ-CG 4.22Å; F329-K333 PolarHBondContact O-N 3.01Å; A330-K333 PolarHBondContact O-N 3.12Å; K333-F338 HydrophobicContact CG-CE1 4.36Å; K333-F338 HydrophobicContact CG-CE2 4.32Å; K333-F338 HydrophobicContact CG-CZ 4.01Å; K333-N347 WeakPolarHBondContact CE-OD1 3.35Å; K333-E349 IonicContact NZ-OE1 3.15Å
334	R	78.7	Confident	81.1	Confident	147 Å²	147	48 Å²	48	56%	0.555	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1.8	177.8	-66.4	171.7	-172.1	176.7	2.9	113.8	E174 A330 F331 I332	E174-R334 IonicContact OE1-NH1 3.66Å; E174-R334 PolarHBondContact OE1-NH1 3.39Å; A330-R334 VanDerWaalsContact O-CG 3.23Å; A330-R334 WeakPolarHBondContact O-CG 3.48Å; A330-R334 PolarHBondContact O-N 2.87Å; A330-R334 VanDerWaalsContact O-N 3.16Å; F331-R334 PolarHBondContact O-N 3.23Å; I332-R334 PolarHBondContact O-N 3.39Å; I332-R334 VanDerWaalsContact O-N 3.12Å
335	S	77.5	Confident	80.7	Confident	10 Å²	10	51.8 Å²	51.8	7%	0.07	27%	0.274	C	S	.	.	S	Bend	trans	-73.8	153.1	176.4	82.9	0	0	0	0	111.1	F331 I332 A337 F338	F331-S335 PolarHBondContact O-N 3.42Å; I332-S335 WeakPolarHBondContact O-CB 3.36Å; I332-S335 PolarHBondContact O-N 2.96Å; I332-S335 PolarHBondContact O-OG 3.22Å; I332-S335 VanDerWaalsContact O-OG 3.09Å; S335-A337 VanDerWaalsContact C-N 3.31Å; S335-A337 PolarHBondContact O-N 3.18Å; S335-F338 PolarHBondContact OG-N 3.44Å
336	Q	73.8	Confident	80.2	Confident	138 Å²	138	51.5 Å²	51.5	65%	0.645	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-25.8	-177.5	-71.8	-177.7	-0.5	0	0	113
337	A	77.6	Confident	80.2	Confident	32 Å²	32	53.4 Å²	53.4	26%	0.264	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	16.9	-179.1	0	0	0	0	0	113.4	D269 S335 D339	D269-A337 WeakPolarHBondContact O-CB 3.13Å; S335-A337 VanDerWaalsContact C-N 3.31Å; S335-A337 PolarHBondContact O-N 3.18Å; A337-D339 PolarHBondContact O-N 3.39Å
338	F	81.4	Confident	80.2	Confident	55 Å²	55	55 Å²	55	24%	0.241	30%	0.296	C	S	.	.			trans	-61.1	127.3	-178.5	176.8	-111.5	0	0	0	111.8	F329 I332 K333 S335 P340 W343	F329-F338 HydrophobicContact CE2-CE2 4.44Å; F329-F338 AromaticContact CZ-CE2 3.8Å; F329-F338 HydrophobicContact CZ-CE2 3.8Å; F329-F338 HydrophobicContact CZ-CZ 4.17Å; I332-F338 HydrophobicContact CG2-CD2 4.14Å; K333-F338 HydrophobicContact CG-CE1 4.36Å; K333-F338 HydrophobicContact CG-CE2 4.32Å; K333-F338 HydrophobicContact CG-CZ 4.01Å; S335-F338 PolarHBondContact OG-N 3.44Å; F338-P340 HydrophobicContact CE1-CB 4.1Å; F338-P340 HydrophobicContact CE1-CG 4.49Å; F338-P340 HydrophobicContact CZ-CB 4.08Å; F338-W343 AromaticContact CE2-CD1 3.77Å; F338-W343 HydrophobicContact CE2-CG 4.38Å
339	D	82.7	Confident	79.9	Confident	61 Å²	61	61 Å²	61	33%	0.326	32%	0.323	S	S	.	.			trans	-126.8	112.3	173.8	175.1	3.9	0	0	0	109.1	A337 A341 K342	A337-D339 PolarHBondContact O-N 3.39Å; D339-A341 PolarHBondContact O-N 2.85Å; D339-A341 WeakPolarHBondContact OD1-CB 3.26Å; D339-A341 PolarHBondContact OD1-N 3.49Å; D339-K342 HydrophobicContact CB-CD 4.14Å; D339-K342 HydrophobicContact CB-CG 4.22Å; D339-K342 PolarHBondContact O-N 2.88Å; D339-K342 VanDerWaalsContact O-N 3.13Å; D339-K342 WeakPolarHBondContact OD2-CE 3.32Å
340	P	82.7	Confident	79.6	Confident	63 Å²	63	60.5 Å²	60.5	41%	0.409	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-61.3	-25.6	-177.5	23.7	-32.4	0	0	0	113.3	F338 K342 W343 N347	F338-P340 HydrophobicContact CE1-CB 4.1Å; F338-P340 HydrophobicContact CE1-CG 4.49Å; F338-P340 HydrophobicContact CZ-CB 4.08Å; P340-K342 PolarHBondContact O-N 2.85Å; P340-W343 PolarHBondContact O-N 2.83Å; P340-N347 WeakPolarHBondContact CB-ND2 3.45Å
341	A	84.6	Confident	79.3	Confident	82 Å²	82	67.4 Å²	67.4	68%	0.678	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-66.3	-24.2	179.2	0	0	0	0	0	112.8	D339 W343	D339-A341 PolarHBondContact O-N 2.85Å; D339-A341 WeakPolarHBondContact OD1-CB 3.26Å; D339-A341 PolarHBondContact OD1-N 3.49Å; A341-W343 VanDerWaalsContact C-N 3.32Å
342	K	80.8	Confident	79.1	Confident	92 Å²	92	72.2 Å²	72.2	40%	0.4	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-81.2	-11.9	178.2	-64	-178.8	-173.2	168.6	0	113.6	I285 D339 P340 P344	I285-K342 HydrophobicContact CD1-CD 4.47Å; I285-K342 HydrophobicContact CG2-CB 4.34Å; D339-K342 HydrophobicContact CB-CD 4.14Å; D339-K342 HydrophobicContact CB-CG 4.22Å; D339-K342 PolarHBondContact O-N 2.88Å; D339-K342 VanDerWaalsContact O-N 3.13Å; D339-K342 WeakPolarHBondContact OD2-CE 3.32Å; P340-K342 PolarHBondContact O-N 2.85Å; K342-P344 WeakPolarHBondContact O-CD 3.44Å
343	W	83.4	Confident	79	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.015	39%	0.392	C	S	.	.			trans	-126.9	56.6	-174.6	-58.4	94.5	0	0	0	112.2	I264 L274 I285 L288 D289 L292 F329 I332 F338 P340 A341 Q345 N347	I264-W343 HydrophobicContact CD1-CH2 4.49Å; L274-W343 HydrophobicContact CD2-CZ2 3.89Å; I285-W343 HydrophobicContact CG2-CD2 4.27Å; I285-W343 HydrophobicContact CG2-CE3 4.48Å; I285-W343 HydrophobicContact CG2-CH2 4.11Å; I285-W343 HydrophobicContact CG2-CZ2 3.88Å; I285-W343 HydrophobicContact CG2-CZ3 4.4Å; L288-W343 HydrophobicContact CB-CH2 3.86Å; L288-W343 HydrophobicContact CB-CZ3 3.87Å; L288-W343 HydrophobicContact CD1-CH2 4.49Å; D289-W343 HydrophobicContact CB-CE3 3.57Å; D289-W343 HydrophobicContact CB-CZ3 3.94Å; L292-W343 HydrophobicContact CD1-CH2 4.37Å; L292-W343 HydrophobicContact CD1-CZ3 3.85Å; F329-W343 HydrophobicContact CD2-CE3 4.49Å; F329-W343 HydrophobicContact CE2-CB 3.87Å; F329-W343 AromaticContact CE2-CD2 3.75Å; F329-W343 HydrophobicContact CE2-CD2 3.75Å; F329-W343 AromaticContact CE2-CE3 3.8Å; F329-W343 HydrophobicContact CE2-CE3 3.8Å; F329-W343 AromaticContact CE2-CG 3.78Å; F329-W343 HydrophobicContact CE2-CG 3.78Å; F329-W343 HydrophobicContact CZ-CB 3.68Å; F329-W343 HydrophobicContact CZ-CD2 4.43Å; F329-W343 AromaticContact CZ-CG 3.97Å; F329-W343 HydrophobicContact CZ-CG 3.97Å; I332-W343 HydrophobicContact CD1-CH2 3.88Å; I332-W343 HydrophobicContact CD1-CZ2 4.18Å; I332-W343 HydrophobicContact CD1-CZ3 4.28Å; I332-W343 HydrophobicContact CG2-CZ2 3.97Å; F338-W343 AromaticContact CE2-CD1 3.77Å; F338-W343 HydrophobicContact CE2-CG 4.38Å; P340-W343 PolarHBondContact O-N 2.83Å; A341-W343 VanDerWaalsContact C-N 3.32Å; W343-Q345 PolarHBondContact O-N 3.35Å; W343-Q345 VanDerWaalsContact O-N 3.17Å; W343-N347 WeakPolarHBondContact O-CB 3.28Å; W343-N347 PolarHBondContact O-N 3.33Å; W343-N347 VanDerWaalsContact O-N 3.1Å
344	P	82.9	Confident	78.6	Confident	90 Å²	90	72.2 Å²	72.2	58%	0.584	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.4	-172.7	27	-36.4	0	0	0	113.7	D289 K342	D289-P344 VanDerWaalsContact OD2-CD 3.26Å; D289-P344 WeakPolarHBondContact OD2-CD 3.23Å; K342-P344 WeakPolarHBondContact O-CD 3.44Å
345	Q	79.1	Confident	78.6	Confident	91 Å²	91	66.3 Å²	66.3	43%	0.425	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-55.6	178.7	-55.1	-175.6	14.3	0	0	110.9	D289 K293 W343 N347 V348	D289-Q345 WeakPolarHBondContact OD2-CB 3.24Å; D289-Q345 WeakPolarHBondContact OD2-CG 3.35Å; D289-Q345 PolarHBondContact OD2-N 3.37Å; K293-Q345 HydrophobicContact CB-CB 3.81Å; K293-Q345 VanDerWaalsContact CE-O 3.26Å; K293-Q345 WeakPolarHBondContact CE-O 3.32Å; K293-Q345 HydrophobicContact CG-CB 3.88Å; K293-Q345 WeakPolarHBondContact CG-O 3.27Å; W343-Q345 PolarHBondContact O-N 3.35Å; W343-Q345 VanDerWaalsContact O-N 3.17Å; Q345-N347 VanDerWaalsContact C-N 3.27Å; Q345-N347 PolarHBondContact O-N 3.11Å; Q345-V348 PolarHBondContact O-N 3.48Å
346	S	76.4	Confident	78.8	Confident	8 Å²	8	70 Å²	70	6%	0.056	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.5	-172.4	-55.6	0	0	0	0	113.5	D289 F329 V348	D289-S346 PolarHBondContact O-OG 2.94Å; D289-S346 VanDerWaalsContact O-OG 3.06Å; D289-S346 WeakPolarHBondContact OD1-CB 3.33Å; D289-S346 PolarHBondContact OD1-N 3.37Å; D289-S346 PolarHBondContact OD1-OG 2.96Å; F329-S346 VanDerWaalsContact CD1-O 3.3Å; F329-S346 WeakPolarHBondContact CD1-O 3.29Å; F329-S346 VanDerWaalsContact CD2-CB 3.41Å; F329-S346 WeakPolarHBondContact CE1-O 3.38Å; F329-S346 VanDerWaalsContact CE2-CB 3.43Å; S346-V348 VanDerWaalsContact C-N 3.31Å; S346-V348 PolarHBondContact O-N 3.01Å
347	N	81.2	Confident	79.2	Confident	58 Å²	58	64 Å²	64	31%	0.31	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.7	-178.3	-162.7	47.3	0	0	0	114.5	F329 K333 P340 W343 Q345	F329-N347 HydrophobicContact CE1-CB 4.21Å; F329-N347 HydrophobicContact CZ-CB 4.33Å; K333-N347 WeakPolarHBondContact CE-OD1 3.35Å; P340-N347 WeakPolarHBondContact CB-ND2 3.45Å; W343-N347 WeakPolarHBondContact O-CB 3.28Å; W343-N347 PolarHBondContact O-N 3.33Å; W343-N347 VanDerWaalsContact O-N 3.1Å; Q345-N347 VanDerWaalsContact C-N 3.27Å; Q345-N347 PolarHBondContact O-N 3.11Å
348	V	80.1	Confident	79.4	Confident	95 Å²	95	63.3 Å²	63.3	58%	0.576	36%	0.357	S	S	*	.	S	Bend	trans	-86.9	119.1	177.7	-179.4	0	0	0	0	109.8	K293 Q345 S346	K293-V348 WeakPolarHBondContact CE-O 3.39Å; K293-V348 PolarHBondContact NZ-O 3.5Å; Q345-V348 PolarHBondContact O-N 3.48Å; S346-V348 VanDerWaalsContact C-N 3.31Å; S346-V348 PolarHBondContact O-N 3.01Å
349	E	71.8	Confident	79.5	Confident	137 Å²	137	66.1 Å²	66.1	64%	0.64	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-70.3	138.4	176.9	-79.3	172.1	-171.8	0	0	112.4	K333	K333-E349 IonicContact NZ-OE1 3.15Å
350	S	73.8	Confident	79.4	Confident	7 Å²	7	66.5 Å²	66.5	5%	0.049	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-84	118.8	177.5	-63.1	0	0	0	0	111.1	K293 E316 V352	K293-S350 PolarHBondContact NZ-OG 2.8Å; E316-S350 PolarHBondContact OE1-N 3.49Å; E316-S350 PolarHBondContact OE1-OG 3.28Å; E316-S350 VanDerWaalsContact OE2-CB 3.23Å; E316-S350 WeakPolarHBondContact OE2-CB 3.43Å; E316-S350 PolarHBondContact OE2-OG 3.3Å; S350-V352 VanDerWaalsContact C-N 3.31Å; S350-V352 PolarHBondContact O-N 3.18Å
351	L	74.3	Confident	79.4	Confident	165 Å²	165	64 Å²	64	86%	0.864	35%	0.352	S	S	*	.	S	Bend	trans	-75.4	-16.3	176.8	-68.3	167.4	0	0	0	114.3
352	V	77.2	Confident	79.3	Confident	105 Å²	105	68.3 Å²	68.3	64%	0.636	35%	0.351	S	S	*	.	S	Bend	trans	-134.7	143.8	-176.2	-176.6	0	0	0	0	108.4	S350 W423	S350-V352 VanDerWaalsContact C-N 3.31Å; S350-V352 PolarHBondContact O-N 3.18Å; V352-W423 VanDerWaalsContact C-CZ2 3.47Å
353	C	77.3	Confident	79.6	Confident	23 Å²	23	66.4 Å²	66.4	16%	0.155	35%	0.347	C	S	.	.			trans	-52.7	126.5	175.1	-170.7	0	0	0	0	110	I355 W423	C353-I355 PolarHBondContact O-N 2.97Å; C353-W423 HydrophobicContact CB-CD2 3.81Å; C353-W423 HydrophobicContact CB-CE3 3.55Å; C353-W423 HydrophobicContact CB-CG 4.48Å; C353-W423 HydrophobicContact CB-CH2 4.25Å; C353-W423 HydrophobicContact CB-CZ2 4.45Å; C353-W423 HydrophobicContact CB-CZ3 3.8Å; C353-W423 VanDerWaalsContact N-CH2 3.31Å
354	P	74.3	Confident	79.7	Confident	54 Å²	54	67 Å²	67	35%	0.351	35%	0.349	S	S	.	.	S	Bend	trans	-68.4	-17.7	-178.6	25.2	-32.5	0	0	0	113
355	I	77.1	Confident	79.9	Confident	22 Å²	22	69.7 Å²	69.7	11%	0.113	35%	0.348	C	S	.	.			trans	-105	115.7	-179.1	-60.1	175.2	0	0	0	109	C353 I357 C416 E419 V420	C353-I355 PolarHBondContact O-N 2.97Å; I355-I357 PolarHBondContact O-N 3.44Å; I355-C416 WeakPolarHBondContact CG2-SG 3.37Å; I355-E419 HydrophobicContact CD1-CB 3.74Å; I355-E419 VanDerWaalsContact CD1-OE2 3.24Å; I355-E419 WeakPolarHBondContact CD1-OE2 3.34Å; I355-V420 HydrophobicContact CB-CG2 3.77Å; I355-V420 HydrophobicContact CD1-CG2 4.44Å; I355-V420 HydrophobicContact CG2-CG2 3.57Å
356	N	83	Confident	80.4	Confident	89 Å²	89	71.5 Å²	71.5	48%	0.476	36%	0.356	S	S	.	.			trans	-88.1	93.4	167.6	-172.5	-21	0	0	0	109.8	A358 E359 R360	N356-A358 PolarHBondContact O-N 3.25Å; N356-A358 WeakPolarHBondContact OD1-CB 3.22Å; N356-A358 PolarHBondContact OD1-N 2.89Å; N356-E359 HydrophobicContact CB-CB 4.28Å; N356-E359 PolarHBondContact O-N 3.5Å; N356-E359 PolarHBondContact OD1-N 3.46Å; N356-R360 WeakPolarHBondContact O-CG 3.45Å; N356-R360 PolarHBondContact O-N 3.02Å; N356-R360 VanDerWaalsContact O-N 3.13Å
357	I	82.4	Confident	81	Confident	10 Å²	10	72.8 Å²	72.8	5%	0.051	36%	0.361	C	S	.	.	H	α-helix	trans	-63.6	-29.6	-177.4	-167.2	67.8	0	0	0	112.6	I355 R360 T361 F364 C416 V420 E456	I355-I357 PolarHBondContact O-N 3.44Å; I357-R360 PolarHBondContact O-N 3.36Å; I357-T361 WeakPolarHBondContact O-CB 3.28Å; I357-T361 PolarHBondContact O-N 2.87Å; I357-T361 PolarHBondContact O-OG1 3.19Å; I357-F364 HydrophobicContact CD1-CE2 4.19Å; I357-C416 HydrophobicContact CD1-CB 4.33Å; I357-C416 WeakPolarHBondContact CD1-SG 3.35Å; I357-V420 HydrophobicContact CB-CG2 4.22Å; I357-E456 HydrophobicContact CG2-CB 3.67Å; I357-E456 HydrophobicContact CG2-CG 3.46Å; I357-E456 VanDerWaalsContact CG2-CG 3.46Å
358	A	81.1	Confident	81.4	Confident	18 Å²	18	72.2 Å²	72.2	15%	0.149	36%	0.357	C	S	.	.	H	α-helix	trans	-65.9	-40.6	178.5	0	0	0	0	0	111.6	N356 E455	N356-A358 PolarHBondContact O-N 3.25Å; N356-A358 WeakPolarHBondContact OD1-CB 3.22Å; N356-A358 PolarHBondContact OD1-N 2.89Å; A358-E455 HydrophobicContact CB-CB 4.1Å
359	E	83.3	Confident	81.9	Confident	114 Å²	114	70.9 Å²	70.9	53%	0.533	35%	0.352	S	S	.	.	H	α-helix	trans	-68	-44.2	173.4	-169.8	178.8	176	0	0	111.2	N356 T361 R362	N356-E359 HydrophobicContact CB-CB 4.28Å; N356-E359 PolarHBondContact O-N 3.5Å; N356-E359 PolarHBondContact OD1-N 3.46Å; E359-T361 VanDerWaalsContact C-N 3.29Å; E359-T361 PolarHBondContact O-N 3.16Å; E359-R362 WeakPolarHBondContact O-CB 3.36Å; E359-R362 PolarHBondContact O-N 3.48Å; E359-R362 VanDerWaalsContact O-N 3.08Å
360	R	80.9	Confident	82.9	Confident	70 Å²	70	68.9 Å²	68.9	26%	0.264	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-36.7	178.5	-69.4	-65	-177.4	-179.9	0.2	113.6	E296 F302 N356 I357 R362 T363 F364	E296-R360 IonicContact OE2-CZ 2.74Å; E296-R360 IonicContact OE2-NH2 3.26Å; E296-R360 PolarHBondContact OE2-NH2 3.36Å; F302-R360 VanDerWaalsContact CD2-NH1 3.26Å; F302-R360 VanDerWaalsContact CE2-CZ 3.41Å; N356-R360 WeakPolarHBondContact O-CG 3.45Å; N356-R360 PolarHBondContact O-N 3.02Å; N356-R360 VanDerWaalsContact O-N 3.13Å; I357-R360 PolarHBondContact O-N 3.36Å; R360-R362 PolarHBondContact O-N 2.92Å; R360-R362 VanDerWaalsContact O-N 3.16Å; R360-T363 WeakPolarHBondContact O-CB 3.41Å; R360-T363 PolarHBondContact O-N 3.4Å; R360-F364 HydrophobicContact CB-CE1 4.17Å; R360-F364 HydrophobicContact CB-CE2 4.19Å; R360-F364 HydrophobicContact CB-CZ 3.89Å; R360-F364 WeakPolarHBondContact O-CD1 3.44Å; R360-F364 VanDerWaalsContact O-CG 3.28Å; R360-F364 WeakPolarHBondContact O-CG 3.36Å; R360-F364 PolarHBondContact O-N 3.16Å
361	T	82.1	Confident	83.7	Confident	11 Å²	11	68.6 Å²	68.6	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-58.2	-29.5	177.5	-61.1	0	0	0	0	111.5	I357 E359 R365 M461	I357-T361 WeakPolarHBondContact O-CB 3.28Å; I357-T361 PolarHBondContact O-N 2.87Å; I357-T361 PolarHBondContact O-OG1 3.19Å; E359-T361 VanDerWaalsContact C-N 3.29Å; E359-T361 PolarHBondContact O-N 3.16Å; T361-R365 WeakPolarHBondContact O-CG 3.25Å; T361-R365 PolarHBondContact O-N 3.28Å; T361-R365 VanDerWaalsContact O-N 3.11Å; T361-M461 HydrophobicContact CG2-CE 3.89Å
362	R	83.6	Confident	84.5	Confident	172 Å²	172	62.5 Å²	62.5	65%	0.649	31%	0.313	S	S	*	.	H	α-helix	trans	-67	-47.9	173.8	-59.8	-178	-174.8	176.9	1.9	111.3	E359 R360 F364 R365 E366	E359-R362 WeakPolarHBondContact O-CB 3.36Å; E359-R362 PolarHBondContact O-N 3.48Å; E359-R362 VanDerWaalsContact O-N 3.08Å; R360-R362 PolarHBondContact O-N 2.92Å; R360-R362 VanDerWaalsContact O-N 3.16Å; R362-F364 VanDerWaalsContact C-N 3.32Å; R362-F364 PolarHBondContact O-N 3.09Å; R362-R365 WeakPolarHBondContact O-CB 3.17Å; R362-R365 PolarHBondContact O-N 3.2Å; R362-E366 PolarHBondContact O-N 3.18Å
363	T	86	Confident	85.2	Confident	52 Å²	52	61.9 Å²	61.9	32%	0.319	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-41.1	175.5	-47.8	0	0	0	0	111.6	R360 R365 E366 E367	R360-T363 WeakPolarHBondContact O-CB 3.41Å; R360-T363 PolarHBondContact O-N 3.4Å; T363-R365 VanDerWaalsContact C-N 3.27Å; T363-R365 PolarHBondContact O-N 3.39Å; T363-E366 PolarHBondContact O-N 2.93Å; T363-E367 HydrophobicContact CG2-CG 4.37Å; T363-E367 WeakPolarHBondContact O-CG 3.31Å; T363-E367 PolarHBondContact O-N 2.85Å
364	F	86.6	Confident	85.8	Confident	15 Å²	15	65.4 Å²	65.4	7%	0.066	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-37.9	177.2	-63	-10.8	0	0	0	111.8	I357 R360 R362 E367 H368 W413 C416 M461	I357-F364 HydrophobicContact CD1-CE2 4.19Å; R360-F364 HydrophobicContact CB-CE1 4.17Å; R360-F364 HydrophobicContact CB-CE2 4.19Å; R360-F364 HydrophobicContact CB-CZ 3.89Å; R360-F364 WeakPolarHBondContact O-CD1 3.44Å; R360-F364 VanDerWaalsContact O-CG 3.28Å; R360-F364 WeakPolarHBondContact O-CG 3.36Å; R360-F364 PolarHBondContact O-N 3.16Å; R362-F364 VanDerWaalsContact C-N 3.32Å; R362-F364 PolarHBondContact O-N 3.09Å; F364-E367 PolarHBondContact O-N 2.76Å; F364-H368 WeakPolarHBondContact O-CB 3.17Å; F364-H368 PolarHBondContact O-N 2.94Å; F364-W413 AromaticContact CD1-CD1 3.24Å; F364-W413 HydrophobicContact CD1-CG 4.08Å; F364-W413 AromaticContact CD1-NE1 3.37Å; F364-W413 HydrophobicContact CD2-CB 4.41Å; F364-W413 HydrophobicContact CD2-CG 4.18Å; F364-W413 AromaticContact CE1-CD1 3.36Å; F364-W413 HydrophobicContact CE1-CG 4.23Å; F364-W413 AromaticContact CE1-NE1 3.93Å; F364-W413 HydrophobicContact CE2-CB 4.22Å; F364-W413 HydrophobicContact CE2-CG 4.32Å; F364-W413 AromaticContact CG-CD1 3.65Å; F364-W413 HydrophobicContact CG-CD2 4.42Å; F364-W413 HydrophobicContact CG-CG 4.06Å; F364-W413 AromaticContact CG-NE1 3.78Å; F364-W413 HydrophobicContact CZ-CB 4.38Å; F364-W413 AromaticContact CZ-CD1 3.84Å; F364-W413 HydrophobicContact CZ-CG 4.34Å; F364-C416 HydrophobicContact CE2-CB 4.32Å; F364-C416 HydrophobicContact CZ-CB 3.77Å; F364-M461 HydrophobicContact CB-CE 3.53Å; F364-M461 HydrophobicContact CB-SD 4.26Å; F364-M461 HydrophobicContact CD2-CE 4.22Å; F364-M461 HydrophobicContact CG-CE 4.41Å
365	R	86.7	Confident	86.5	Confident	148 Å²	148	63.2 Å²	63.2	56%	0.558	31%	0.305	S	S	*	.	H	α-helix	trans	-64.8	-41.7	175.9	-73.3	174.6	-170.1	-177.9	5.6	112.5	T361 R362 T363 S369 M461	T361-R365 WeakPolarHBondContact O-CG 3.25Å; T361-R365 PolarHBondContact O-N 3.28Å; T361-R365 VanDerWaalsContact O-N 3.11Å; R362-R365 WeakPolarHBondContact O-CB 3.17Å; R362-R365 PolarHBondContact O-N 3.2Å; T363-R365 VanDerWaalsContact C-N 3.27Å; T363-R365 PolarHBondContact O-N 3.39Å; R365-S369 WeakPolarHBondContact O-CB 3.24Å; R365-S369 PolarHBondContact O-N 2.9Å; R365-M461 HydrophobicContact CB-SD 4.35Å; R365-M461 HydrophobicContact CG-CE 4.25Å; R365-M461 HydrophobicContact CG-SD 3.5Å; R365-M461 VanDerWaalsContact CG-SD 3.5Å
366	E	89.3	Confident	86.9	Confident	129 Å²	129	64.2 Å²	64.2	60%	0.603	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-49.9	176.1	-67.8	172.2	-178.9	0	0	110.6	R362 T363 H368 S369 D370	R362-E366 PolarHBondContact O-N 3.18Å; T363-E366 PolarHBondContact O-N 2.93Å; E366-H368 VanDerWaalsContact C-N 3.34Å; E366-H368 PolarHBondContact O-N 3.46Å; E366-S369 PolarHBondContact O-N 2.99Å; E366-D370 PolarHBondContact O-N 2.68Å
367	E	88.7	Confident	87.1	Confident	34 Å²	34	62.5 Å²	62.5	16%	0.159	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-41.9	177.3	-71.1	177.3	163.6	0	0	112.6	T363 F364 F371 L409 W413	T363-E367 HydrophobicContact CG2-CG 4.37Å; T363-E367 WeakPolarHBondContact O-CG 3.31Å; T363-E367 PolarHBondContact O-N 2.85Å; F364-E367 PolarHBondContact O-N 2.76Å; E367-F371 VanDerWaalsContact O-CB 3.31Å; E367-F371 WeakPolarHBondContact O-CB 3.44Å; E367-F371 PolarHBondContact O-N 3.39Å; E367-L409 HydrophobicContact CB-CD2 4.02Å; E367-L409 HydrophobicContact CG-CD2 4.23Å; E367-W413 HydrophobicContact CB-CZ2 3.98Å; E367-W413 PolarHBondContact OE2-NE1 3.33Å
368	H	90.1	Very high	87.1	Confident	47 Å²	47	63 Å²	63	22%	0.218	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-48.6	175.6	178.7	-83.6	0	0	0	111	F364 E366 D370 F371 V372 W413	F364-H368 WeakPolarHBondContact O-CB 3.17Å; F364-H368 PolarHBondContact O-N 2.94Å; E366-H368 VanDerWaalsContact C-N 3.34Å; E366-H368 PolarHBondContact O-N 3.46Å; H368-D370 PolarHBondContact O-N 3.49Å; H368-F371 PolarHBondContact O-N 3.45Å; H368-V372 WeakPolarHBondContact O-CB 3.2Å; H368-V372 VanDerWaalsContact O-CG2 3.29Å; H368-V372 WeakPolarHBondContact O-CG2 2.7Å; H368-V372 PolarHBondContact O-N 2.94Å; H368-W413 HydrophobicContact CB-CH2 3.64Å; H368-W413 HydrophobicContact CB-CZ2 4.21Å; H368-W413 HydrophobicContact CB-CZ3 4.5Å; H368-W413 AromaticContact CD2-CH2 3.95Å
369	S	90.2	Very high	87.1	Confident	66 Å²	66	67.4 Å²	67.4	46%	0.462	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-47.2	179.4	-172.4	0	0	0	0	111.6	R365 E366 T373	R365-S369 WeakPolarHBondContact O-CB 3.24Å; R365-S369 PolarHBondContact O-N 2.9Å; E366-S369 PolarHBondContact O-N 2.99Å; S369-T373 VanDerWaalsContact O-CB 3.31Å; S369-T373 WeakPolarHBondContact O-CB 3.44Å; S369-T373 PolarHBondContact O-N 3.27Å; S369-T373 PolarHBondContact O-OG1 2.76Å
370	D	92.3	Very high	87	Confident	95 Å²	95	66.4 Å²	66.4	51%	0.508	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-46.6	178.6	-77.5	-4.7	0	0	0	112	E366 H368 R374	E366-D370 PolarHBondContact O-N 2.68Å; H368-D370 PolarHBondContact O-N 3.49Å; D370-R374 PolarHBondContact O-N 3.38Å
371	F	92.2	Very high	86.9	Confident	1 Å²	1	68.2 Å²	68.2	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-47.6	-177.3	-175.4	-92.5	0	0	0	112	E367 H368 T373 R374 L375 M402 Q405 L409 L465 M469	E367-F371 VanDerWaalsContact O-CB 3.31Å; E367-F371 WeakPolarHBondContact O-CB 3.44Å; E367-F371 PolarHBondContact O-N 3.39Å; H368-F371 PolarHBondContact O-N 3.45Å; F371-T373 VanDerWaalsContact C-N 3.32Å; F371-T373 PolarHBondContact O-N 2.64Å; F371-R374 PolarHBondContact O-N 3.33Å; F371-L375 HydrophobicContact CE1-CB 4.47Å; F371-L375 HydrophobicContact CE1-CD2 4.16Å; F371-L375 WeakPolarHBondContact O-CB 3.36Å; F371-L375 PolarHBondContact O-N 2.94Å; F371-M402 HydrophobicContact CD2-CE 3.95Å; F371-M402 HydrophobicContact CD2-SD 4.16Å; F371-M402 HydrophobicContact CE1-CE 4.14Å; F371-M402 HydrophobicContact CE2-CE 3.51Å; F371-M402 WeakPolarHBondContact CE2-O 3.38Å; F371-M402 HydrophobicContact CE2-SD 3.77Å; F371-M402 HydrophobicContact CG-CE 4.44Å; F371-M402 HydrophobicContact CZ-CE 3.62Å; F371-M402 WeakPolarHBondContact CZ-O 3.43Å; F371-M402 HydrophobicContact CZ-SD 4.41Å; F371-Q405 HydrophobicContact CD2-CG 4.22Å; F371-Q405 HydrophobicContact CE2-CB 4.14Å; F371-Q405 HydrophobicContact CE2-CG 4.25Å; F371-L409 HydrophobicContact CB-CD1 3.81Å; F371-L409 HydrophobicContact CD2-CD1 3.76Å; F371-L409 HydrophobicContact CG-CD1 3.84Å; F371-L465 HydrophobicContact CD1-CD1 3.55Å; F371-L465 HydrophobicContact CD1-CD2 4.29Å; F371-L465 HydrophobicContact CE1-CD1 3.67Å; F371-M469 HydrophobicContact CE1-CG 4.33Å; F371-M469 HydrophobicContact CE1-SD 4.33Å; F371-M469 HydrophobicContact CZ-SD 4.37Å
372	V	90.3	Very high	86.5	Confident	37 Å²	37	69 Å²	69	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-37.8	-179.4	172.2	0	0	0	0	111.1	H368 L375 A376 L465 L468	H368-V372 WeakPolarHBondContact O-CB 3.2Å; H368-V372 VanDerWaalsContact O-CG2 3.29Å; H368-V372 WeakPolarHBondContact O-CG2 2.7Å; H368-V372 PolarHBondContact O-N 2.94Å; V372-L375 PolarHBondContact O-N 3.4Å; V372-A376 VanDerWaalsContact O-CB 3.3Å; V372-A376 WeakPolarHBondContact O-CB 3.38Å; V372-A376 PolarHBondContact O-N 3.31Å; V372-L465 HydrophobicContact CG2-CD1 4.15Å; V372-L468 HydrophobicContact CB-CD1 4.47Å; V372-L468 HydrophobicContact CG1-CD1 3.95Å; V372-L468 HydrophobicContact CG2-CD1 3.65Å
373	T	90.8	Very high	86.1	Confident	93 Å²	93	66.3 Å²	66.3	57%	0.571	34%	0.339	S	S	*	.	H	α-helix	trans	-62.2	-45.1	176.5	-57.4	0	0	0	0	111.4	S369 F371 A376 A377	S369-T373 VanDerWaalsContact O-CB 3.31Å; S369-T373 WeakPolarHBondContact O-CB 3.44Å; S369-T373 PolarHBondContact O-N 3.27Å; S369-T373 PolarHBondContact O-OG1 2.76Å; F371-T373 VanDerWaalsContact C-N 3.32Å; F371-T373 PolarHBondContact O-N 2.64Å; T373-A376 PolarHBondContact O-N 3.02Å; T373-A377 PolarHBondContact O-N 2.81Å
374	R	90.6	Very high	85.4	Confident	97 Å²	97	70.9 Å²	70.9	37%	0.366	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-45	175.4	-79.1	171.7	42.2	178.8	-10.8	112.5	D370 F371 A376 A377 I378 M402	D370-R374 PolarHBondContact O-N 3.38Å; F371-R374 PolarHBondContact O-N 3.33Å; R374-A376 VanDerWaalsContact C-N 3.31Å; R374-A376 PolarHBondContact O-N 3.24Å; R374-A377 PolarHBondContact O-N 2.99Å; R374-I378 PolarHBondContact O-N 2.86Å; R374-I378 VanDerWaalsContact O-N 3.09Å; R374-M402 HydrophobicContact CB-CE 4.11Å; R374-M402 HydrophobicContact CB-SD 4.2Å; R374-M402 VanDerWaalsContact CZ-SD 3.6Å; R374-M402 PolarHBondContact NH2-SD 2.86Å
375	L	88.9	Confident	84.4	Confident	8 Å²	8	75.2 Å²	75.2	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-59.3	-44.9	178.4	-172.2	67.2	0	0	0	111.1	F371 V372 A377 I378 R379 M402 L468 M472 F476	F371-L375 HydrophobicContact CE1-CB 4.47Å; F371-L375 HydrophobicContact CE1-CD2 4.16Å; F371-L375 WeakPolarHBondContact O-CB 3.36Å; F371-L375 PolarHBondContact O-N 2.94Å; V372-L375 PolarHBondContact O-N 3.4Å; L375-A377 PolarHBondContact O-N 3.38Å; L375-I378 PolarHBondContact O-N 2.87Å; L375-R379 WeakPolarHBondContact O-CB 3.45Å; L375-R379 PolarHBondContact O-N 2.82Å; L375-M402 HydrophobicContact CB-CE 3.64Å; L375-M402 HydrophobicContact CD1-CE 3.78Å; L375-M402 HydrophobicContact CG-CE 4.33Å; L375-L468 HydrophobicContact CD2-CB 4.18Å; L375-M472 HydrophobicContact CD1-CE 4.13Å; L375-M472 HydrophobicContact CD1-SD 3.42Å; L375-M472 WeakPolarHBondContact CD1-SD 3.29Å; L375-M472 HydrophobicContact CD2-SD 4.32Å; L375-M472 HydrophobicContact CG-SD 3.72Å; L375-F476 HydrophobicContact CD1-CE1 4.32Å; L375-F476 HydrophobicContact CD1-CE2 4.49Å; L375-F476 HydrophobicContact CD1-CZ 3.61Å
376	A	86.2	Confident	83	Confident	42 Å²	42	70 Å²	70	35%	0.347	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-40.8	176.9	0	0	0	0	0	112.2	V372 T373 R374 I378 R379 N380	V372-A376 VanDerWaalsContact O-CB 3.3Å; V372-A376 WeakPolarHBondContact O-CB 3.38Å; V372-A376 PolarHBondContact O-N 3.31Å; T373-A376 PolarHBondContact O-N 3.02Å; R374-A376 VanDerWaalsContact C-N 3.31Å; R374-A376 PolarHBondContact O-N 3.24Å; A376-I378 PolarHBondContact O-N 2.88Å; A376-R379 PolarHBondContact O-N 3.3Å; A376-N380 WeakPolarHBondContact O-CB 3.18Å; A376-N380 PolarHBondContact O-N 2.68Å; A376-N380 PolarHBondContact O-ND2 3.31Å
377	A	86.6	Confident	81.5	Confident	54 Å²	54	75.2 Å²	75.2	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-44.5	177.2	0	0	0	0	0	112.1	T373 R374 L375 N380 K381	T373-A377 PolarHBondContact O-N 2.81Å; R374-A377 PolarHBondContact O-N 2.99Å; L375-A377 PolarHBondContact O-N 3.38Å; A377-N380 PolarHBondContact O-N 2.92Å; A377-K381 PolarHBondContact O-N 3.07Å; A377-K381 VanDerWaalsContact O-N 3.16Å
378	I	81.8	Confident	79.8	Confident	20 Å²	20	81.5 Å²	81.5	10%	0.103	42%	0.422	C	S	.	.	H	α-helix	trans	-69.2	-43.6	178.1	-60.4	165.5	0	0	0	110.9	R374 L375 A376 N380 K381 I382 E398 L399 M402	R374-I378 PolarHBondContact O-N 2.86Å; R374-I378 VanDerWaalsContact O-N 3.09Å; L375-I378 PolarHBondContact O-N 2.87Å; A376-I378 PolarHBondContact O-N 2.88Å; I378-N380 VanDerWaalsContact C-N 3.28Å; I378-N380 PolarHBondContact O-N 2.98Å; I378-K381 WeakPolarHBondContact O-CB 3.43Å; I378-K381 PolarHBondContact O-N 3.26Å; I378-K381 VanDerWaalsContact O-N 3.07Å; I378-I382 HydrophobicContact CG2-CD1 3.99Å; I378-I382 HydrophobicContact CG2-CG1 4.39Å; I378-I382 WeakPolarHBondContact O-CG1 3.25Å; I378-I382 PolarHBondContact O-N 3.41Å; I378-E398 HydrophobicContact CD1-CG 4.22Å; I378-L399 HydrophobicContact CB-CD1 4.4Å; I378-L399 HydrophobicContact CG2-CD1 3.3Å; I378-M402 HydrophobicContact CD1-CG 3.83Å
379	R	82.4	Confident	78.3	Confident	110 Å²	110	83.6 Å²	83.6	42%	0.415	44%	0.438	S	S	.	.	H	α-helix	trans	-56.6	-42.7	176	-175	177.6	174.3	-155.9	-5.4	112.1	L375 A376 I382 L383 M472	L375-R379 WeakPolarHBondContact O-CB 3.45Å; L375-R379 PolarHBondContact O-N 2.82Å; A376-R379 PolarHBondContact O-N 3.3Å; R379-I382 PolarHBondContact O-N 2.92Å; R379-L383 HydrophobicContact CG-CD1 4.1Å; R379-L383 PolarHBondContact O-N 3.36Å; R379-M472 HydrophobicContact CB-CE 4.35Å; R379-M472 HydrophobicContact CB-SD 3.88Å; R379-M472 HydrophobicContact CG-SD 4.18Å
380	N	81.3	Confident	77	Confident	94 Å²	94	83.4 Å²	83.4	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-65	-38.2	177.1	-71.9	-16.2	0	0	0	112	A376 A377 I378 L383 L384	A376-N380 WeakPolarHBondContact O-CB 3.18Å; A376-N380 PolarHBondContact O-N 2.68Å; A376-N380 PolarHBondContact O-ND2 3.31Å; A377-N380 PolarHBondContact O-N 2.92Å; I378-N380 VanDerWaalsContact C-N 3.28Å; I378-N380 PolarHBondContact O-N 2.98Å; N380-L383 PolarHBondContact O-N 3.28Å; N380-L384 VanDerWaalsContact O-CG 3.29Å; N380-L384 WeakPolarHBondContact O-CG 3.33Å; N380-L384 PolarHBondContact O-N 3.06Å; N380-L384 VanDerWaalsContact O-N 3.11Å
381	K	78.3	Confident	75.9	Confident	108 Å²	108	80.9 Å²	80.9	47%	0.47	43%	0.427	S	S	.	.	H	α-helix	trans	-61.8	-46.4	173	-73.6	-179	178	-177.4	0	111.8	A377 I378 L383 L384 H385	A377-K381 PolarHBondContact O-N 3.07Å; A377-K381 VanDerWaalsContact O-N 3.16Å; I378-K381 WeakPolarHBondContact O-CB 3.43Å; I378-K381 PolarHBondContact O-N 3.26Å; I378-K381 VanDerWaalsContact O-N 3.07Å; K381-L383 VanDerWaalsContact C-N 3.31Å; K381-L383 PolarHBondContact O-N 3.37Å; K381-L384 PolarHBondContact O-N 2.62Å; K381-L384 VanDerWaalsContact O-N 3.12Å; K381-H385 PolarHBondContact O-CD2 2.97Å; K381-H385 PolarHBondContact O-N 3.34Å
382	I	74.4	Confident	75.2	Confident	26 Å²	26	84.6 Å²	84.6	13%	0.133	45%	0.447	C	S	.	.	H	α-helix	trans	-58.6	-45.1	178	-65.4	166.9	0	0	0	110.5	I378 R379 L384 H385 G386 L391 L399 M472	I378-I382 HydrophobicContact CG2-CD1 3.99Å; I378-I382 HydrophobicContact CG2-CG1 4.39Å; I378-I382 WeakPolarHBondContact O-CG1 3.25Å; I378-I382 PolarHBondContact O-N 3.41Å; R379-I382 PolarHBondContact O-N 2.92Å; I382-L384 VanDerWaalsContact C-N 3.28Å; I382-L384 PolarHBondContact O-N 2.81Å; I382-H385 PolarHBondContact O-N 3.22Å; I382-G386 PolarHBondContact O-N 3.43Å; I382-L391 HydrophobicContact CG1-CD2 4.18Å; I382-L399 HydrophobicContact CD1-CD1 4.01Å; I382-M472 HydrophobicContact CD1-CE 4.13Å
383	L	73.8	Confident	74.8	Confident	117 Å²	117	87 Å²	87	61%	0.613	46%	0.458	S	S	*	.	H	α-helix	trans	-61.5	-33.2	177.3	-82.5	157.9	0	0	0	113.2	R379 N380 K381	R379-L383 HydrophobicContact CG-CD1 4.1Å; R379-L383 PolarHBondContact O-N 3.36Å; N380-L383 PolarHBondContact O-N 3.28Å; K381-L383 VanDerWaalsContact C-N 3.31Å; K381-L383 PolarHBondContact O-N 3.37Å
384	L	71.2	Confident	74.5	Confident	147 Å²	147	90.1 Å²	90.1	77%	0.77	47%	0.466	S	S	*	.	H	α-helix	trans	-75.7	-32.2	179.5	-73.9	165.8	0	0	0	113.4	N380 K381 I382	N380-L384 VanDerWaalsContact O-CG 3.29Å; N380-L384 WeakPolarHBondContact O-CG 3.33Å; N380-L384 PolarHBondContact O-N 3.06Å; N380-L384 VanDerWaalsContact O-N 3.11Å; K381-L384 PolarHBondContact O-N 2.62Å; K381-L384 VanDerWaalsContact O-N 3.12Å; I382-L384 VanDerWaalsContact C-N 3.28Å; I382-L384 PolarHBondContact O-N 2.81Å
385	H	66.1	Low	74.2	Confident	107 Å²	107	87.9 Å²	87.9	50%	0.495	46%	0.459	S	S	.	.	H	α-helix	trans	-81.6	-13.4	-177.7	-74.1	-64	0	0	0	114	K381 I382 V389	K381-H385 PolarHBondContact O-CD2 2.97Å; K381-H385 PolarHBondContact O-N 3.34Å; I382-H385 PolarHBondContact O-N 3.22Å; H385-V389 HydrophobicContact CB-CB 4.48Å; H385-V389 VanDerWaalsContact O-CG2 3.24Å; H385-V389 WeakPolarHBondContact O-CG2 3.24Å
386	G	57.4	Low	74.1	Confident	38 Å²	38	87.8 Å²	87.8	39%	0.392	46%	0.459	S	S	.	.			trans	77.5	145.4	-173.9	0	0	0	0	0	111.9	I382 D388 V389	I382-G386 PolarHBondContact O-N 3.43Å; G386-D388 PolarHBondContact O-N 3.33Å; G386-D388 VanDerWaalsContact O-N 3.1Å; G386-V389 PolarHBondContact O-N 3.14Å
387	R	57.9	Low	74.2	Confident	239 Å²	239	88.9 Å²	88.9	90%	0.902	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.1	-174.7	-79.4	-177.2	173	174.1	-2	114.2
388	D	53.5	Low	74.4	Confident	165 Å²	165	90.4 Å²	90.4	88%	0.882	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.1	-176	-66.2	-33	0	0	0	114.2	G386 A390	G386-D388 PolarHBondContact O-N 3.33Å; G386-D388 VanDerWaalsContact O-N 3.1Å; D388-A390 PolarHBondContact O-N 3.16Å
389	V	58.5	Low	74.8	Confident	91 Å²	91	89.5 Å²	89.5	55%	0.552	45%	0.449	S	S	*	.	S	Bend	trans	-86.8	108.7	177.9	-176.6	0	0	0	0	109	H385 G386 L391	H385-V389 HydrophobicContact CB-CB 4.48Å; H385-V389 VanDerWaalsContact O-CG2 3.24Å; H385-V389 WeakPolarHBondContact O-CG2 3.24Å; G386-V389 PolarHBondContact O-N 3.14Å; V389-L391 PolarHBondContact O-N 3.37Å; V389-L391 VanDerWaalsContact O-N 3.17Å
390	A	62	Low	75.2	Confident	63 Å²	63	84.6 Å²	84.6	52%	0.521	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-56.6	120.8	174.9	0	0	0	0	0	110.3	D388	D388-A390 PolarHBondContact O-N 3.16Å
391	L	68.7	Low	75.6	Confident	42 Å²	42	84.5 Å²	84.5	22%	0.22	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-49.9	142.1	173.1	-71.8	170.4	0	0	0	110.8	I382 V389 E395	I382-L391 HydrophobicContact CG1-CD2 4.18Å; V389-L391 PolarHBondContact O-N 3.37Å; V389-L391 VanDerWaalsContact O-N 3.17Å; L391-E395 HydrophobicContact CB-CB 4.39Å; L391-E395 HydrophobicContact CD2-CB 4.21Å
392	N	79.4	Confident	76.2	Confident	79 Å²	79	79.3 Å²	79.3	42%	0.422	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-68.9	165.7	176.1	75.8	39.9	0	0	0	110.5	E394 E395 T396	N392-E394 VanDerWaalsContact C-N 3.3Å; N392-E394 PolarHBondContact O-N 3.05Å; N392-E394 PolarHBondContact OD1-N 3.32Å; N392-E395 PolarHBondContact N-OE2 3.16Å; N392-E395 PolarHBondContact ND2-OE2 3.41Å; N392-E395 PolarHBondContact O-N 3.44Å; N392-E395 WeakPolarHBondContact OD1-CB 3.5Å; N392-E395 VanDerWaalsContact OD1-CG 3.31Å; N392-E395 WeakPolarHBondContact OD1-CG 3.32Å; N392-E395 PolarHBondContact OD1-N 2.84Å; N392-T396 WeakPolarHBondContact O-CB 3.09Å; N392-T396 PolarHBondContact O-N 3.1Å; N392-T396 PolarHBondContact O-OG1 2.78Å
393	I	80.8	Confident	77	Confident	87 Å²	87	78.1 Å²	78.1	45%	0.446	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-36.7	-174.4	-65.7	173.2	0	0	0	112.1	K397 L486 V553	I393-K397 HydrophobicContact CG2-CD 4.31Å; I393-K397 WeakPolarHBondContact O-CG 3.38Å; I393-K397 PolarHBondContact O-N 2.86Å; I393-L486 HydrophobicContact CD1-CD2 4.45Å; I393-L486 HydrophobicContact CG2-CD2 3.43Å; I393-L486 VanDerWaalsContact CG2-CD2 3.43Å; I393-V553 HydrophobicContact CD1-CG2 4.18Å; I393-V553 HydrophobicContact CG1-CG2 4.48Å
394	E	85.1	Confident	77.6	Confident	158 Å²	158	73.9 Å²	73.9	74%	0.738	38%	0.38	S	S	*	.	H	α-helix	trans	-70.2	-44.3	-179.7	-68.8	-169.1	162.9	0	0	111.8	N392 T396 K397 E398	N392-E394 VanDerWaalsContact C-N 3.3Å; N392-E394 PolarHBondContact O-N 3.05Å; N392-E394 PolarHBondContact OD1-N 3.32Å; E394-T396 VanDerWaalsContact C-N 3.31Å; E394-T396 PolarHBondContact O-N 3.4Å; E394-K397 WeakPolarHBondContact O-CB 3.38Å; E394-K397 PolarHBondContact O-N 2.9Å; E394-E398 PolarHBondContact O-N 3.17Å
395	E	83.9	Confident	78.5	Confident	50 Å²	50	68 Å²	68	23%	0.234	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-39.3	175.4	-71.2	170.5	161.6	0	0	111.2	L391 N392 E398 L399	L391-E395 HydrophobicContact CB-CB 4.39Å; L391-E395 HydrophobicContact CD2-CB 4.21Å; N392-E395 PolarHBondContact N-OE2 3.16Å; N392-E395 PolarHBondContact ND2-OE2 3.41Å; N392-E395 PolarHBondContact O-N 3.44Å; N392-E395 WeakPolarHBondContact OD1-CB 3.5Å; N392-E395 VanDerWaalsContact OD1-CG 3.31Å; N392-E395 WeakPolarHBondContact OD1-CG 3.32Å; N392-E395 PolarHBondContact OD1-N 2.84Å; E395-E398 PolarHBondContact O-N 3.18Å; E395-L399 WeakPolarHBondContact O-CB 3.3Å; E395-L399 PolarHBondContact O-N 2.99Å
396	T	85.8	Confident	79.5	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-41.6	175.9	-51.8	0	0	0	0	111.1	N392 E394 T400 S479 R482 T483	N392-T396 WeakPolarHBondContact O-CB 3.09Å; N392-T396 PolarHBondContact O-N 3.1Å; N392-T396 PolarHBondContact O-OG1 2.78Å; E394-T396 VanDerWaalsContact C-N 3.31Å; E394-T396 PolarHBondContact O-N 3.4Å; T396-T400 PolarHBondContact O-N 3.44Å; T396-T400 VanDerWaalsContact O-N 3.1Å; T396-T400 PolarHBondContact O-OG1 3.38Å; T396-S479 WeakPolarHBondContact CG2-O 3.42Å; T396-R482 HydrophobicContact CG2-CB 3.78Å; T396-T483 PolarHBondContact O-OG1 3.26Å
397	K	89.2	Confident	80.8	Confident	66 Å²	66	61.1 Å²	61.1	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-44.8	173.6	-76.5	176.9	178.8	-180	0	111.2	I393 E394 L399 T400 D401 T483	I393-K397 HydrophobicContact CG2-CD 4.31Å; I393-K397 WeakPolarHBondContact O-CG 3.38Å; I393-K397 PolarHBondContact O-N 2.86Å; E394-K397 WeakPolarHBondContact O-CB 3.38Å; E394-K397 PolarHBondContact O-N 2.9Å; K397-L399 VanDerWaalsContact C-N 3.34Å; K397-L399 PolarHBondContact O-N 3.04Å; K397-T400 WeakPolarHBondContact O-CB 3.44Å; K397-T400 PolarHBondContact O-N 3.01Å; K397-D401 PolarHBondContact O-N 3.44Å; K397-T483 HydrophobicContact CG-CG2 3.92Å
398	E	90	Very high	82	Confident	86 Å²	86	50.8 Å²	50.8	40%	0.402	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-41.3	177.5	-172.4	-179.7	-170.6	0	0	111.8	I378 E394 E395 D401 M402	I378-E398 HydrophobicContact CD1-CG 4.22Å; E394-E398 PolarHBondContact O-N 3.17Å; E395-E398 PolarHBondContact O-N 3.18Å; E398-D401 PolarHBondContact O-N 3.4Å; E398-M402 WeakPolarHBondContact O-CB 3.32Å; E398-M402 WeakPolarHBondContact O-CG 3.41Å; E398-M402 PolarHBondContact O-N 3.31Å
399	L	90.5	Very high	83.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-39.3	176.8	-145.6	87.6	0	0	0	112	I378 I382 E395 K397 M402 A403 M472 D475 F476 S479	I378-L399 HydrophobicContact CB-CD1 4.4Å; I378-L399 HydrophobicContact CG2-CD1 3.3Å; I382-L399 HydrophobicContact CD1-CD1 4.01Å; E395-L399 WeakPolarHBondContact O-CB 3.3Å; E395-L399 PolarHBondContact O-N 2.99Å; K397-L399 VanDerWaalsContact C-N 3.34Å; K397-L399 PolarHBondContact O-N 3.04Å; L399-M402 WeakPolarHBondContact O-CB 3.44Å; L399-M402 PolarHBondContact O-N 3.5Å; L399-A403 PolarHBondContact O-N 3.31Å; L399-M472 HydrophobicContact CD1-CE 4.24Å; L399-D475 VanDerWaalsContact CD2-C 3.48Å; L399-D475 HydrophobicContact CD2-CB 3.87Å; L399-D475 VanDerWaalsContact CD2-O 3.27Å; L399-D475 WeakPolarHBondContact CD2-O 3.23Å; L399-F476 HydrophobicContact CD2-CD1 3.85Å; L399-F476 HydrophobicContact CD2-CE1 4.38Å; L399-F476 HydrophobicContact CG-CD1 3.82Å; L399-F476 HydrophobicContact CG-CE1 3.96Å; L399-S479 WeakPolarHBondContact CD2-OG 3.47Å
400	T	90.9	Very high	84.8	Confident	7 Å²	7	39 Å²	39	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-42.2	175.1	-60.7	0	0	0	0	111.3	T396 K397 M402 A403 L404 S479 I480 T483 L608	T396-T400 PolarHBondContact O-N 3.44Å; T396-T400 VanDerWaalsContact O-N 3.1Å; T396-T400 PolarHBondContact O-OG1 3.38Å; K397-T400 WeakPolarHBondContact O-CB 3.44Å; K397-T400 PolarHBondContact O-N 3.01Å; T400-M402 VanDerWaalsContact C-N 3.34Å; T400-A403 WeakPolarHBondContact O-CB 3.3Å; T400-A403 PolarHBondContact O-N 2.97Å; T400-L404 PolarHBondContact O-N 3.48Å; T400-S479 PolarHBondContact OG1-O 2.9Å; T400-I480 HydrophobicContact CG2-CG1 4.08Å; T400-I480 PolarHBondContact OG1-N 3.43Å; T400-T483 HydrophobicContact CG2-CG2 4.07Å; T400-T483 WeakPolarHBondContact OG1-CB 3.32Å; T400-T483 PolarHBondContact OG1-OG1 2.89Å; T400-L608 HydrophobicContact CG2-CD1 4.22Å
401	D	90	Very high	85.6	Confident	91 Å²	91	36 Å²	36	49%	0.487	18%	0.178	S	C	.	.	H	α-helix	trans	-67.2	-35.5	175.7	-73.8	-19.8	0	0	0	111.8	K397 E398 L404 Q405	K397-D401 PolarHBondContact O-N 3.44Å; E398-D401 PolarHBondContact O-N 3.4Å; D401-L404 PolarHBondContact O-N 3.01Å; D401-Q405 VanDerWaalsContact O-CB 3.29Å; D401-Q405 WeakPolarHBondContact O-CB 3.26Å; D401-Q405 PolarHBondContact O-N 2.81Å
402	M	90.9	Very high	86.1	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-43.9	171.5	-84.1	-72	-67.1	0	0	112.3	F371 R374 L375 I378 E398 L399 T400 L404 Q405 G406 F476	F371-M402 HydrophobicContact CD2-CE 3.95Å; F371-M402 HydrophobicContact CD2-SD 4.16Å; F371-M402 HydrophobicContact CE1-CE 4.14Å; F371-M402 HydrophobicContact CE2-CE 3.51Å; F371-M402 WeakPolarHBondContact CE2-O 3.38Å; F371-M402 HydrophobicContact CE2-SD 3.77Å; F371-M402 HydrophobicContact CG-CE 4.44Å; F371-M402 HydrophobicContact CZ-CE 3.62Å; F371-M402 WeakPolarHBondContact CZ-O 3.43Å; F371-M402 HydrophobicContact CZ-SD 4.41Å; R374-M402 HydrophobicContact CB-CE 4.11Å; R374-M402 HydrophobicContact CB-SD 4.2Å; R374-M402 VanDerWaalsContact CZ-SD 3.6Å; R374-M402 PolarHBondContact NH2-SD 2.86Å; L375-M402 HydrophobicContact CB-CE 3.64Å; L375-M402 HydrophobicContact CD1-CE 3.78Å; L375-M402 HydrophobicContact CG-CE 4.33Å; I378-M402 HydrophobicContact CD1-CG 3.83Å; E398-M402 WeakPolarHBondContact O-CB 3.32Å; E398-M402 WeakPolarHBondContact O-CG 3.41Å; E398-M402 PolarHBondContact O-N 3.31Å; L399-M402 WeakPolarHBondContact O-CB 3.44Å; L399-M402 PolarHBondContact O-N 3.5Å; T400-M402 VanDerWaalsContact C-N 3.34Å; M402-L404 VanDerWaalsContact C-N 3.31Å; M402-L404 PolarHBondContact O-N 3Å; M402-Q405 PolarHBondContact O-N 2.92Å; M402-G406 PolarHBondContact O-N 3.42Å; M402-F476 HydrophobicContact CB-CE1 4.27Å
403	A	91	Very high	86.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-46.5	175.8	0	0	0	0	0	110.8	L399 T400 G406 L407 F476 I480 L608 F611	L399-A403 PolarHBondContact O-N 3.31Å; T400-A403 WeakPolarHBondContact O-CB 3.3Å; T400-A403 PolarHBondContact O-N 2.97Å; A403-G406 PolarHBondContact O-N 2.62Å; A403-L407 WeakPolarHBondContact O-CG 3.44Å; A403-L407 PolarHBondContact O-N 3.26Å; A403-L407 VanDerWaalsContact O-N 3.16Å; A403-F476 HydrophobicContact CB-CB 4.26Å; A403-F476 HydrophobicContact CB-CD1 3.61Å; A403-F476 HydrophobicContact CB-CE1 3.99Å; A403-F476 HydrophobicContact CB-CG 3.93Å; A403-I480 HydrophobicContact CB-CD1 3.99Å; A403-I480 HydrophobicContact CB-CG1 4.46Å; A403-L608 HydrophobicContact CB-CD2 4.22Å; A403-F611 HydrophobicContact CB-CD2 4.33Å; A403-F611 HydrophobicContact CB-CE2 3.89Å
404	L	88	Confident	86.5	Confident	28 Å²	28	27.6 Å²	27.6	15%	0.147	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-50.4	174.8	-171.1	78.4	0	0	0	110.8	L307 T400 D401 M402 G406 L407 Q408 F604 L608	L307-L404 HydrophobicContact CB-CD1 4.26Å; L307-L404 HydrophobicContact CD1-CB 4.27Å; L307-L404 HydrophobicContact CD1-CD1 3.33Å; L307-L404 HydrophobicContact CD1-CG 3.78Å; L307-L404 WeakPolarHBondContact CD1-O 3.12Å; L307-L404 HydrophobicContact CD2-CD1 3.49Å; L307-L404 VanDerWaalsContact CD2-CD1 3.49Å; L307-L404 HydrophobicContact CG-CD1 3.88Å; T400-L404 PolarHBondContact O-N 3.48Å; D401-L404 PolarHBondContact O-N 3.01Å; M402-L404 VanDerWaalsContact C-N 3.31Å; M402-L404 PolarHBondContact O-N 3Å; L404-G406 VanDerWaalsContact C-N 3.31Å; L404-G406 PolarHBondContact O-N 3.06Å; L404-L407 PolarHBondContact O-N 3.37Å; L404-Q408 WeakPolarHBondContact O-CB 3.15Å; L404-Q408 WeakPolarHBondContact O-CG 3.45Å; L404-Q408 PolarHBondContact O-N 3.41Å; L404-F604 HydrophobicContact CD1-CB 3.51Å; L404-F604 HydrophobicContact CD1-CD1 4.15Å; L404-F604 HydrophobicContact CD1-CD2 4.41Å; L404-F604 HydrophobicContact CD1-CG 3.78Å; L404-L608 HydrophobicContact CB-CD2 4.11Å; L404-L608 HydrophobicContact CD1-CD1 3.94Å; L404-L608 HydrophobicContact CD1-CD2 4.1Å; L404-L608 HydrophobicContact CD1-CG 4.04Å
405	Q	88	Confident	86.2	Confident	24 Å²	24	20.4 Å²	20.4	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-62.3	-37.6	-178.7	-174.3	-177.1	-11	0	0	112.4	F371 D401 M402 Q408 L409	F371-Q405 HydrophobicContact CD2-CG 4.22Å; F371-Q405 HydrophobicContact CE2-CB 4.14Å; F371-Q405 HydrophobicContact CE2-CG 4.25Å; D401-Q405 VanDerWaalsContact O-CB 3.29Å; D401-Q405 WeakPolarHBondContact O-CB 3.26Å; D401-Q405 PolarHBondContact O-N 2.81Å; M402-Q405 PolarHBondContact O-N 2.92Å; Q405-Q408 WeakPolarHBondContact O-CB 3.35Å; Q405-Q408 PolarHBondContact O-N 3.4Å; Q405-L409 HydrophobicContact CG-CD1 4.38Å; Q405-L409 WeakPolarHBondContact O-CG 3.49Å; Q405-L409 PolarHBondContact O-N 2.7Å
406	G	88.3	Confident	86.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-49.5	-179.9	0	0	0	0	0	112.4	M402 A403 L404 Q408 L409 L410 M469	M402-G406 PolarHBondContact O-N 3.42Å; A403-G406 PolarHBondContact O-N 2.62Å; L404-G406 VanDerWaalsContact C-N 3.31Å; L404-G406 PolarHBondContact O-N 3.06Å; G406-Q408 PolarHBondContact O-N 3.33Å; G406-L409 PolarHBondContact O-N 3.05Å; G406-L409 VanDerWaalsContact O-N 3.15Å; G406-L410 WeakPolarHBondContact O-CG 3.34Å; G406-L410 PolarHBondContact O-N 2.87Å; G406-M469 WeakPolarHBondContact CA-SD 3.17Å
407	L	85	Confident	86	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.3	-36.9	171.6	-74.7	177.7	0	0	0	111.2	L307 A403 L404 S411 M469 L608 F611 L615 C618	L307-L407 HydrophobicContact CD1-CB 3.18Å; L307-L407 HydrophobicContact CD1-CD1 3.89Å; L307-L407 HydrophobicContact CD1-CG 4.18Å; L307-L407 HydrophobicContact CD2-CD1 4.32Å; L307-L407 HydrophobicContact CG-CB 3.9Å; L307-L407 HydrophobicContact CG-CD1 4.26Å; A403-L407 WeakPolarHBondContact O-CG 3.44Å; A403-L407 PolarHBondContact O-N 3.26Å; A403-L407 VanDerWaalsContact O-N 3.16Å; L404-L407 PolarHBondContact O-N 3.37Å; L407-S411 WeakPolarHBondContact O-CB 3.19Å; L407-S411 PolarHBondContact O-N 3.43Å; L407-M469 HydrophobicContact CG-CE 4.2Å; L407-L608 HydrophobicContact CD1-CD2 4.42Å; L407-F611 HydrophobicContact CD1-CD2 3.75Å; L407-F611 HydrophobicContact CD1-CE2 3.91Å; L407-F611 HydrophobicContact CD2-CE2 4.29Å; L407-F611 HydrophobicContact CG-CD2 4.25Å; L407-F611 HydrophobicContact CG-CE2 3.91Å; L407-L615 VanDerWaalsContact CD2-CA 3.5Å; L407-L615 HydrophobicContact CD2-CB 3.97Å; L407-L615 HydrophobicContact CD2-CD1 3.92Å; L407-C618 HydrophobicContact CD2-CB 4.36Å
408	Q	82.5	Confident	85.7	Confident	22 Å²	22	16.1 Å²	16.1	10%	0.103	9%	0.086	C	C	.	.	H	α-helix	trans	-63.9	-41.9	176.7	-75.5	174.8	-6	0	0	113.3	G305 R306 L307 L404 Q405 G406 S412	G305-Q408 VanDerWaalsContact C-CD 3.4Å; R306-Q408 VanDerWaalsContact N-CG 3.3Å; R306-Q408 VanDerWaalsContact O-CA 3.24Å; R306-Q408 WeakPolarHBondContact O-CA 3.17Å; L307-Q408 HydrophobicContact CB-CG 3.75Å; L307-Q408 HydrophobicContact CD1-CG 3.64Å; L307-Q408 HydrophobicContact CG-CG 4.35Å; L307-Q408 VanDerWaalsContact N-CG 3.31Å; L404-Q408 WeakPolarHBondContact O-CB 3.15Å; L404-Q408 WeakPolarHBondContact O-CG 3.45Å; L404-Q408 PolarHBondContact O-N 3.41Å; Q405-Q408 WeakPolarHBondContact O-CB 3.35Å; Q405-Q408 PolarHBondContact O-N 3.4Å; G406-Q408 PolarHBondContact O-N 3.33Å; Q408-S412 WeakPolarHBondContact O-CB 3.21Å; Q408-S412 PolarHBondContact O-N 3.4Å; Q408-S412 VanDerWaalsContact O-N 3.09Å
409	L	84.6	Confident	85.2	Confident	8 Å²	8	12.5 Å²	12.5	4%	0.042	7%	0.069	C	C	.	.	H	α-helix	trans	-67.9	-50.9	178.1	-73.3	170.8	0	0	0	110.5	E367 F371 Q405 G406 S411 S412 W413	E367-L409 HydrophobicContact CB-CD2 4.02Å; E367-L409 HydrophobicContact CG-CD2 4.23Å; F371-L409 HydrophobicContact CB-CD1 3.81Å; F371-L409 HydrophobicContact CD2-CD1 3.76Å; F371-L409 HydrophobicContact CG-CD1 3.84Å; Q405-L409 HydrophobicContact CG-CD1 4.38Å; Q405-L409 WeakPolarHBondContact O-CG 3.49Å; Q405-L409 PolarHBondContact O-N 2.7Å; G406-L409 PolarHBondContact O-N 3.05Å; G406-L409 VanDerWaalsContact O-N 3.15Å; L409-S411 PolarHBondContact O-N 3.38Å; L409-S412 WeakPolarHBondContact O-CA 3.16Å; L409-S412 VanDerWaalsContact O-CB 3.27Å; L409-S412 WeakPolarHBondContact O-CB 3.5Å; L409-S412 PolarHBondContact O-N 2.74Å; L409-W413 HydrophobicContact CB-CZ2 4.1Å; L409-W413 HydrophobicContact CD2-CZ2 4.36Å; L409-W413 VanDerWaalsContact O-CD1 3.29Å; L409-W413 PolarHBondContact O-N 3.33Å
410	L	85.3	Confident	85	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-55.2	-51.2	178.8	-72.6	170.7	0	0	0	111.4	G406 S412 W413 T414 I462 L465 M469 L615 C618	G406-L410 WeakPolarHBondContact O-CG 3.34Å; G406-L410 PolarHBondContact O-N 2.87Å; L410-S412 VanDerWaalsContact C-N 3.27Å; L410-S412 PolarHBondContact O-N 3.45Å; L410-W413 HydrophobicContact CD2-CE3 4.41Å; L410-W413 PolarHBondContact O-N 3.38Å; L410-T414 WeakPolarHBondContact O-CB 3.36Å; L410-T414 PolarHBondContact O-N 2.85Å; L410-T414 PolarHBondContact O-OG1 3.29Å; L410-I462 HydrophobicContact CD2-CG2 4.16Å; L410-I462 WeakPolarHBondContact CD2-O 3.4Å; L410-L465 HydrophobicContact CD1-CG 4.39Å; L410-L465 HydrophobicContact CD2-CB 3.8Å; L410-L465 HydrophobicContact CD2-CD2 3.78Å; L410-L465 HydrophobicContact CD2-CG 3.83Å; L410-L465 HydrophobicContact CG-CD2 3.9Å; L410-L465 HydrophobicContact CG-CG 4.14Å; L410-M469 HydrophobicContact CD1-SD 3.57Å; L410-M469 VanDerWaalsContact CD1-SD 3.57Å; L410-M469 HydrophobicContact CG-SD 4.48Å; L410-L615 HydrophobicContact CD1-CD1 3.51Å; L410-C618 CarbonylContact C-O 3.32Å; L410-C618 HydrophobicContact CB-CB 4.04Å
411	S	80.8	Confident	84.9	Confident	2 Å²	2	12.7 Å²	12.7	1%	0.014	7%	0.069	C	C	.	.	H	α-helix	trans	-59.5	-36.6	176.6	-175.5	0	0	0	0	112.6	R306 C309 L407 L409 S415	R306-S411 WeakPolarHBondContact O-CB 3.49Å; R306-S411 PolarHBondContact O-OG 3.04Å; C309-S411 WeakPolarHBondContact CA-OG 3.43Å; C309-S411 WeakPolarHBondContact CB-OG 3.26Å; C309-S411 PolarHBondContact N-OG 3.48Å; C309-S411 PolarHBondContact SG-OG 2.97Å; L407-S411 WeakPolarHBondContact O-CB 3.19Å; L407-S411 PolarHBondContact O-N 3.43Å; L409-S411 PolarHBondContact O-N 3.38Å; S411-S415 WeakPolarHBondContact O-CB 3.32Å; S411-S415 PolarHBondContact O-N 2.8Å; S411-S415 VanDerWaalsContact O-N 3.12Å; S411-S415 PolarHBondContact O-OG 3.37Å
412	S	79.2	Confident	84.7	Confident	20 Å²	20	8.3 Å²	8.3	14%	0.14	5%	0.046	C	C	.	.	H	α-helix	trans	-65.1	-46.9	176.3	-171	0	0	0	0	112	R306 Q408 L409 L410 C416	R306-S412 WeakPolarHBondContact CD-OG 3.33Å; R306-S412 PolarHBondContact NH1-OG 3.07Å; Q408-S412 WeakPolarHBondContact O-CB 3.21Å; Q408-S412 PolarHBondContact O-N 3.4Å; Q408-S412 VanDerWaalsContact O-N 3.09Å; L409-S412 WeakPolarHBondContact O-CA 3.16Å; L409-S412 VanDerWaalsContact O-CB 3.27Å; L409-S412 WeakPolarHBondContact O-CB 3.5Å; L409-S412 PolarHBondContact O-N 2.74Å; L410-S412 VanDerWaalsContact C-N 3.27Å; L410-S412 PolarHBondContact O-N 3.45Å; S412-C416 PolarHBondContact O-N 3.02Å; S412-C416 VanDerWaalsContact O-N 3.15Å
413	W	84.6	Confident	84.5	Confident	1 Å²	1	9.4 Å²	9.4	0%	0.004	5%	0.05	C	C	.	.	H	α-helix	trans	-68.1	-46	-177.7	-57.3	-12.4	0	0	0	111	F364 E367 H368 L409 L410 S415 C416 V417 M461 I462 L465	F364-W413 AromaticContact CD1-CD1 3.24Å; F364-W413 HydrophobicContact CD1-CG 4.08Å; F364-W413 AromaticContact CD1-NE1 3.37Å; F364-W413 HydrophobicContact CD2-CB 4.41Å; F364-W413 HydrophobicContact CD2-CG 4.18Å; F364-W413 AromaticContact CE1-CD1 3.36Å; F364-W413 HydrophobicContact CE1-CG 4.23Å; F364-W413 AromaticContact CE1-NE1 3.93Å; F364-W413 HydrophobicContact CE2-CB 4.22Å; F364-W413 HydrophobicContact CE2-CG 4.32Å; F364-W413 AromaticContact CG-CD1 3.65Å; F364-W413 HydrophobicContact CG-CD2 4.42Å; F364-W413 HydrophobicContact CG-CG 4.06Å; F364-W413 AromaticContact CG-NE1 3.78Å; F364-W413 HydrophobicContact CZ-CB 4.38Å; F364-W413 AromaticContact CZ-CD1 3.84Å; F364-W413 HydrophobicContact CZ-CG 4.34Å; E367-W413 HydrophobicContact CB-CZ2 3.98Å; E367-W413 PolarHBondContact OE2-NE1 3.33Å; H368-W413 HydrophobicContact CB-CH2 3.64Å; H368-W413 HydrophobicContact CB-CZ2 4.21Å; H368-W413 HydrophobicContact CB-CZ3 4.5Å; H368-W413 AromaticContact CD2-CH2 3.95Å; L409-W413 HydrophobicContact CB-CZ2 4.1Å; L409-W413 HydrophobicContact CD2-CZ2 4.36Å; L409-W413 VanDerWaalsContact O-CD1 3.29Å; L409-W413 PolarHBondContact O-N 3.33Å; L410-W413 HydrophobicContact CD2-CE3 4.41Å; L410-W413 PolarHBondContact O-N 3.38Å; W413-S415 PolarHBondContact O-N 3.37Å; W413-C416 WeakPolarHBondContact O-CB 3.25Å; W413-C416 PolarHBondContact O-N 3.07Å; W413-V417 PolarHBondContact O-N 2.83Å; W413-V417 VanDerWaalsContact O-N 3.1Å; W413-M461 HydrophobicContact CE3-CB 4.48Å; W413-M461 HydrophobicContact CZ3-CB 4.23Å; W413-I462 HydrophobicContact CB-CD1 3.98Å; W413-I462 HydrophobicContact CB-CG1 3.83Å; W413-I462 HydrophobicContact CE3-CG1 4.2Å; W413-L465 HydrophobicContact CE3-CD2 4.5Å; W413-L465 HydrophobicContact CH2-CD2 3.61Å; W413-L465 HydrophobicContact CZ3-CB 4.12Å; W413-L465 HydrophobicContact CZ3-CD2 3.56Å; W413-L465 HydrophobicContact CZ3-CG 4.48Å
414	T	83.7	Confident	84.5	Confident	10 Å²	10	10 Å²	10	6%	0.061	5%	0.053	C	C	.	.	H	α-helix	trans	-59	-46.8	176.9	-59.5	0	0	0	0	111.3	L410 C416 V417 V418 I462 C618 L621	L410-T414 WeakPolarHBondContact O-CB 3.36Å; L410-T414 PolarHBondContact O-N 2.85Å; L410-T414 PolarHBondContact O-OG1 3.29Å; T414-C416 VanDerWaalsContact C-N 3.31Å; T414-C416 PolarHBondContact O-N 3.49Å; T414-V417 PolarHBondContact O-N 3.45Å; T414-V418 HydrophobicContact CG2-CG2 4.34Å; T414-V418 WeakPolarHBondContact O-CG2 3.24Å; T414-V418 PolarHBondContact O-N 2.88Å; T414-I462 WeakPolarHBondContact OG1-CG2 3.5Å; T414-C618 VanDerWaalsContact CB-O 3.31Å; T414-C618 WeakPolarHBondContact CB-O 3.4Å; T414-C618 PolarHBondContact OG1-O 2.87Å; T414-L621 HydrophobicContact CG2-CD2 3.92Å
415	S	77.9	Confident	84.7	Confident	6 Å²	6	8.6 Å²	8.6	4%	0.042	5%	0.046	C	C	.	.	H	α-helix	trans	-60.5	-41.1	176.2	-62.2	0	0	0	0	112.6	C309 S411 W413 V417 V418 E419	C309-S415 WeakPolarHBondContact CB-OG 3.24Å; C309-S415 PolarHBondContact SG-OG 3.44Å; S411-S415 WeakPolarHBondContact O-CB 3.32Å; S411-S415 PolarHBondContact O-N 2.8Å; S411-S415 VanDerWaalsContact O-N 3.12Å; S411-S415 PolarHBondContact O-OG 3.37Å; W413-S415 PolarHBondContact O-N 3.37Å; S415-V417 VanDerWaalsContact C-N 3.29Å; S415-V417 PolarHBondContact O-N 2.8Å; S415-V418 PolarHBondContact O-N 2.6Å; S415-E419 WeakPolarHBondContact O-CB 3.28Å; S415-E419 WeakPolarHBondContact O-CG 3.45Å; S415-E419 PolarHBondContact O-N 3.39Å
416	C	81.3	Confident	84.7	Confident	7 Å²	7	10.1 Å²	10.1	5%	0.047	5%	0.054	C	C	.	.	H	α-helix	trans	-60.3	-41.1	178.1	-168.3	0	0	0	0	111.8	I355 I357 F364 S412 W413 T414 V420	I355-C416 WeakPolarHBondContact CG2-SG 3.37Å; I357-C416 HydrophobicContact CD1-CB 4.33Å; I357-C416 WeakPolarHBondContact CD1-SG 3.35Å; F364-C416 HydrophobicContact CE2-CB 4.32Å; F364-C416 HydrophobicContact CZ-CB 3.77Å; S412-C416 PolarHBondContact O-N 3.02Å; S412-C416 VanDerWaalsContact O-N 3.15Å; W413-C416 WeakPolarHBondContact O-CB 3.25Å; W413-C416 PolarHBondContact O-N 3.07Å; T414-C416 VanDerWaalsContact C-N 3.31Å; T414-C416 PolarHBondContact O-N 3.49Å; C416-V420 WeakPolarHBondContact O-CG2 3.29Å; C416-V420 PolarHBondContact O-N 3.21Å
417	V	85.4	Confident	84.8	Confident	16 Å²	16	12.5 Å²	12.5	10%	0.097	7%	0.065	C	C	.	.	H	α-helix	trans	-65.1	-50.4	175.5	171.1	0	0	0	0	111.2	W413 T414 S415 E419 V420 Y421 I459 I462 L621	W413-V417 PolarHBondContact O-N 2.83Å; W413-V417 VanDerWaalsContact O-N 3.1Å; T414-V417 PolarHBondContact O-N 3.45Å; S415-V417 VanDerWaalsContact C-N 3.29Å; S415-V417 PolarHBondContact O-N 2.8Å; V417-E419 VanDerWaalsContact C-N 3.35Å; V417-E419 PolarHBondContact O-N 2.75Å; V417-V420 PolarHBondContact O-N 3.35Å; V417-Y421 WeakPolarHBondContact O-CB 3.36Å; V417-Y421 PolarHBondContact O-N 3.16Å; V417-I459 HydrophobicContact CG1-CD1 3.75Å; V417-I459 HydrophobicContact CG1-CG1 4.3Å; V417-I459 HydrophobicContact CG2-CG1 4.37Å; V417-I459 HydrophobicContact CG2-CG2 4.31Å; V417-I462 HydrophobicContact CG2-CD1 4.06Å; V417-L621 HydrophobicContact CB-CD2 4.39Å; V417-L621 HydrophobicContact CG1-CD2 3.94Å
418	V	82.8	Confident	85.1	Confident	9 Å²	9	13.9 Å²	13.9	6%	0.055	7%	0.074	C	C	.	.	H	α-helix	trans	-67.5	-35.9	-176.6	-177.7	0	0	0	0	111.6	P319 T414 S415 Y421 A422 L621	P319-V418 HydrophobicContact CG-CG1 3.76Å; T414-V418 HydrophobicContact CG2-CG2 4.34Å; T414-V418 WeakPolarHBondContact O-CG2 3.24Å; T414-V418 PolarHBondContact O-N 2.88Å; S415-V418 PolarHBondContact O-N 2.6Å; V418-Y421 PolarHBondContact O-N 3.33Å; V418-A422 WeakPolarHBondContact O-CB 3.28Å; V418-A422 PolarHBondContact O-N 2.85Å; V418-L621 HydrophobicContact CG2-CD2 4.15Å
419	E	78.9	Confident	85.6	Confident	11 Å²	11	13.1 Å²	13.1	5%	0.051	7%	0.071	C	C	.	.	H	α-helix	trans	-66.3	-41.3	176.9	-74.6	167.1	-173	0	0	111.6	Q313 Q314 H315 I355 S415 V417 A422 W423	Q313-E419 HydrophobicContact CB-CG 4.18Å; Q314-E419 PolarHBondContact N-OE1 3.41Å; H315-E419 IonicContact CD2-OE2 2.8Å; I355-E419 HydrophobicContact CD1-CB 3.74Å; I355-E419 VanDerWaalsContact CD1-OE2 3.24Å; I355-E419 WeakPolarHBondContact CD1-OE2 3.34Å; S415-E419 WeakPolarHBondContact O-CB 3.28Å; S415-E419 WeakPolarHBondContact O-CG 3.45Å; S415-E419 PolarHBondContact O-N 3.39Å; V417-E419 VanDerWaalsContact C-N 3.35Å; V417-E419 PolarHBondContact O-N 2.75Å; E419-A422 PolarHBondContact O-N 3.42Å; E419-W423 WeakPolarHBondContact O-CB 3.21Å; E419-W423 PolarHBondContact O-N 2.82Å
420	V	85.3	Confident	85.9	Confident	6 Å²	6	14.9 Å²	14.9	4%	0.036	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-45.2	174	170.7	0	0	0	0	110.3	I355 I357 C416 V417 W423 K424 Y452	I355-V420 HydrophobicContact CB-CG2 3.77Å; I355-V420 HydrophobicContact CD1-CG2 4.44Å; I355-V420 HydrophobicContact CG2-CG2 3.57Å; I357-V420 HydrophobicContact CB-CG2 4.22Å; C416-V420 WeakPolarHBondContact O-CG2 3.29Å; C416-V420 PolarHBondContact O-N 3.21Å; V417-V420 PolarHBondContact O-N 3.35Å; V420-W423 PolarHBondContact O-N 2.52Å; V420-K424 HydrophobicContact CG1-CD 4.49Å; V420-K424 WeakPolarHBondContact O-CB 3.21Å; V420-K424 WeakPolarHBondContact O-CG 3.42Å; V420-K424 PolarHBondContact O-N 3.33Å; V420-Y452 HydrophobicContact CG1-CE1 4.44Å
421	Y	88.7	Confident	86.1	Confident	5 Å²	5	17.2 Å²	17.2	2%	0.02	10%	0.096	C	C	.	.	H	α-helix	trans	-58.9	-49.9	176.2	176.2	-105.3	0	0	0	111.8	V417 V418 W423 K424 L425 Y452 L624 M647	V417-Y421 WeakPolarHBondContact O-CB 3.36Å; V417-Y421 PolarHBondContact O-N 3.16Å; V418-Y421 PolarHBondContact O-N 3.33Å; Y421-W423 PolarHBondContact O-N 3.14Å; Y421-K424 PolarHBondContact O-N 3.06Å; Y421-L425 HydrophobicContact CD1-CD1 4.01Å; Y421-L425 HydrophobicContact CD1-CG 4.45Å; Y421-L425 HydrophobicContact CE1-CD1 3.38Å; Y421-L425 HydrophobicContact CE1-CG 4.08Å; Y421-L425 HydrophobicContact CE2-CD1 4.29Å; Y421-L425 HydrophobicContact CE2-CD2 4.18Å; Y421-L425 HydrophobicContact CE2-CG 4.18Å; Y421-L425 WeakPolarHBondContact O-CG 2.65Å; Y421-L425 PolarHBondContact O-N 3.3Å; Y421-Y452 WeakPolarHBondContact CA-OH 3.39Å; Y421-Y452 VanDerWaalsContact CD2-OH 3.3Å; Y421-Y452 WeakPolarHBondContact CD2-OH 3.46Å; Y421-L624 HydrophobicContact CD1-CD2 3.81Å; Y421-L624 HydrophobicContact CD2-CD2 3.56Å; Y421-L624 HydrophobicContact CE1-CD2 4.21Å; Y421-L624 HydrophobicContact CE2-CD2 4.03Å; Y421-L624 HydrophobicContact CG-CD2 3.45Å; Y421-L624 VanDerWaalsContact CG-CD2 3.45Å; Y421-M647 HydrophobicContact CD2-CG 4.11Å; Y421-M647 HydrophobicContact CE2-CG 3.54Å; Y421-M647 HydrophobicContact CE2-SD 4.28Å
422	A	86	Confident	86.4	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-57.6	-46.1	177.7	0	0	0	0	0	112.3	V317 P319 Q325 V418 E419 K424 L425 L426	V317-A422 HydrophobicContact CG1-CB 4.08Å; V317-A422 WeakPolarHBondContact CG1-O 3.4Å; P319-A422 HydrophobicContact CG-CB 4.11Å; Q325-A422 HydrophobicContact CG-CB 4.27Å; V418-A422 WeakPolarHBondContact O-CB 3.28Å; V418-A422 PolarHBondContact O-N 2.85Å; E419-A422 PolarHBondContact O-N 3.42Å; A422-K424 PolarHBondContact O-N 2.65Å; A422-L425 PolarHBondContact O-N 3.15Å; A422-L426 PolarHBondContact O-N 3.29Å
423	W	87.4	Confident	86.8	Confident	23 Å²	23	30.9 Å²	30.9	9%	0.087	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-44.4	177.6	-170.7	92.7	0	0	0	111.4	V317 V352 C353 E419 V420 Y421 L425 L426 H427	V317-W423 HydrophobicContact CG2-CG 4.5Å; V352-W423 VanDerWaalsContact C-CZ2 3.47Å; C353-W423 HydrophobicContact CB-CD2 3.81Å; C353-W423 HydrophobicContact CB-CE3 3.55Å; C353-W423 HydrophobicContact CB-CG 4.48Å; C353-W423 HydrophobicContact CB-CH2 4.25Å; C353-W423 HydrophobicContact CB-CZ2 4.45Å; C353-W423 HydrophobicContact CB-CZ3 3.8Å; C353-W423 VanDerWaalsContact N-CH2 3.31Å; E419-W423 WeakPolarHBondContact O-CB 3.21Å; E419-W423 PolarHBondContact O-N 2.82Å; V420-W423 PolarHBondContact O-N 2.52Å; Y421-W423 PolarHBondContact O-N 3.14Å; W423-L425 PolarHBondContact O-N 3.13Å; W423-L426 PolarHBondContact O-N 3.46Å; W423-H427 AromaticContact CD1-CE1 3.89Å; W423-H427 AromaticContact CD1-ND1 3.94Å; W423-H427 HydrophobicContact CD2-CB 4.43Å; W423-H427 AromaticContact CD2-ND1 3.57Å; W423-H427 AromaticContact CE2-CE1 3.66Å; W423-H427 AromaticContact CE2-CG 3.8Å; W423-H427 AromaticContact CE2-ND1 3.41Å; W423-H427 HydrophobicContact CE3-CB 4.07Å; W423-H427 AromaticContact CG-ND1 3.91Å; W423-H427 HydrophobicContact CH2-CB 3.7Å; W423-H427 AromaticContact CH2-CG 3.82Å; W423-H427 HydrophobicContact CZ2-CB 4.09Å; W423-H427 AromaticContact CZ2-CD2 3.89Å; W423-H427 AromaticContact CZ2-CG 3.66Å; W423-H427 AromaticContact CZ2-ND1 3.78Å; W423-H427 HydrophobicContact CZ3-CB 3.69Å; W423-H427 AromaticContact NE1-CE1 3.47Å; W423-H427 PolarHBondContact NE1-CE1 3.24Å; W423-H427 AromaticContact NE1-ND1 3.64Å; W423-H427 PolarHBondContact O-N 3.41Å; W423-H427 PolarHBondContact O-ND1 2.72Å
424	K	90.8	Very high	87	Confident	11 Å²	11	32.7 Å²	32.7	5%	0.048	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-29.4	-179.3	-72.7	-160.1	-175.2	-169.5	0	113.7	V420 Y421 A422 H427 N451 Y452 E456	V420-K424 HydrophobicContact CG1-CD 4.49Å; V420-K424 WeakPolarHBondContact O-CB 3.21Å; V420-K424 WeakPolarHBondContact O-CG 3.42Å; V420-K424 PolarHBondContact O-N 3.33Å; Y421-K424 PolarHBondContact O-N 3.06Å; A422-K424 PolarHBondContact O-N 2.65Å; K424-H427 CarbonylContact O-C 3.5Å; K424-H427 VanDerWaalsContact O-C 3.32Å; K424-H427 PolarHBondContact O-N 2.9Å; K424-N451 WeakPolarHBondContact CB-ND2 3.02Å; K424-N451 HydrophobicContact CD-CB 4.11Å; K424-N451 WeakPolarHBondContact CD-O 3.46Å; K424-N451 WeakPolarHBondContact CE-O 3.27Å; K424-N451 PolarHBondContact NZ-O 2.93Å; K424-N451 PolarHBondContact O-ND2 3.47Å; K424-Y452 HydrophobicContact CD-CD1 4.05Å; K424-Y452 HydrophobicContact CD-CE1 3.71Å; K424-Y452 HydrophobicContact CD-CE2 4.3Å; K424-Y452 HydrophobicContact CD-CG 4.48Å; K424-E456 IonicContact NZ-OE1 2.64Å; K424-E456 PolarHBondContact NZ-OE1 3.21Å; K424-E456 IonicContact NZ-OE2 3.89Å; K424-E456 PolarHBondContact NZ-OE2 3.33Å
425	L	92.1	Very high	87.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-48.9	169.6	-75.1	-175.6	0	0	0	111.4	D323 Q325 Y421 A422 W423 H427 Y444 A447 T448 Y630	D323-L425 HydrophobicContact CB-CD1 4.23Å; Q325-L425 HydrophobicContact CG-CB 3.97Å; Q325-L425 HydrophobicContact CG-CD1 4.08Å; Y421-L425 HydrophobicContact CD1-CD1 4.01Å; Y421-L425 HydrophobicContact CD1-CG 4.45Å; Y421-L425 HydrophobicContact CE1-CD1 3.38Å; Y421-L425 HydrophobicContact CE1-CG 4.08Å; Y421-L425 HydrophobicContact CE2-CD1 4.29Å; Y421-L425 HydrophobicContact CE2-CD2 4.18Å; Y421-L425 HydrophobicContact CE2-CG 4.18Å; Y421-L425 WeakPolarHBondContact O-CG 2.65Å; Y421-L425 PolarHBondContact O-N 3.3Å; A422-L425 PolarHBondContact O-N 3.15Å; W423-L425 PolarHBondContact O-N 3.13Å; L425-H427 VanDerWaalsContact C-N 3.28Å; L425-H427 PolarHBondContact O-N 3.13Å; L425-Y444 HydrophobicContact CD2-CD2 4.37Å; L425-Y444 HydrophobicContact CD2-CE2 3.97Å; L425-A447 HydrophobicContact CD2-CB 4.09Å; L425-T448 HydrophobicContact CD2-CG2 4.25Å; L425-Y630 HydrophobicContact CB-CE2 4.29Å; L425-Y630 HydrophobicContact CD1-CE2 4.24Å; L425-Y630 HydrophobicContact CD2-CE2 3.8Å; L425-Y630 HydrophobicContact CG-CE2 4.33Å; L425-Y630 PolarHBondContact O-OH 3.46Å
426	L	88.6	Confident	87.9	Confident	56 Å²	56	49.4 Å²	49.4	29%	0.293	24%	0.237	S	C	.	.	H	α-helix	trans	-72.8	-16.7	178.2	-72.2	-173.2	0	0	0	114.9	V317 Q325 M327 A422 W423 P428	V317-L426 HydrophobicContact CB-CD1 4.22Å; V317-L426 HydrophobicContact CG1-CD1 3.37Å; V317-L426 HydrophobicContact CG1-CG 4Å; V317-L426 HydrophobicContact CG2-CD1 3.84Å; Q325-L426 HydrophobicContact CB-CD1 3.82Å; Q325-L426 HydrophobicContact CB-CD2 3.95Å; Q325-L426 HydrophobicContact CB-CG 3.61Å; Q325-L426 HydrophobicContact CG-CG 4.27Å; M327-L426 HydrophobicContact CG-CD1 3.98Å; A422-L426 PolarHBondContact O-N 3.29Å; W423-L426 PolarHBondContact O-N 3.46Å; L426-P428 VanDerWaalsContact C-CD 3.46Å; L426-P428 WeakPolarHBondContact O-CD 2.82Å
427	H	89.9	Confident	88.4	Confident	50 Å²	50	49.3 Å²	49.3	23%	0.231	24%	0.237	C	C	.	.	S	Bend	trans	-124.7	72	-179.5	-55	83.9	0	0	0	110.6	W423 K424 L425 N451	W423-H427 AromaticContact CD1-CE1 3.89Å; W423-H427 AromaticContact CD1-ND1 3.94Å; W423-H427 HydrophobicContact CD2-CB 4.43Å; W423-H427 AromaticContact CD2-ND1 3.57Å; W423-H427 AromaticContact CE2-CE1 3.66Å; W423-H427 AromaticContact CE2-CG 3.8Å; W423-H427 AromaticContact CE2-ND1 3.41Å; W423-H427 HydrophobicContact CE3-CB 4.07Å; W423-H427 AromaticContact CG-ND1 3.91Å; W423-H427 HydrophobicContact CH2-CB 3.7Å; W423-H427 AromaticContact CH2-CG 3.82Å; W423-H427 HydrophobicContact CZ2-CB 4.09Å; W423-H427 AromaticContact CZ2-CD2 3.89Å; W423-H427 AromaticContact CZ2-CG 3.66Å; W423-H427 AromaticContact CZ2-ND1 3.78Å; W423-H427 HydrophobicContact CZ3-CB 3.69Å; W423-H427 AromaticContact NE1-CE1 3.47Å; W423-H427 PolarHBondContact NE1-CE1 3.24Å; W423-H427 AromaticContact NE1-ND1 3.64Å; W423-H427 PolarHBondContact O-N 3.41Å; W423-H427 PolarHBondContact O-ND1 2.72Å; K424-H427 CarbonylContact O-C 3.5Å; K424-H427 VanDerWaalsContact O-C 3.32Å; K424-H427 PolarHBondContact O-N 2.9Å; L425-H427 VanDerWaalsContact C-N 3.28Å; L425-H427 PolarHBondContact O-N 3.13Å; H427-N451 PolarHBondContact O-ND2 3.15Å
428	P	92	Very high	88.8	Confident	28 Å²	28	50.6 Å²	50.6	18%	0.182	25%	0.246	C	C	.	.			trans	-57.8	143	175.1	-18.1	29.3	0	0	0	110.9	L426 E443 R446 A447	L426-P428 VanDerWaalsContact C-CD 3.46Å; L426-P428 WeakPolarHBondContact O-CD 2.82Å; P428-E443 HydrophobicContact CG-CG 3.87Å; P428-R446 HydrophobicContact CB-CB 3.82Å; P428-A447 HydrophobicContact CB-CB 4.24Å; P428-A447 HydrophobicContact CG-CB 4.23Å
429	T	92.6	Very high	89.1	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.037	28%	0.28	C	S	.	.			trans	-71.5	173.3	175.5	-156.9	0	0	0	0	111.4	Q433 N434 C437 R446	T429-Q433 WeakPolarHBondContact OG1-CB 2.59Å; T429-Q433 PolarHBondContact OG1-OE1 3.45Å; T429-N434 HydrophobicContact CG2-CB 4.14Å; T429-C437 HydrophobicContact CG2-CB 4.15Å; T429-R446 PolarHBondContact N-O 3.2Å; T429-R446 WeakPolarHBondContact O-CD 3.32Å; T429-R446 PolarHBondContact O-NH1 3.42Å
430	D	91.1	Very high	89.8	Confident	46 Å²	46	61 Å²	61	25%	0.246	31%	0.314	C	S	.	.			trans	-140.6	167.7	175.5	66	38.9	0	0	0	110.3	H432 Q433 N434	D430-H432 PolarHBondContact O-N 2.83Å; D430-H432 VanDerWaalsContact O-N 3.12Å; D430-H432 VanDerWaalsContact OD1-CA 3.3Å; D430-H432 WeakPolarHBondContact OD1-CA 2.97Å; D430-H432 VanDerWaalsContact OD1-CB 3.23Å; D430-H432 WeakPolarHBondContact OD1-CB 3.06Å; D430-H432 IonicContact OD1-CD2 2.83Å; D430-H432 IonicContact OD1-CG 3.34Å; D430-H432 PolarHBondContact OD1-N 2.93Å; D430-Q433 PolarHBondContact O-N 2.81Å; D430-Q433 VanDerWaalsContact O-N 3.14Å; D430-Q433 WeakPolarHBondContact OD1-CG 3.29Å; D430-Q433 PolarHBondContact OD1-N 3.07Å; D430-N434 PolarHBondContact O-N 3.22Å
431	P	89	Confident	90.1	Very high	49 Å²	49	61.2 Å²	61.2	32%	0.318	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-18.5	178.9	-24.3	34.3	0	0	0	114.7	N434 C437 A439	P431-N434 WeakPolarHBondContact CA-O 3.04Å; P431-C437 WeakPolarHBondContact CG-O 3.11Å; P431-A439 HydrophobicContact CG-CB 4.16Å
432	H	88	Confident	90.3	Very high	177 Å²	177	63.3 Å²	63.3	82%	0.819	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-36	177.3	-57	-63.8	0	0	0	111.4	D430	D430-H432 PolarHBondContact O-N 2.83Å; D430-H432 VanDerWaalsContact O-N 3.12Å; D430-H432 VanDerWaalsContact OD1-CA 3.3Å; D430-H432 WeakPolarHBondContact OD1-CA 2.97Å; D430-H432 VanDerWaalsContact OD1-CB 3.23Å; D430-H432 WeakPolarHBondContact OD1-CB 3.06Å; D430-H432 IonicContact OD1-CD2 2.83Å; D430-H432 IonicContact OD1-CG 3.34Å; D430-H432 PolarHBondContact OD1-N 2.93Å
433	Q	86.6	Confident	90.7	Very high	131 Å²	131	67.4 Å²	67.4	61%	0.612	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-44.2	177.4	-65.6	176.6	15.5	0	0	112.1	T429 D430	T429-Q433 WeakPolarHBondContact OG1-CB 2.59Å; T429-Q433 PolarHBondContact OG1-OE1 3.45Å; D430-Q433 PolarHBondContact O-N 2.81Å; D430-Q433 VanDerWaalsContact O-N 3.14Å; D430-Q433 WeakPolarHBondContact OD1-CG 3.29Å; D430-Q433 PolarHBondContact OD1-N 3.07Å
434	N	88.9	Confident	91.1	Very high	40 Å²	40	66.4 Å²	66.4	21%	0.214	34%	0.342	C	S	.	.			trans	-123.2	111.2	176.9	-175.8	-2	0	0	0	110.6	T429 D430 P431 D436 C437 Y450	T429-N434 HydrophobicContact CG2-CB 4.14Å; D430-N434 PolarHBondContact O-N 3.22Å; P431-N434 WeakPolarHBondContact CA-O 3.04Å; N434-D436 PolarHBondContact O-N 3.03Å; N434-D436 PolarHBondContact OD1-N 2.93Å; N434-C437 HydrophobicContact CB-CB 4.17Å; N434-C437 WeakPolarHBondContact O-CB 3.46Å; N434-C437 PolarHBondContact O-N 3.27Å; N434-Y450 PolarHBondContact ND2-O 3.09Å
435	R	89.4	Confident	91.3	Very high	235 Å²	235	66.9 Å²	66.9	89%	0.887	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22	-179.6	-65.9	-174.2	178.7	-173.4	-0.6	114	C437	R435-C437 VanDerWaalsContact C-N 3.28Å
436	D	90.2	Very high	91.5	Very high	131 Å²	131	69.9 Å²	69.9	70%	0.701	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-7.9	177.8	-61.4	-30	0	0	0	112.2	N434 P438 Y450	N434-D436 PolarHBondContact O-N 3.03Å; N434-D436 PolarHBondContact OD1-N 2.93Å; D436-P438 WeakPolarHBondContact O-CD 3.33Å; D436-Y450 VanDerWaalsContact O-CE1 3.25Å; D436-Y450 WeakPolarHBondContact O-CE1 3.5Å
437	C	92.1	Very high	91.7	Very high	6 Å²	6	67.2 Å²	67.2	4%	0.041	34%	0.342	C	S	.	.	S	Bend	trans	-80.5	119.8	177.4	-175.6	0	0	0	0	110.8	T429 P431 N434 R435 Y450	T429-C437 HydrophobicContact CG2-CB 4.15Å; P431-C437 WeakPolarHBondContact CG-O 3.11Å; N434-C437 HydrophobicContact CB-CB 4.17Å; N434-C437 WeakPolarHBondContact O-CB 3.46Å; N434-C437 PolarHBondContact O-N 3.27Å; R435-C437 VanDerWaalsContact C-N 3.28Å; C437-Y450 HydrophobicContact CB-CD1 4.42Å; C437-Y450 HydrophobicContact CB-CG 4.12Å
438	P	93.7	Very high	92	Very high	43 Å²	43	64.9 Å²	64.9	28%	0.279	33%	0.331	S	S	.	.			trans	-62.7	150.5	172.2	-19.6	31.7	0	0	0	112.1	D436 D440 A441 Y450	D436-P438 WeakPolarHBondContact O-CD 3.33Å; P438-D440 VanDerWaalsContact C-N 3.29Å; P438-D440 WeakPolarHBondContact CB-OD1 3.13Å; P438-D440 PolarHBondContact O-N 3.34Å; P438-A441 HydrophobicContact CB-CB 4.18Å; P438-A441 HydrophobicContact CG-CB 4.39Å; P438-A441 WeakPolarHBondContact O-CB 3.07Å; P438-A441 PolarHBondContact O-N 2.8Å; P438-Y450 WeakPolarHBondContact CD-OH 3.4Å; P438-Y450 HydrophobicContact CG-CE2 4.31Å
439	A	90.8	Very high	92.1	Very high	94 Å²	94	68 Å²	68	78%	0.777	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.5	177.5	0	0	0	0	0	113.1	P431	P431-A439 HydrophobicContact CG-CB 4.16Å
440	D	92.4	Very high	92.1	Very high	145 Å²	145	69.5 Å²	69.5	78%	0.775	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	1.2	177.7	61.8	-36.3	0	0	0	113.5	P438 E442	P438-D440 VanDerWaalsContact C-N 3.29Å; P438-D440 WeakPolarHBondContact CB-OD1 3.13Å; P438-D440 PolarHBondContact O-N 3.34Å; D440-E442 PolarHBondContact O-N 3.02Å
441	A	92.5	Very high	92.2	Very high	10 Å²	10	68.2 Å²	68.2	8%	0.083	34%	0.337	C	S	.	.			trans	-60.5	131.1	177.8	0	0	0	0	0	111.2	P438 R446 Y450	P438-A441 HydrophobicContact CB-CB 4.18Å; P438-A441 HydrophobicContact CG-CB 4.39Å; P438-A441 WeakPolarHBondContact O-CB 3.07Å; P438-A441 PolarHBondContact O-N 2.8Å; A441-R446 HydrophobicContact CB-CG 3.68Å; A441-R446 WeakPolarHBondContact O-CD 3.44Å; A441-R446 PolarHBondContact O-NE 3Å; A441-R446 VanDerWaalsContact O-NE 3.16Å; A441-Y450 HydrophobicContact CB-CD2 4.43Å; A441-Y450 HydrophobicContact CB-CE2 4.19Å
442	E	93.1	Very high	92.3	Very high	49 Å²	49	67.1 Å²	67.1	23%	0.229	33%	0.327	C	S	.	.			trans	-69.1	158.5	-179.5	65.2	-175.8	148.7	0	0	112.1	D440 Y444 E445 R446 N638 M645	D440-E442 PolarHBondContact O-N 3.02Å; E442-Y444 VanDerWaalsContact C-N 3.32Å; E442-Y444 PolarHBondContact O-N 2.62Å; E442-E445 HydrophobicContact CG-CB 3.95Å; E442-E445 WeakPolarHBondContact O-CB 3.42Å; E442-E445 PolarHBondContact O-N 2.87Å; E442-E445 VanDerWaalsContact O-N 3.07Å; E442-R446 WeakPolarHBondContact O-CG 3.12Å; E442-R446 PolarHBondContact O-N 2.72Å; E442-N638 PolarHBondContact OE2-ND2 3.34Å; E442-M645 HydrophobicContact CG-CE 4.06Å; E442-M645 HydrophobicContact CG-SD 4.18Å; E442-M645 WeakPolarHBondContact OE1-CE 3.24Å; E442-M645 VanDerWaalsContact OE1-SD 3.36Å
443	E	93.7	Very high	92.3	Very high	86 Å²	86	61.6 Å²	61.6	40%	0.402	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-41.1	-170	-169.7	171.1	-165.6	0	0	113.1	P428 R446 A447 Y630	P428-E443 HydrophobicContact CG-CG 3.87Å; E443-R446 PolarHBondContact O-N 2.93Å; E443-A447 VanDerWaalsContact O-CB 3.32Å; E443-A447 WeakPolarHBondContact O-CB 3.38Å; E443-A447 PolarHBondContact O-N 3.34Å; E443-Y630 HydrophobicContact CG-CE1 4.42Å
444	Y	95.9	Very high	92.1	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-67.3	-36.7	177.4	-170.8	-114	0	0	0	112.6	L425 E442 A447 T448 R627 Y630 F641 M645	L425-Y444 HydrophobicContact CD2-CD2 4.37Å; L425-Y444 HydrophobicContact CD2-CE2 3.97Å; E442-Y444 VanDerWaalsContact C-N 3.32Å; E442-Y444 PolarHBondContact O-N 2.62Å; Y444-A447 PolarHBondContact O-N 3.24Å; Y444-T448 HydrophobicContact CD1-CG2 4.48Å; Y444-T448 HydrophobicContact CD2-CG2 4.19Å; Y444-T448 HydrophobicContact CE1-CG2 4.02Å; Y444-T448 HydrophobicContact CE2-CG2 3.76Å; Y444-T448 WeakPolarHBondContact O-CB 3.3Å; Y444-T448 PolarHBondContact O-N 3.49Å; Y444-T448 PolarHBondContact O-OG1 3.32Å; Y444-R627 HydrophobicContact CE1-CB 4.26Å; Y444-R627 HydrophobicContact CE2-CB 4.05Å; Y444-R627 WeakPolarHBondContact OH-CD 3.4Å; Y444-Y630 AromaticContact CD2-CD1 3.76Å; Y444-Y630 HydrophobicContact CD2-CD1 3.76Å; Y444-Y630 AromaticContact CD2-CD2 3.43Å; Y444-Y630 HydrophobicContact CD2-CD2 3.43Å; Y444-Y630 VanDerWaalsContact CD2-CD2 3.43Å; Y444-Y630 HydrophobicContact CD2-CE1 4.25Å; Y444-Y630 HydrophobicContact CD2-CE2 4.01Å; Y444-Y630 AromaticContact CD2-CG 3.32Å; Y444-Y630 HydrophobicContact CD2-CG 3.32Å; Y444-Y630 AromaticContact CE2-CD2 3.73Å; Y444-Y630 HydrophobicContact CE2-CD2 3.73Å; Y444-Y630 HydrophobicContact CE2-CE2 4.28Å; Y444-Y630 HydrophobicContact CE2-CG 4.05Å; Y444-Y630 HydrophobicContact CG-CD1 4.29Å; Y444-Y630 HydrophobicContact CG-CG 4.04Å; Y444-F641 HydrophobicContact CD1-CB 4.26Å; Y444-F641 HydrophobicContact CD1-CD1 4.01Å; Y444-F641 AromaticContact CD1-CD2 3.59Å; Y444-F641 HydrophobicContact CD1-CD2 3.59Å; Y444-F641 HydrophobicContact CD1-CE1 4.22Å; Y444-F641 AromaticContact CD1-CE2 3.81Å; Y444-F641 HydrophobicContact CD1-CE2 3.81Å; Y444-F641 AromaticContact CD1-CG 3.69Å; Y444-F641 HydrophobicContact CD1-CG 3.69Å; Y444-F641 HydrophobicContact CD1-CZ 4.13Å; Y444-F641 HydrophobicContact CE1-CB 4.43Å; Y444-F641 AromaticContact CE1-CD2 3.92Å; Y444-F641 HydrophobicContact CE1-CD2 3.92Å; Y444-F641 HydrophobicContact CE1-CE2 4.39Å; Y444-F641 HydrophobicContact CE1-CG 4.2Å; Y444-F641 HydrophobicContact CG-CD2 4.23Å; Y444-F641 HydrophobicContact CG-CE1 4.37Å; Y444-F641 AromaticContact CG-CE2 3.96Å; Y444-F641 HydrophobicContact CG-CE2 3.96Å; Y444-F641 HydrophobicContact CG-CZ 4.05Å; Y444-M645 HydrophobicContact CD1-CB 4Å; Y444-M645 HydrophobicContact CD1-SD 4.47Å; Y444-M645 HydrophobicContact CE1-CB 4.07Å; Y444-M645 WeakPolarHBondContact CE1-O 3.33Å
445	E	95.4	Very high	91.6	Very high	20 Å²	20	63.8 Å²	63.8	9%	0.093	33%	0.326	C	S	.	.	H	α-helix	trans	-66.1	-41	175.7	-166	176.7	-156	0	0	111.4	E442 A447 T448 R449 Y450 M645	E442-E445 HydrophobicContact CG-CB 3.95Å; E442-E445 WeakPolarHBondContact O-CB 3.42Å; E442-E445 PolarHBondContact O-N 2.87Å; E442-E445 VanDerWaalsContact O-N 3.07Å; E445-A447 VanDerWaalsContact C-N 3.28Å; E445-A447 PolarHBondContact O-N 2.93Å; E445-T448 CarbonylContact O-C 3.57Å; E445-T448 PolarHBondContact O-N 2.99Å; E445-R449 HydrophobicContact CG-CB 3.95Å; E445-R449 PolarHBondContact O-N 3.47Å; E445-R449 VanDerWaalsContact O-N 3.11Å; E445-R449 VanDerWaalsContact OE1-CD 3.31Å; E445-R449 WeakPolarHBondContact OE1-CD 3.21Å; E445-R449 IonicContact OE1-CZ 2.85Å; E445-R449 IonicContact OE1-NE 2.76Å; E445-R449 IonicContact OE1-NH1 3.77Å; E445-R449 PolarHBondContact OE1-NH1 3.41Å; E445-Y450 VanDerWaalsContact CD-CE2 3.47Å; E445-Y450 HydrophobicContact CG-CD2 3.82Å; E445-Y450 HydrophobicContact CG-CE2 3.57Å; E445-Y450 PolarHBondContact O-N 3.5Å; E445-M645 HydrophobicContact CB-CE 3.76Å; E445-M645 HydrophobicContact CB-CG 4.16Å; E445-M645 HydrophobicContact CB-SD 3.7Å; E445-M645 HydrophobicContact CG-CE 3.81Å; E445-M645 HydrophobicContact CG-CG 4.01Å; E445-M645 HydrophobicContact CG-SD 4.1Å
446	R	95.4	Very high	91.2	Very high	64 Å²	64	54.5 Å²	54.5	24%	0.242	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-28.7	173.8	-66.2	-169.3	-65.9	117.7	-0.7	112.9	P428 T429 A441 E442 E443 N451	P428-R446 HydrophobicContact CB-CB 3.82Å; T429-R446 PolarHBondContact N-O 3.2Å; T429-R446 WeakPolarHBondContact O-CD 3.32Å; T429-R446 PolarHBondContact O-NH1 3.42Å; A441-R446 HydrophobicContact CB-CG 3.68Å; A441-R446 WeakPolarHBondContact O-CD 3.44Å; A441-R446 PolarHBondContact O-NE 3Å; A441-R446 VanDerWaalsContact O-NE 3.16Å; E442-R446 WeakPolarHBondContact O-CG 3.12Å; E442-R446 PolarHBondContact O-N 2.72Å; E443-R446 PolarHBondContact O-N 2.93Å; R446-N451 WeakPolarHBondContact O-CB 3.36Å
447	A	94	Very high	90.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-79.3	-28.8	176.1	0	0	0	0	0	113.1	L425 P428 E443 Y444 E445 N451	L425-A447 HydrophobicContact CD2-CB 4.09Å; P428-A447 HydrophobicContact CB-CB 4.24Å; P428-A447 HydrophobicContact CG-CB 4.23Å; E443-A447 VanDerWaalsContact O-CB 3.32Å; E443-A447 WeakPolarHBondContact O-CB 3.38Å; E443-A447 PolarHBondContact O-N 3.34Å; Y444-A447 PolarHBondContact O-N 3.24Å; E445-A447 VanDerWaalsContact C-N 3.28Å; E445-A447 PolarHBondContact O-N 2.93Å; A447-N451 VanDerWaalsContact O-CB 3.27Å; A447-N451 WeakPolarHBondContact O-CB 3.38Å
448	T	94.9	Very high	89.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-94	-176.5	57.3	0	0	0	0	111.4	L425 Y444 E445 Y450 N451 Y452 M645 M647	L425-T448 HydrophobicContact CD2-CG2 4.25Å; Y444-T448 HydrophobicContact CD1-CG2 4.48Å; Y444-T448 HydrophobicContact CD2-CG2 4.19Å; Y444-T448 HydrophobicContact CE1-CG2 4.02Å; Y444-T448 HydrophobicContact CE2-CG2 3.76Å; Y444-T448 WeakPolarHBondContact O-CB 3.3Å; Y444-T448 PolarHBondContact O-N 3.49Å; Y444-T448 PolarHBondContact O-OG1 3.32Å; E445-T448 CarbonylContact O-C 3.57Å; E445-T448 PolarHBondContact O-N 2.99Å; T448-Y450 VanDerWaalsContact C-N 3.28Å; T448-Y450 PolarHBondContact O-N 2.91Å; T448-N451 PolarHBondContact O-N 3.4Å; T448-Y452 WeakPolarHBondContact O-CD2 3.48Å; T448-M645 PolarHBondContact OG1-O 3.02Å; T448-M647 HydrophobicContact CG2-CG 4.45Å; T448-M647 HydrophobicContact CG2-SD 4.23Å
449	R	94	Very high	88.1	Confident	95 Å²	95	49.3 Å²	49.3	36%	0.358	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.1	-49.7	-171.6	-174.3	-177.2	-178.5	178.9	5.1	114.5	E445 E644 I650	E445-R449 HydrophobicContact CG-CB 3.95Å; E445-R449 PolarHBondContact O-N 3.47Å; E445-R449 VanDerWaalsContact O-N 3.11Å; E445-R449 VanDerWaalsContact OE1-CD 3.31Å; E445-R449 WeakPolarHBondContact OE1-CD 3.21Å; E445-R449 IonicContact OE1-CZ 2.85Å; E445-R449 IonicContact OE1-NE 2.76Å; E445-R449 IonicContact OE1-NH1 3.77Å; E445-R449 PolarHBondContact OE1-NH1 3.41Å; R449-E644 WeakPolarHBondContact CB-O 2.8Å; R449-E644 WeakPolarHBondContact CG-O 3.45Å; R449-I650 HydrophobicContact CB-CD1 4.26Å
450	Y	93.4	Very high	87.5	Confident	36 Å²	36	45.5 Å²	45.5	14%	0.141	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.1	-174.6	-62.6	-66.3	0	0	0	114.2	N434 D436 C437 P438 A441 E445 T448	N434-Y450 PolarHBondContact ND2-O 3.09Å; D436-Y450 VanDerWaalsContact O-CE1 3.25Å; D436-Y450 WeakPolarHBondContact O-CE1 3.5Å; C437-Y450 HydrophobicContact CB-CD1 4.42Å; C437-Y450 HydrophobicContact CB-CG 4.12Å; P438-Y450 WeakPolarHBondContact CD-OH 3.4Å; P438-Y450 HydrophobicContact CG-CE2 4.31Å; A441-Y450 HydrophobicContact CB-CD2 4.43Å; A441-Y450 HydrophobicContact CB-CE2 4.19Å; E445-Y450 VanDerWaalsContact CD-CE2 3.47Å; E445-Y450 HydrophobicContact CG-CD2 3.82Å; E445-Y450 HydrophobicContact CG-CE2 3.57Å; E445-Y450 PolarHBondContact O-N 3.5Å; T448-Y450 VanDerWaalsContact C-N 3.28Å; T448-Y450 PolarHBondContact O-N 2.91Å
451	N	93	Very high	87	Confident	19 Å²	19	39.9 Å²	39.9	10%	0.102	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-6.9	-174	-142.4	-5.4	0	0	0	113.6	K424 H427 R446 A447 T448	K424-N451 WeakPolarHBondContact CB-ND2 3.02Å; K424-N451 HydrophobicContact CD-CB 4.11Å; K424-N451 WeakPolarHBondContact CD-O 3.46Å; K424-N451 WeakPolarHBondContact CE-O 3.27Å; K424-N451 PolarHBondContact NZ-O 2.93Å; K424-N451 PolarHBondContact O-ND2 3.47Å; H427-N451 PolarHBondContact O-ND2 3.15Å; R446-N451 WeakPolarHBondContact O-CB 3.36Å; A447-N451 VanDerWaalsContact O-CB 3.27Å; A447-N451 WeakPolarHBondContact O-CB 3.38Å; T448-N451 PolarHBondContact O-N 3.4Å
452	Y	91.2	Very high	86.8	Confident	26 Å²	26	39.7 Å²	39.7	10%	0.102	20%	0.196	C	C	.	.			trans	-113.3	127.6	-179	-61.1	-92.9	0	0	0	112.5	V420 Y421 K424 T448 E456 K457 M647	V420-Y452 HydrophobicContact CG1-CE1 4.44Å; Y421-Y452 WeakPolarHBondContact CA-OH 3.39Å; Y421-Y452 VanDerWaalsContact CD2-OH 3.3Å; Y421-Y452 WeakPolarHBondContact CD2-OH 3.46Å; K424-Y452 HydrophobicContact CD-CD1 4.05Å; K424-Y452 HydrophobicContact CD-CE1 3.71Å; K424-Y452 HydrophobicContact CD-CE2 4.3Å; K424-Y452 HydrophobicContact CD-CG 4.48Å; T448-Y452 WeakPolarHBondContact O-CD2 3.48Å; Y452-E456 HydrophobicContact CD1-CB 4.4Å; Y452-K457 WeakPolarHBondContact O-CE 3.23Å; Y452-M647 HydrophobicContact CD2-CE 4.05Å; Y452-M647 HydrophobicContact CD2-SD 4.18Å; Y452-M647 HydrophobicContact CE1-CE 4.09Å; Y452-M647 HydrophobicContact CE2-CE 3.62Å; Y452-M647 HydrophobicContact CE2-SD 3.61Å
453	S	86.9	Confident	86.5	Confident	61 Å²	61	37.5 Å²	37.5	43%	0.427	19%	0.186	S	C	.	.			trans	-73.9	167.7	168.1	70.2	0	0	0	0	111.7	E455 E456 K457	S453-E455 VanDerWaalsContact C-N 3.32Å; S453-E455 PolarHBondContact O-N 3.46Å; S453-E456 WeakPolarHBondContact CB-OE2 3.33Å; S453-E456 PolarHBondContact N-OE2 3.11Å; S453-E456 PolarHBondContact O-N 2.76Å; S453-E456 VanDerWaalsContact OG-CG 3.26Å; S453-E456 WeakPolarHBondContact OG-CG 3.46Å; S453-E456 PolarHBondContact OG-OE2 3.01Å; S453-K457 WeakPolarHBondContact O-CG 3.38Å
454	S	82.8	Confident	86.1	Confident	79 Å²	79	33.9 Å²	33.9	55%	0.552	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-64.1	-33.9	-178.9	-65	0	0	0	0	113.4	E456 H654	S454-E456 VanDerWaalsContact C-N 3.3Å; S454-E456 PolarHBondContact O-N 3.31Å; S454-H654 VanDerWaalsContact CB-CE1 3.46Å; S454-H654 WeakPolarHBondContact CB-CE1 3.27Å; S454-H654 PolarHBondContact O-NE2 2.95Å; S454-H654 PolarHBondContact OG-CE1 3.31Å
455	E	78.7	Confident	85.7	Confident	138 Å²	138	33.8 Å²	33.8	65%	0.645	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-72.9	-23.2	-179	-63.6	-168	168.8	0	0	113.1	A358 S453 K457	A358-E455 HydrophobicContact CB-CB 4.1Å; S453-E455 VanDerWaalsContact C-N 3.32Å; S453-E455 PolarHBondContact O-N 3.46Å; E455-K457 VanDerWaalsContact C-N 3.32Å
456	E	81.1	Confident	85.4	Confident	40 Å²	40	33.3 Å²	33.3	19%	0.187	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-81.5	-11.5	-177	-62.6	174.4	109.5	0	0	113.2	I357 K424 Y452 S453 S454 V458	I357-E456 HydrophobicContact CG2-CB 3.67Å; I357-E456 HydrophobicContact CG2-CG 3.46Å; I357-E456 VanDerWaalsContact CG2-CG 3.46Å; K424-E456 IonicContact NZ-OE1 2.64Å; K424-E456 PolarHBondContact NZ-OE1 3.21Å; K424-E456 IonicContact NZ-OE2 3.89Å; K424-E456 PolarHBondContact NZ-OE2 3.33Å; Y452-E456 HydrophobicContact CD1-CB 4.4Å; S453-E456 WeakPolarHBondContact CB-OE2 3.33Å; S453-E456 PolarHBondContact N-OE2 3.11Å; S453-E456 PolarHBondContact O-N 2.76Å; S453-E456 VanDerWaalsContact OG-CG 3.26Å; S453-E456 WeakPolarHBondContact OG-CG 3.46Å; S453-E456 PolarHBondContact OG-OE2 3.01Å; S454-E456 VanDerWaalsContact C-N 3.3Å; S454-E456 PolarHBondContact O-N 3.31Å; E456-V458 VanDerWaalsContact C-N 3.35Å; E456-V458 PolarHBondContact O-N 3.45Å
457	K	75.9	Confident	85	Confident	27 Å²	27	30.5 Å²	30.5	12%	0.117	16%	0.159	C	C	.	.			trans	-89.6	46.7	-171.3	-67	178.8	-177.9	-175.3	0	113.6	Y452 S453 E455 I650 L651 H654	Y452-K457 WeakPolarHBondContact O-CE 3.23Å; S453-K457 WeakPolarHBondContact O-CG 3.38Å; E455-K457 VanDerWaalsContact C-N 3.32Å; K457-I650 HydrophobicContact CD-CG2 4.48Å; K457-L651 HydrophobicContact CB-CD2 3.68Å; K457-L651 HydrophobicContact CG-CD2 3.92Å; K457-H654 HydrophobicContact CD-CB 3.71Å; K457-H654 VanDerWaalsContact CD-CG 3.45Å
458	V	64.3	Low	84.6	Confident	29 Å²	29	32.9 Å²	32.9	18%	0.176	17%	0.172	C	C	.	.			trans	-135.7	110.7	-177.6	-173.7	0	0	0	0	112.8	E456 M663	E456-V458 VanDerWaalsContact C-N 3.35Å; E456-V458 PolarHBondContact O-N 3.45Å; V458-M663 HydrophobicContact CG2-SD 3.91Å
459	I	71.6	Confident	84.3	Confident	16 Å²	16	32.9 Å²	32.9	8%	0.082	17%	0.172	C	C	.	.			trans	-124.4	-0.4	-176.3	-52.4	173.5	0	0	0	113.5	V417 M461 I462 L621 L624 L651	V417-I459 HydrophobicContact CG1-CD1 3.75Å; V417-I459 HydrophobicContact CG1-CG1 4.3Å; V417-I459 HydrophobicContact CG2-CG1 4.37Å; V417-I459 HydrophobicContact CG2-CG2 4.31Å; I459-M461 VanDerWaalsContact C-N 3.28Å; I459-M461 PolarHBondContact O-N 2.86Å; I459-I462 HydrophobicContact CG2-CD1 3.91Å; I459-I462 HydrophobicContact CG2-CG1 4.49Å; I459-I462 PolarHBondContact O-N 3.07Å; I459-L621 HydrophobicContact CG2-CD1 3.49Å; I459-L621 VanDerWaalsContact CG2-CD1 3.49Å; I459-L624 HydrophobicContact CD1-CD1 4.1Å; I459-L651 HydrophobicContact CD1-CD1 3.58Å
460	S	77.8	Confident	84	Confident	13 Å²	13	29 Å²	29	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-24.8	-169.2	52	0	0	0	0	116.5	I462 G464 C666	S460-I462 VanDerWaalsContact C-N 3.3Å; S460-I462 PolarHBondContact O-N 3.06Å; S460-G464 PolarHBondContact O-N 3.05Å; S460-C666 PolarHBondContact OG-SG 3.37Å
461	M	82.2	Confident	83.5	Confident	27 Å²	27	32.2 Å²	32.2	13%	0.133	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-31.7	-177.8	-66.7	-179.6	-65.9	0	0	113.3	T361 F364 R365 W413 I459 L465	T361-M461 HydrophobicContact CG2-CE 3.89Å; F364-M461 HydrophobicContact CB-CE 3.53Å; F364-M461 HydrophobicContact CB-SD 4.26Å; F364-M461 HydrophobicContact CD2-CE 4.22Å; F364-M461 HydrophobicContact CG-CE 4.41Å; R365-M461 HydrophobicContact CB-SD 4.35Å; R365-M461 HydrophobicContact CG-CE 4.25Å; R365-M461 HydrophobicContact CG-SD 3.5Å; R365-M461 VanDerWaalsContact CG-SD 3.5Å; W413-M461 HydrophobicContact CE3-CB 4.48Å; W413-M461 HydrophobicContact CZ3-CB 4.23Å; I459-M461 VanDerWaalsContact C-N 3.28Å; I459-M461 PolarHBondContact O-N 2.86Å; M461-L465 WeakPolarHBondContact O-CB 3.09Å; M461-L465 PolarHBondContact O-N 3.33Å
462	I	87.5	Confident	83.2	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-55	-179.7	-60.3	178.3	0	0	0	109.3	L410 W413 T414 V417 I459 S460 G464 L465 Q466 C619 L621	L410-I462 HydrophobicContact CD2-CG2 4.16Å; L410-I462 WeakPolarHBondContact CD2-O 3.4Å; W413-I462 HydrophobicContact CB-CD1 3.98Å; W413-I462 HydrophobicContact CB-CG1 3.83Å; W413-I462 HydrophobicContact CE3-CG1 4.2Å; T414-I462 WeakPolarHBondContact OG1-CG2 3.5Å; V417-I462 HydrophobicContact CG2-CD1 4.06Å; I459-I462 HydrophobicContact CG2-CD1 3.91Å; I459-I462 HydrophobicContact CG2-CG1 4.49Å; I459-I462 PolarHBondContact O-N 3.07Å; S460-I462 VanDerWaalsContact C-N 3.3Å; S460-I462 PolarHBondContact O-N 3.06Å; I462-G464 PolarHBondContact O-N 3.47Å; I462-L465 PolarHBondContact O-N 3.42Å; I462-Q466 PolarHBondContact O-N 3.49Å; I462-C619 HydrophobicContact CG2-CB 4.12Å; I462-L621 HydrophobicContact CD1-CD1 4.39Å
463	K	86.5	Confident	83	Confident	3 Å²	3	32.6 Å²	32.6	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-41.5	178.9	-65.8	-63	-170.5	168.8	0	112.1	A32 L465 Q466 V467 Y669 D672 D676	A32-K463 HydrophobicContact CB-CB 4.07Å; A32-K463 HydrophobicContact CB-CD 4.13Å; A32-K463 HydrophobicContact CB-CG 4.37Å; K463-L465 PolarHBondContact O-N 2.81Å; K463-Q466 WeakPolarHBondContact O-CB 3.42Å; K463-Q466 PolarHBondContact O-N 2.57Å; K463-V467 WeakPolarHBondContact O-CG2 3.38Å; K463-V467 PolarHBondContact O-N 3.11Å; K463-V467 VanDerWaalsContact O-N 3.14Å; K463-Y669 HydrophobicContact CB-CD1 3.47Å; K463-Y669 VanDerWaalsContact CB-CD1 3.47Å; K463-Y669 HydrophobicContact CB-CE1 4.15Å; K463-Y669 HydrophobicContact CB-CG 4.21Å; K463-Y669 HydrophobicContact CG-CD1 4.48Å; K463-D672 WeakPolarHBondContact CD-OD2 3.21Å; K463-D672 WeakPolarHBondContact CE-OD2 3.37Å; K463-D672 IonicContact NZ-OD2 2.65Å; K463-D672 PolarHBondContact NZ-OD2 2.87Å; K463-D676 WeakPolarHBondContact CE-OD2 3.11Å; K463-D676 IonicContact NZ-OD1 3.45Å; K463-D676 PolarHBondContact NZ-OD1 3.44Å; K463-D676 IonicContact NZ-OD2 3.67Å; K463-D676 PolarHBondContact NZ-OD2 2.87Å
464	G	84.7	Confident	83	Confident	11 Å²	11	34.3 Å²	34.3	11%	0.113	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-45.6	176.8	0	0	0	0	0	112.8	S460 I462 V467 L468	S460-G464 PolarHBondContact O-N 3.05Å; I462-G464 PolarHBondContact O-N 3.47Å; G464-V467 PolarHBondContact O-N 3.46Å; G464-L468 PolarHBondContact O-N 2.62Å
465	L	88.3	Confident	83.2	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.3	-35.2	177.5	178.7	60.2	0	0	0	112.4	F371 V372 L410 W413 M461 I462 K463 V467 L468 M469	F371-L465 HydrophobicContact CD1-CD1 3.55Å; F371-L465 HydrophobicContact CD1-CD2 4.29Å; F371-L465 HydrophobicContact CE1-CD1 3.67Å; V372-L465 HydrophobicContact CG2-CD1 4.15Å; L410-L465 HydrophobicContact CD1-CG 4.39Å; L410-L465 HydrophobicContact CD2-CB 3.8Å; L410-L465 HydrophobicContact CD2-CD2 3.78Å; L410-L465 HydrophobicContact CD2-CG 3.83Å; L410-L465 HydrophobicContact CG-CD2 3.9Å; L410-L465 HydrophobicContact CG-CG 4.14Å; W413-L465 HydrophobicContact CE3-CD2 4.5Å; W413-L465 HydrophobicContact CH2-CD2 3.61Å; W413-L465 HydrophobicContact CZ3-CB 4.12Å; W413-L465 HydrophobicContact CZ3-CD2 3.56Å; W413-L465 HydrophobicContact CZ3-CG 4.48Å; M461-L465 WeakPolarHBondContact O-CB 3.09Å; M461-L465 PolarHBondContact O-N 3.33Å; I462-L465 PolarHBondContact O-N 3.42Å; K463-L465 PolarHBondContact O-N 2.81Å; L465-V467 VanDerWaalsContact C-N 3.31Å; L465-V467 PolarHBondContact O-N 2.73Å; L465-L468 PolarHBondContact O-N 3.44Å; L465-M469 HydrophobicContact CD1-CG 4.17Å; L465-M469 HydrophobicContact CG-CG 4.42Å; L465-M469 HydrophobicContact CG-SD 4.41Å; L465-M469 WeakPolarHBondContact O-CG 3.18Å; L465-M469 PolarHBondContact O-N 2.81Å
466	Q	89.2	Confident	83.7	Confident	10 Å²	10	26.2 Å²	26.2	5%	0.047	14%	0.14	C	C	.	.	H	α-helix	trans	-54.6	-47	173.4	-170.1	-175.1	8.4	0	0	111.4	I462 K463 L468 M469 A470 L615 C619	I462-Q466 PolarHBondContact O-N 3.49Å; K463-Q466 WeakPolarHBondContact O-CB 3.42Å; K463-Q466 PolarHBondContact O-N 2.57Å; Q466-L468 VanDerWaalsContact C-N 3.35Å; Q466-L468 PolarHBondContact O-N 3.45Å; Q466-M469 PolarHBondContact O-N 3.05Å; Q466-A470 WeakPolarHBondContact O-CB 3.26Å; Q466-A470 PolarHBondContact O-N 3.48Å; Q466-L615 HydrophobicContact CG-CD1 4.27Å; Q466-L615 HydrophobicContact CG-CD2 4.49Å; Q466-L615 HydrophobicContact CG-CG 4.12Å; Q466-C619 HydrophobicContact CB-CB 4.39Å; Q466-C619 VanDerWaalsContact CD-CB 3.47Å; Q466-C619 HydrophobicContact CG-CB 4.06Å
467	V	86	Confident	84.1	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.03	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-44.4	178	-179.2	0	0	0	0	111.8	M29 Q33 K463 G464 L465 M469 A470 K471	M29-V467 HydrophobicContact CE-CG1 4.24Å; M29-V467 HydrophobicContact CG-CG1 4.44Å; M29-V467 HydrophobicContact SD-CG1 3.57Å; M29-V467 VanDerWaalsContact SD-CG1 3.57Å; Q33-V467 HydrophobicContact CB-CG2 4.17Å; Q33-V467 VanDerWaalsContact N-CG2 3.25Å; K463-V467 WeakPolarHBondContact O-CG2 3.38Å; K463-V467 PolarHBondContact O-N 3.11Å; K463-V467 VanDerWaalsContact O-N 3.14Å; G464-V467 PolarHBondContact O-N 3.46Å; L465-V467 VanDerWaalsContact C-N 3.31Å; L465-V467 PolarHBondContact O-N 2.73Å; V467-M469 VanDerWaalsContact C-N 3.32Å; V467-M469 PolarHBondContact O-N 2.86Å; V467-A470 PolarHBondContact O-N 3.1Å; V467-K471 HydrophobicContact CG1-CD 4.5Å; V467-K471 WeakPolarHBondContact O-CG 3.23Å; V467-K471 PolarHBondContact O-N 3.5Å; V467-K471 VanDerWaalsContact O-N 3.08Å
468	L	86	Confident	84.7	Confident	50 Å²	50	28 Å²	28	26%	0.262	16%	0.155	S	C	.	.	H	α-helix	trans	-63.7	-39.6	179.9	-66.5	175.5	0	0	0	111.8	V372 L375 G464 L465 Q466	V372-L468 HydrophobicContact CB-CD1 4.47Å; V372-L468 HydrophobicContact CG1-CD1 3.95Å; V372-L468 HydrophobicContact CG2-CD1 3.65Å; L375-L468 HydrophobicContact CD2-CB 4.18Å; G464-L468 PolarHBondContact O-N 2.62Å; L465-L468 PolarHBondContact O-N 3.44Å; Q466-L468 VanDerWaalsContact C-N 3.35Å; Q466-L468 PolarHBondContact O-N 3.45Å
469	M	88.9	Confident	86	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-71	-42.9	177.6	-70.9	-166.6	62.8	0	0	112.6	F371 G406 L407 L410 L465 Q466 V467 K471 M472 E473 F476 F611 L615	F371-M469 HydrophobicContact CE1-CG 4.33Å; F371-M469 HydrophobicContact CE1-SD 4.33Å; F371-M469 HydrophobicContact CZ-SD 4.37Å; G406-M469 WeakPolarHBondContact CA-SD 3.17Å; L407-M469 HydrophobicContact CG-CE 4.2Å; L410-M469 HydrophobicContact CD1-SD 3.57Å; L410-M469 VanDerWaalsContact CD1-SD 3.57Å; L410-M469 HydrophobicContact CG-SD 4.48Å; L465-M469 HydrophobicContact CD1-CG 4.17Å; L465-M469 HydrophobicContact CG-CG 4.42Å; L465-M469 HydrophobicContact CG-SD 4.41Å; L465-M469 WeakPolarHBondContact O-CG 3.18Å; L465-M469 PolarHBondContact O-N 2.81Å; Q466-M469 PolarHBondContact O-N 3.05Å; V467-M469 VanDerWaalsContact C-N 3.32Å; V467-M469 PolarHBondContact O-N 2.86Å; M469-K471 VanDerWaalsContact C-N 3.27Å; M469-K471 PolarHBondContact O-N 3.22Å; M469-M472 CarbonylContact O-C 3.58Å; M469-M472 PolarHBondContact O-N 2.88Å; M469-E473 PolarHBondContact O-N 2.74Å; M469-F476 HydrophobicContact CB-CE2 4.42Å; M469-F476 HydrophobicContact CE-CE2 4.36Å; M469-F611 HydrophobicContact CB-CZ 4.43Å; M469-F611 HydrophobicContact CE-CE2 3.72Å; M469-F611 HydrophobicContact CE-CZ 3.56Å; M469-L615 HydrophobicContact CB-CD1 4Å; M469-L615 HydrophobicContact CB-CD2 4.2Å; M469-L615 HydrophobicContact CE-CD1 4.44Å; M469-L615 HydrophobicContact SD-CD1 4.29Å
470	A	87.7	Confident	86.9	Confident	14 Å²	14	26.1 Å²	26.1	12%	0.116	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-37.2	177	0	0	0	0	0	112.1	Q33 Q466 V467 M472 E473 L615	Q33-A470 VanDerWaalsContact CD-CB 3.4Å; Q33-A470 HydrophobicContact CG-CB 4.14Å; Q466-A470 WeakPolarHBondContact O-CB 3.26Å; Q466-A470 PolarHBondContact O-N 3.48Å; V467-A470 PolarHBondContact O-N 3.1Å; A470-M472 PolarHBondContact O-N 2.7Å; A470-E473 WeakPolarHBondContact O-CB 3.38Å; A470-E473 PolarHBondContact O-N 3.27Å; A470-E473 VanDerWaalsContact O-N 3.07Å; A470-L615 HydrophobicContact CB-CD2 3.94Å
471	K	83.4	Confident	87.6	Confident	102 Å²	102	28.4 Å²	28.4	44%	0.443	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.4	175.6	-79.2	-177.7	170	-164.4	0	114.6	M29 V467 M469	M29-K471 HydrophobicContact SD-CD 4.38Å; M29-K471 WeakPolarHBondContact SD-CE 3.3Å; M29-K471 PolarHBondContact SD-NZ 3.38Å; V467-K471 HydrophobicContact CG1-CD 4.5Å; V467-K471 WeakPolarHBondContact O-CG 3.23Å; V467-K471 PolarHBondContact O-N 3.5Å; V467-K471 VanDerWaalsContact O-N 3.08Å; M469-K471 VanDerWaalsContact C-N 3.27Å; M469-K471 PolarHBondContact O-N 3.22Å
472	M	86.6	Confident	88	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	11	177.3	-72.4	-164.6	60.1	0	0	112.3	L375 R379 I382 L399 M469 A470 T474 D475 F476	L375-M472 HydrophobicContact CD1-CE 4.13Å; L375-M472 HydrophobicContact CD1-SD 3.42Å; L375-M472 WeakPolarHBondContact CD1-SD 3.29Å; L375-M472 HydrophobicContact CD2-SD 4.32Å; L375-M472 HydrophobicContact CG-SD 3.72Å; R379-M472 HydrophobicContact CB-CE 4.35Å; R379-M472 HydrophobicContact CB-SD 3.88Å; R379-M472 HydrophobicContact CG-SD 4.18Å; I382-M472 HydrophobicContact CD1-CE 4.13Å; L399-M472 HydrophobicContact CD1-CE 4.24Å; M469-M472 CarbonylContact O-C 3.58Å; M469-M472 PolarHBondContact O-N 2.88Å; A470-M472 PolarHBondContact O-N 2.7Å; M472-T474 VanDerWaalsContact C-N 3.3Å; M472-T474 PolarHBondContact O-N 2.94Å; M472-D475 HydrophobicContact CE-CB 4.41Å; M472-D475 PolarHBondContact O-N 2.93Å; M472-D475 VanDerWaalsContact O-N 3.12Å; M472-F476 HydrophobicContact CB-CD2 3.83Å; M472-F476 HydrophobicContact CB-CE2 3.58Å; M472-F476 HydrophobicContact CB-CZ 4.14Å; M472-F476 VanDerWaalsContact O-CD2 3.23Å; M472-F476 WeakPolarHBondContact O-CD2 3.48Å; M472-F476 WeakPolarHBondContact O-CG 3.4Å; M472-F476 PolarHBondContact O-N 2.92Å
473	E	87.3	Confident	88.2	Confident	53 Å²	53	30.2 Å²	30.2	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-54.2	-44.4	-177	176.5	174	-172.1	0	0	112.4	M469 A470 D475 F476 V477 F611 S612	M469-E473 PolarHBondContact O-N 2.74Å; A470-E473 WeakPolarHBondContact O-CB 3.38Å; A470-E473 PolarHBondContact O-N 3.27Å; A470-E473 VanDerWaalsContact O-N 3.07Å; E473-D475 VanDerWaalsContact C-N 3.32Å; E473-D475 PolarHBondContact O-N 3.26Å; E473-F476 PolarHBondContact O-N 3.33Å; E473-V477 HydrophobicContact CG-CG2 4.06Å; E473-V477 WeakPolarHBondContact O-CB 3.14Å; E473-V477 VanDerWaalsContact O-CG2 3.29Å; E473-V477 WeakPolarHBondContact O-CG2 3.29Å; E473-V477 PolarHBondContact O-N 3.5Å; E473-F611 HydrophobicContact CB-CE1 4.34Å; E473-F611 HydrophobicContact CG-CD1 4.07Å; E473-F611 HydrophobicContact CG-CE1 4.39Å; E473-S612 WeakPolarHBondContact OE1-CB 3.37Å; E473-S612 PolarHBondContact OE1-OG 3.4Å
474	T	85.5	Confident	88.6	Confident	96 Å²	96	30.1 Å²	30.1	59%	0.589	16%	0.16	S	C	*	.	H	α-helix	trans	-60.6	-42.2	179.5	51.3	0	0	0	0	112.4	M472 T478	M472-T474 VanDerWaalsContact C-N 3.3Å; M472-T474 PolarHBondContact O-N 2.94Å; T474-T478 WeakPolarHBondContact O-CB 3.33Å; T474-T478 PolarHBondContact O-N 3.21Å; T474-T478 PolarHBondContact O-OG1 3.21Å
475	D	87.6	Confident	88.9	Confident	47 Å²	47	30.1 Å²	30.1	25%	0.251	16%	0.157	S	C	.	.	H	α-helix	trans	-70.5	-41.4	179.4	-56.9	-44.9	0	0	0	110.4	L399 M472 E473 S479	L399-D475 VanDerWaalsContact CD2-C 3.48Å; L399-D475 HydrophobicContact CD2-CB 3.87Å; L399-D475 VanDerWaalsContact CD2-O 3.27Å; L399-D475 WeakPolarHBondContact CD2-O 3.23Å; M472-D475 HydrophobicContact CE-CB 4.41Å; M472-D475 PolarHBondContact O-N 2.93Å; M472-D475 VanDerWaalsContact O-N 3.12Å; E473-D475 VanDerWaalsContact C-N 3.32Å; E473-D475 PolarHBondContact O-N 3.26Å; D475-S479 VanDerWaalsContact O-CB 3.3Å; D475-S479 WeakPolarHBondContact O-CB 3.46Å; D475-S479 PolarHBondContact O-N 2.77Å; D475-S479 VanDerWaalsContact O-N 3.08Å; D475-S479 PolarHBondContact O-OG 2.68Å
476	F	90.6	Very high	89.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-53.2	176.1	-72.3	-43.7	0	0	0	112.2	L375 L399 M402 A403 M469 M472 E473 T478 S479 I480 F611	L375-F476 HydrophobicContact CD1-CE1 4.32Å; L375-F476 HydrophobicContact CD1-CE2 4.49Å; L375-F476 HydrophobicContact CD1-CZ 3.61Å; L399-F476 HydrophobicContact CD2-CD1 3.85Å; L399-F476 HydrophobicContact CD2-CE1 4.38Å; L399-F476 HydrophobicContact CG-CD1 3.82Å; L399-F476 HydrophobicContact CG-CE1 3.96Å; M402-F476 HydrophobicContact CB-CE1 4.27Å; A403-F476 HydrophobicContact CB-CB 4.26Å; A403-F476 HydrophobicContact CB-CD1 3.61Å; A403-F476 HydrophobicContact CB-CE1 3.99Å; A403-F476 HydrophobicContact CB-CG 3.93Å; M469-F476 HydrophobicContact CB-CE2 4.42Å; M469-F476 HydrophobicContact CE-CE2 4.36Å; M472-F476 HydrophobicContact CB-CD2 3.83Å; M472-F476 HydrophobicContact CB-CE2 3.58Å; M472-F476 HydrophobicContact CB-CZ 4.14Å; M472-F476 VanDerWaalsContact O-CD2 3.23Å; M472-F476 WeakPolarHBondContact O-CD2 3.48Å; M472-F476 WeakPolarHBondContact O-CG 3.4Å; M472-F476 PolarHBondContact O-N 2.92Å; E473-F476 PolarHBondContact O-N 3.33Å; F476-T478 VanDerWaalsContact C-N 3.33Å; F476-T478 PolarHBondContact O-N 3.33Å; F476-S479 PolarHBondContact O-N 3.44Å; F476-S479 VanDerWaalsContact O-N 3.15Å; F476-I480 HydrophobicContact CB-CD1 4.28Å; F476-I480 WeakPolarHBondContact O-CB 3.4Å; F476-I480 WeakPolarHBondContact O-CD1 3.28Å; F476-I480 WeakPolarHBondContact O-CG1 3.28Å; F476-I480 PolarHBondContact O-N 3.29Å; F476-F611 HydrophobicContact CB-CZ 4.41Å; F476-F611 AromaticContact CD2-CE1 3.97Å; F476-F611 HydrophobicContact CD2-CE1 3.97Å; F476-F611 HydrophobicContact CD2-CE2 4.21Å; F476-F611 AromaticContact CD2-CZ 3.54Å; F476-F611 HydrophobicContact CD2-CZ 3.54Å; F476-F611 HydrophobicContact CE2-CZ 4.05Å; F476-F611 HydrophobicContact CG-CZ 4.24Å
477	V	89.4	Confident	89.2	Confident	40 Å²	40	31.3 Å²	31.3	24%	0.242	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-44.8	-177	170.6	0	0	0	0	110.9	E473 S479 I480 Q481 F611	E473-V477 HydrophobicContact CG-CG2 4.06Å; E473-V477 WeakPolarHBondContact O-CB 3.14Å; E473-V477 VanDerWaalsContact O-CG2 3.29Å; E473-V477 WeakPolarHBondContact O-CG2 3.29Å; E473-V477 PolarHBondContact O-N 3.5Å; V477-S479 VanDerWaalsContact C-N 3.32Å; V477-S479 PolarHBondContact O-N 3.37Å; V477-I480 PolarHBondContact O-N 3.14Å; V477-Q481 VanDerWaalsContact O-CG 3.29Å; V477-Q481 WeakPolarHBondContact O-CG 3.05Å; V477-Q481 PolarHBondContact O-N 2.82Å; V477-F611 HydrophobicContact CG2-CB 4.24Å
478	T	88.4	Confident	89.5	Confident	64 Å²	64	31.4 Å²	31.4	39%	0.393	16%	0.164	S	C	.	.	H	α-helix	trans	-62.2	-42.4	178.2	-54	0	0	0	0	111.2	T474 F476 R482	T474-T478 WeakPolarHBondContact O-CB 3.33Å; T474-T478 PolarHBondContact O-N 3.21Å; T474-T478 PolarHBondContact O-OG1 3.21Å; F476-T478 VanDerWaalsContact C-N 3.33Å; F476-T478 PolarHBondContact O-N 3.33Å; T478-R482 WeakPolarHBondContact O-CG 3.3Å; T478-R482 PolarHBondContact O-N 2.91Å
479	S	90.6	Very high	89.8	Confident	5 Å²	5	29.2 Å²	29.2	4%	0.035	15%	0.153	C	C	.	.	H	α-helix	trans	-69	-43.2	179.4	-59.7	0	0	0	0	112.3	T396 L399 T400 D475 F476 V477 Q481 R482 T483	T396-S479 WeakPolarHBondContact CG2-O 3.42Å; L399-S479 WeakPolarHBondContact CD2-OG 3.47Å; T400-S479 PolarHBondContact OG1-O 2.9Å; D475-S479 VanDerWaalsContact O-CB 3.3Å; D475-S479 WeakPolarHBondContact O-CB 3.46Å; D475-S479 PolarHBondContact O-N 2.77Å; D475-S479 VanDerWaalsContact O-N 3.08Å; D475-S479 PolarHBondContact O-OG 2.68Å; F476-S479 PolarHBondContact O-N 3.44Å; F476-S479 VanDerWaalsContact O-N 3.15Å; V477-S479 VanDerWaalsContact C-N 3.32Å; V477-S479 PolarHBondContact O-N 3.37Å; S479-Q481 PolarHBondContact O-N 3.24Å; S479-R482 PolarHBondContact O-N 3.28Å; S479-T483 WeakPolarHBondContact O-CB 3.41Å; S479-T483 PolarHBondContact O-N 3.08Å; S479-T483 PolarHBondContact O-OG1 3.24Å
480	I	91.3	Very high	89.8	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-56.8	-49.1	175.9	-73.3	163.1	0	0	0	110.3	T400 A403 F476 V477 R482 T483 I484 L608 L609 F611	T400-I480 HydrophobicContact CG2-CG1 4.08Å; T400-I480 PolarHBondContact OG1-N 3.43Å; A403-I480 HydrophobicContact CB-CD1 3.99Å; A403-I480 HydrophobicContact CB-CG1 4.46Å; F476-I480 HydrophobicContact CB-CD1 4.28Å; F476-I480 WeakPolarHBondContact O-CB 3.4Å; F476-I480 WeakPolarHBondContact O-CD1 3.28Å; F476-I480 WeakPolarHBondContact O-CG1 3.28Å; F476-I480 PolarHBondContact O-N 3.29Å; V477-I480 PolarHBondContact O-N 3.14Å; I480-R482 PolarHBondContact O-N 3.14Å; I480-T483 PolarHBondContact O-N 3.48Å; I480-I484 HydrophobicContact CG2-CD1 3.59Å; I480-I484 HydrophobicContact CG2-CG1 4.37Å; I480-I484 VanDerWaalsContact O-CB 3.32Å; I480-I484 WeakPolarHBondContact O-CB 3.42Å; I480-I484 VanDerWaalsContact O-CG1 3.3Å; I480-I484 WeakPolarHBondContact O-CG1 3.41Å; I480-I484 PolarHBondContact O-N 2.85Å; I480-L608 HydrophobicContact CD1-CB 4.18Å; I480-L608 HydrophobicContact CD1-CD2 3.97Å; I480-L608 HydrophobicContact CG1-CB 4.37Å; I480-L608 HydrophobicContact CG1-CD2 4.33Å; I480-L608 HydrophobicContact CG2-CB 3.75Å; I480-L609 HydrophobicContact CG2-CD2 4.12Å; I480-F611 HydrophobicContact CD1-CB 4.37Å; I480-F611 HydrophobicContact CD1-CD2 4.13Å; I480-F611 HydrophobicContact CD1-CG 4.47Å
481	Q	91.5	Very high	90	Very high	60 Å²	60	32.3 Å²	32.3	28%	0.28	17%	0.165	S	C	.	.	H	α-helix	trans	-60.1	-46.4	179.8	-73.5	172.6	-10.7	0	0	111.6	V477 S479 Y485 S555 A557 L609	V477-Q481 VanDerWaalsContact O-CG 3.29Å; V477-Q481 WeakPolarHBondContact O-CG 3.05Å; V477-Q481 PolarHBondContact O-N 2.82Å; S479-Q481 PolarHBondContact O-N 3.24Å; Q481-Y485 VanDerWaalsContact O-CB 3.23Å; Q481-Y485 WeakPolarHBondContact O-CB 3.43Å; Q481-Y485 PolarHBondContact O-N 3.17Å; Q481-S555 PolarHBondContact OE1-O 3.36Å; Q481-A557 HydrophobicContact CG-CB 4.43Å; Q481-L609 HydrophobicContact CG-CD2 4.44Å
482	R	91.2	Very high	90.4	Very high	63 Å²	63	27.5 Å²	27.5	24%	0.238	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-46.7	177.5	-77.4	-179.9	160	-170.9	-5	112.7	T396 T478 S479 I480 Y485 L486 V553 S555	T396-R482 HydrophobicContact CG2-CB 3.78Å; T478-R482 WeakPolarHBondContact O-CG 3.3Å; T478-R482 PolarHBondContact O-N 2.91Å; S479-R482 PolarHBondContact O-N 3.28Å; I480-R482 PolarHBondContact O-N 3.14Å; R482-Y485 PolarHBondContact O-N 3.24Å; R482-L486 WeakPolarHBondContact O-CB 3.18Å; R482-L486 PolarHBondContact O-N 2.83Å; R482-V553 HydrophobicContact CB-CG1 4.09Å; R482-V553 HydrophobicContact CG-CG1 4.18Å; R482-S555 VanDerWaalsContact CG-OG 3.31Å; R482-S555 WeakPolarHBondContact CG-OG 3.49Å; R482-S555 PolarHBondContact NE-OG 3.37Å
483	T	92.5	Very high	90.4	Very high	9 Å²	9	27.6 Å²	27.6	6%	0.055	14%	0.144	C	C	.	.	H	α-helix	trans	-66.4	-45.1	-179.3	-66.5	0	0	0	0	111.4	T396 K397 T400 S479 I480 L486 L487	T396-T483 PolarHBondContact O-OG1 3.26Å; K397-T483 HydrophobicContact CG-CG2 3.92Å; T400-T483 HydrophobicContact CG2-CG2 4.07Å; T400-T483 WeakPolarHBondContact OG1-CB 3.32Å; T400-T483 PolarHBondContact OG1-OG1 2.89Å; S479-T483 WeakPolarHBondContact O-CB 3.41Å; S479-T483 PolarHBondContact O-N 3.08Å; S479-T483 PolarHBondContact O-OG1 3.24Å; I480-T483 PolarHBondContact O-N 3.48Å; T483-L486 PolarHBondContact O-N 2.92Å; T483-L487 HydrophobicContact CG2-CD1 3.84Å; T483-L487 HydrophobicContact CG2-CG 4.38Å; T483-L487 WeakPolarHBondContact O-CB 3.32Å; T483-L487 VanDerWaalsContact O-CG 3.26Å; T483-L487 WeakPolarHBondContact O-CG 3.46Å; T483-L487 PolarHBondContact O-N 2.82Å
484	I	93	Very high	90.4	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-43.3	178	-71.2	175.1	0	0	0	110.6	I480 L487 S488 P558 W605 L608 L609	I480-I484 HydrophobicContact CG2-CD1 3.59Å; I480-I484 HydrophobicContact CG2-CG1 4.37Å; I480-I484 VanDerWaalsContact O-CB 3.32Å; I480-I484 WeakPolarHBondContact O-CB 3.42Å; I480-I484 VanDerWaalsContact O-CG1 3.3Å; I480-I484 WeakPolarHBondContact O-CG1 3.41Å; I480-I484 PolarHBondContact O-N 2.85Å; I484-L487 PolarHBondContact O-N 3Å; I484-S488 WeakPolarHBondContact O-CB 3.21Å; I484-S488 PolarHBondContact O-N 2.9Å; I484-S488 PolarHBondContact O-OG 3.14Å; I484-P558 HydrophobicContact CG2-CG 4.12Å; I484-W605 HydrophobicContact CD1-CB 3.84Å; I484-W605 HydrophobicContact CD1-CD2 4.38Å; I484-W605 HydrophobicContact CD1-CG 3.85Å; I484-W605 HydrophobicContact CG1-CB 4.46Å; I484-W605 HydrophobicContact CG1-CD2 4.05Å; I484-W605 HydrophobicContact CG1-CG 3.97Å; I484-W605 HydrophobicContact CG2-CD2 3.96Å; I484-W605 HydrophobicContact CG2-CE3 3.64Å; I484-W605 HydrophobicContact CG2-CG 4.46Å; I484-W605 HydrophobicContact CG2-CZ3 3.95Å; I484-L608 HydrophobicContact CD1-CB 4.46Å; I484-L609 HydrophobicContact CD1-CD1 4.3Å; I484-L609 HydrophobicContact CD1-CD2 3.77Å; I484-L609 HydrophobicContact CD1-CG 3.75Å
485	Y	92.8	Very high	90.6	Very high	10 Å²	10	26.7 Å²	26.7	4%	0.039	14%	0.142	C	C	.	.	H	α-helix	trans	-56.7	-53.7	174.8	-179.6	-91.7	0	0	0	111.2	Q481 R482 L487 S488 Q489 D524 S552 R554 V556	Q481-Y485 VanDerWaalsContact O-CB 3.23Å; Q481-Y485 WeakPolarHBondContact O-CB 3.43Å; Q481-Y485 PolarHBondContact O-N 3.17Å; R482-Y485 PolarHBondContact O-N 3.24Å; Y485-L487 PolarHBondContact O-N 2.64Å; Y485-S488 PolarHBondContact O-N 2.56Å; Y485-S488 VanDerWaalsContact O-N 3.14Å; Y485-S488 PolarHBondContact O-OG 3.27Å; Y485-Q489 HydrophobicContact CD1-CG 4.14Å; Y485-Q489 HydrophobicContact CD2-CG 4.48Å; Y485-Q489 HydrophobicContact CE1-CG 3.64Å; Y485-Q489 HydrophobicContact CE2-CG 4.07Å; Y485-Q489 WeakPolarHBondContact O-CG 3.37Å; Y485-Q489 PolarHBondContact O-N 3.19Å; Y485-D524 PolarHBondContact OH-OD2 3.1Å; Y485-S552 VanDerWaalsContact CE1-O 3.23Å; Y485-S552 WeakPolarHBondContact CE1-O 3.23Å; Y485-R554 HydrophobicContact CD1-CB 4.16Å; Y485-R554 HydrophobicContact CD2-CB 4.25Å; Y485-R554 HydrophobicContact CE1-CB 4Å; Y485-R554 HydrophobicContact CE1-CG 4.12Å; Y485-R554 HydrophobicContact CE2-CB 4.06Å; Y485-R554 HydrophobicContact CE2-CG 4.3Å; Y485-R554 HydrophobicContact CG-CB 4.28Å; Y485-V556 VanDerWaalsContact CB-O 3.29Å; Y485-V556 WeakPolarHBondContact CB-O 3.47Å; Y485-V556 HydrophobicContact CD2-CG1 4.06Å; Y485-V556 WeakPolarHBondContact CD2-O 3.21Å; Y485-V556 HydrophobicContact CE2-CG1 4.22Å
486	L	91.4	Very high	90.7	Very high	11 Å²	11	24.6 Å²	24.6	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-56.3	-48.7	-179.8	174.8	63.7	0	0	0	111.6	I393 R482 T483 S488 Q489 E490 I551 V553	I393-L486 HydrophobicContact CD1-CD2 4.45Å; I393-L486 HydrophobicContact CG2-CD2 3.43Å; I393-L486 VanDerWaalsContact CG2-CD2 3.43Å; R482-L486 WeakPolarHBondContact O-CB 3.18Å; R482-L486 PolarHBondContact O-N 2.83Å; T483-L486 PolarHBondContact O-N 2.92Å; L486-S488 VanDerWaalsContact C-N 3.31Å; L486-S488 PolarHBondContact O-N 3.48Å; L486-Q489 PolarHBondContact O-N 3.15Å; L486-E490 HydrophobicContact CD1-CG 4.26Å; L486-E490 WeakPolarHBondContact O-CB 3.27Å; L486-E490 PolarHBondContact O-N 3.36Å; L486-I551 HydrophobicContact CD1-CB 4.43Å; L486-I551 HydrophobicContact CD1-CG2 4.14Å; L486-V553 HydrophobicContact CD1-CG2 4.16Å
487	L	91.8	Very high	90.5	Very high	25 Å²	25	28.1 Å²	28.1	13%	0.131	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-35	179.8	-68.5	172.8	0	0	0	112.3	T483 I484 Y485 L491 W605	T483-L487 HydrophobicContact CG2-CD1 3.84Å; T483-L487 HydrophobicContact CG2-CG 4.38Å; T483-L487 WeakPolarHBondContact O-CB 3.32Å; T483-L487 VanDerWaalsContact O-CG 3.26Å; T483-L487 WeakPolarHBondContact O-CG 3.46Å; T483-L487 PolarHBondContact O-N 2.82Å; I484-L487 PolarHBondContact O-N 3Å; Y485-L487 PolarHBondContact O-N 2.64Å; L487-L491 WeakPolarHBondContact O-CB 3.38Å; L487-L491 PolarHBondContact O-N 2.98Å; L487-L491 VanDerWaalsContact O-N 3.08Å; L487-W605 HydrophobicContact CB-CH2 3.82Å; L487-W605 HydrophobicContact CB-CZ2 3.75Å; L487-W605 HydrophobicContact CD1-CZ2 3.9Å
488	S	92	Very high	90.4	Very high	7 Å²	7	29.1 Å²	29.1	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-67.4	-41.3	175.4	72.9	0	0	0	0	111.8	I484 Y485 L486 L491 V492	I484-S488 WeakPolarHBondContact O-CB 3.21Å; I484-S488 PolarHBondContact O-N 2.9Å; I484-S488 PolarHBondContact O-OG 3.14Å; Y485-S488 PolarHBondContact O-N 2.56Å; Y485-S488 VanDerWaalsContact O-N 3.14Å; Y485-S488 PolarHBondContact O-OG 3.27Å; L486-S488 VanDerWaalsContact C-N 3.31Å; L486-S488 PolarHBondContact O-N 3.48Å; S488-L491 WeakPolarHBondContact O-CB 3.38Å; S488-L491 PolarHBondContact O-N 2.83Å; S488-V492 WeakPolarHBondContact O-CG2 3.26Å; S488-V492 PolarHBondContact O-N 3.28Å
489	Q	91.7	Very high	90.3	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.019	13%	0.13	C	C	.	.	H	α-helix	trans	-72.8	-39.3	177	-63.5	-52	-39.3	0	0	112.1	Y485 L486 L491 V492 Q493 V522 I551	Y485-Q489 HydrophobicContact CD1-CG 4.14Å; Y485-Q489 HydrophobicContact CD2-CG 4.48Å; Y485-Q489 HydrophobicContact CE1-CG 3.64Å; Y485-Q489 HydrophobicContact CE2-CG 4.07Å; Y485-Q489 WeakPolarHBondContact O-CG 3.37Å; Y485-Q489 PolarHBondContact O-N 3.19Å; L486-Q489 PolarHBondContact O-N 3.15Å; Q489-L491 PolarHBondContact O-N 2.77Å; Q489-V492 PolarHBondContact O-N 3.22Å; Q489-Q493 VanDerWaalsContact O-CB 3.28Å; Q489-Q493 WeakPolarHBondContact O-CB 3.36Å; Q489-Q493 WeakPolarHBondContact O-CG 3.43Å; Q489-Q493 PolarHBondContact O-N 3Å; Q489-V522 PolarHBondContact NE2-O 3.09Å; Q489-I551 HydrophobicContact CB-CD1 4.23Å; Q489-I551 HydrophobicContact CB-CG2 3.61Å; Q489-I551 HydrophobicContact CG-CG2 4.24Å
490	E	90.6	Very high	90.2	Very high	72 Å²	72	26.2 Å²	26.2	34%	0.336	13%	0.129	S	C	.	.	I	π-helix	trans	-59	-37.2	172.6	-86	-175.5	148.7	0	0	111.5	L486 V494 T495 I551	L486-E490 HydrophobicContact CD1-CG 4.26Å; L486-E490 WeakPolarHBondContact O-CB 3.27Å; L486-E490 PolarHBondContact O-N 3.36Å; E490-V494 WeakPolarHBondContact O-CB 3.39Å; E490-V494 PolarHBondContact O-N 2.68Å; E490-T495 PolarHBondContact O-N 2.74Å; E490-T495 PolarHBondContact O-OG1 3.25Å; E490-T495 VanDerWaalsContact O-OG1 3.08Å; E490-I551 HydrophobicContact CB-CD1 4.23Å; E490-I551 HydrophobicContact CG-CD1 3.61Å
491	L	91.9	Very high	89.8	Confident	7 Å²	7	30.2 Å²	30.2	4%	0.037	14%	0.144	C	C	.	.	I	π-helix	trans	-60.6	-56.1	173.8	178.4	72.1	0	0	0	110.7	L487 S488 Q489 T495 L496 V566 L570 F598	L487-L491 WeakPolarHBondContact O-CB 3.38Å; L487-L491 PolarHBondContact O-N 2.98Å; L487-L491 VanDerWaalsContact O-N 3.08Å; S488-L491 WeakPolarHBondContact O-CB 3.38Å; S488-L491 PolarHBondContact O-N 2.83Å; Q489-L491 PolarHBondContact O-N 2.77Å; L491-T495 HydrophobicContact CD1-CG2 4.28Å; L491-T495 WeakPolarHBondContact O-CB 3.35Å; L491-T495 PolarHBondContact O-N 3.35Å; L491-L496 HydrophobicContact CD1-CD1 4.43Å; L491-L496 HydrophobicContact CD1-CD2 4.2Å; L491-L496 HydrophobicContact CD1-CG 4.06Å; L491-L496 HydrophobicContact CD2-CD1 4.48Å; L491-L496 HydrophobicContact CG-CD1 4.09Å; L491-L496 HydrophobicContact CG-CG 4.11Å; L491-L496 WeakPolarHBondContact O-CB 3.46Å; L491-L496 WeakPolarHBondContact O-CG 3.43Å; L491-L496 PolarHBondContact O-N 2.73Å; L491-V566 HydrophobicContact CD2-CG1 4.21Å; L491-L570 HydrophobicContact CD2-CD1 3.67Å; L491-F598 HydrophobicContact CB-CD2 4.1Å; L491-F598 HydrophobicContact CB-CE2 4.01Å; L491-F598 HydrophobicContact CD1-CB 4.2Å; L491-F598 HydrophobicContact CD1-CD2 3.95Å; L491-F598 HydrophobicContact CD1-CE2 4.49Å; L491-F598 HydrophobicContact CD1-CG 3.98Å; L491-F598 HydrophobicContact CD2-CD1 3.84Å; L491-F598 HydrophobicContact CD2-CD2 3.64Å; L491-F598 HydrophobicContact CD2-CE1 3.63Å; L491-F598 HydrophobicContact CD2-CE2 3.37Å; L491-F598 HydrophobicContact CD2-CG 3.86Å; L491-F598 HydrophobicContact CD2-CZ 3.39Å; L491-F598 HydrophobicContact CG-CD2 4.08Å; L491-F598 HydrophobicContact CG-CE2 4.13Å; L491-F598 HydrophobicContact CG-CG 4.43Å
492	V	90	Very high	89.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.141	C	C	.	.	I	π-helix	trans	-82.6	-28.2	-168.6	-67.2	0	0	0	0	114.9	S488 Q489 L496 V518 R519 V522 V523	S488-V492 WeakPolarHBondContact O-CG2 3.26Å; S488-V492 PolarHBondContact O-N 3.28Å; Q489-V492 PolarHBondContact O-N 3.22Å; V492-L496 HydrophobicContact CG1-CD1 4.31Å; V492-V518 HydrophobicContact CG1-CG1 4.24Å; V492-R519 HydrophobicContact CB-CG 4.04Å; V492-R519 WeakPolarHBondContact O-CD 3.37Å; V492-R519 WeakPolarHBondContact O-CG 3.4Å; V492-R519 PolarHBondContact O-NE 3.04Å; V492-V522 HydrophobicContact CG1-CG2 3.72Å; V492-V523 HydrophobicContact CG2-CB 4.18Å; V492-V523 HydrophobicContact CG2-CG2 4.26Å
493	Q	87.6	Confident	89.3	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.014	13%	0.132	C	C	.	.	I	π-helix	trans	-91.3	-34.2	-179	-57.8	-171.3	23.4	0	0	112.2	Q489 V523 D524 I549	Q489-Q493 VanDerWaalsContact O-CB 3.28Å; Q489-Q493 WeakPolarHBondContact O-CB 3.36Å; Q489-Q493 WeakPolarHBondContact O-CG 3.43Å; Q489-Q493 PolarHBondContact O-N 3Å; Q493-V523 HydrophobicContact CG-CG2 4Å; Q493-D524 PolarHBondContact NE2-O 2.76Å; Q493-I549 HydrophobicContact CB-CG2 4.26Å; Q493-I549 WeakPolarHBondContact O-CD1 3.27Å
494	V	88	Confident	89	Confident	76 Å²	76	28.1 Å²	28.1	46%	0.461	14%	0.138	S	C	.	.	I	π-helix	trans	-111.2	-59.5	-174.9	-174.4	0	0	0	0	111.7	E490 L496 R497 I549 I551	E490-V494 WeakPolarHBondContact O-CB 3.39Å; E490-V494 PolarHBondContact O-N 2.68Å; V494-L496 PolarHBondContact O-N 3.16Å; V494-R497 VanDerWaalsContact O-CB 3.28Å; V494-R497 WeakPolarHBondContact O-CB 3.22Å; V494-R497 PolarHBondContact O-N 2.65Å; V494-I549 HydrophobicContact CG2-CB 4.46Å; V494-I549 HydrophobicContact CG2-CD1 4.45Å; V494-I551 HydrophobicContact CG2-CD1 4.3Å
495	T	89.3	Confident	88.6	Confident	55 Å²	55	35 Å²	35	34%	0.337	17%	0.168	S	C	.	.	I	π-helix	trans	-67.9	-42.2	-167.7	-52.9	0	0	0	0	112.9	E490 L491 R497 P499 A594	E490-T495 PolarHBondContact O-N 2.74Å; E490-T495 PolarHBondContact O-OG1 3.25Å; E490-T495 VanDerWaalsContact O-OG1 3.08Å; L491-T495 HydrophobicContact CD1-CG2 4.28Å; L491-T495 WeakPolarHBondContact O-CB 3.35Å; L491-T495 PolarHBondContact O-N 3.35Å; T495-R497 VanDerWaalsContact C-N 3.31Å; T495-P499 WeakPolarHBondContact O-CD 3.29Å; T495-A594 HydrophobicContact CG2-CB 3.98Å
496	L	89.7	Confident	88.3	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.9	-179.6	-63.6	-176.2	0	0	0	113.5	L491 V492 V494 P499 L500 L515 V518 L570 I595	L491-L496 HydrophobicContact CD1-CD1 4.43Å; L491-L496 HydrophobicContact CD1-CD2 4.2Å; L491-L496 HydrophobicContact CD1-CG 4.06Å; L491-L496 HydrophobicContact CD2-CD1 4.48Å; L491-L496 HydrophobicContact CG-CD1 4.09Å; L491-L496 HydrophobicContact CG-CG 4.11Å; L491-L496 WeakPolarHBondContact O-CB 3.46Å; L491-L496 WeakPolarHBondContact O-CG 3.43Å; L491-L496 PolarHBondContact O-N 2.73Å; V492-L496 HydrophobicContact CG1-CD1 4.31Å; V494-L496 PolarHBondContact O-N 3.16Å; L496-P499 WeakPolarHBondContact O-CD 3.27Å; L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 PolarHBondContact O-N 2.76Å; L496-L515 HydrophobicContact CD1-CD2 4.44Å; L496-L515 HydrophobicContact CD2-CD2 3.92Å; L496-V518 HydrophobicContact CD1-CB 4.35Å; L496-V518 HydrophobicContact CD1-CG1 3.59Å; L496-L570 HydrophobicContact CD1-CD2 4.24Å; L496-L570 HydrophobicContact CD2-CD2 4.2Å; L496-I595 HydrophobicContact CD2-CD1 4.46Å; L496-I595 HydrophobicContact CD2-CG1 4.26Å
497	R	86.5	Confident	87.9	Confident	74 Å²	74	47.4 Å²	47.4	28%	0.279	23%	0.227	S	C	.	.	H	α-helix	trans	-63	-49.5	-177.2	-162.3	178.6	171.9	-157.2	-5	112.2	V494 T495 L500 R501 D533 I534	V494-R497 VanDerWaalsContact O-CB 3.28Å; V494-R497 WeakPolarHBondContact O-CB 3.22Å; V494-R497 PolarHBondContact O-N 2.65Å; T495-R497 VanDerWaalsContact C-N 3.31Å; R497-L500 PolarHBondContact O-N 2.94Å; R497-R501 WeakPolarHBondContact O-CB 3.34Å; R497-R501 PolarHBondContact O-N 3.46Å; R497-D533 IonicContact CZ-OD2 2.7Å; R497-D533 IonicContact NH2-OD2 3.25Å; R497-D533 PolarHBondContact NH2-OD2 2.85Å; R497-I534 HydrophobicContact CG-CD1 4.22Å; R497-I534 HydrophobicContact CG-CG1 4.12Å
498	E	85.6	Confident	87.6	Confident	61 Å²	61	49.9 Å²	49.9	29%	0.285	24%	0.236	S	C	.	.	H	α-helix	trans	-70.8	-43.1	179	-173	63.4	-173.4	0	0	113.7	L500 R501 K502	E498-L500 VanDerWaalsContact C-N 3.3Å; E498-L500 PolarHBondContact O-N 3.03Å; E498-R501 PolarHBondContact O-N 3.11Å; E498-R501 IonicContact OE1-CZ 2.66Å; E498-R501 IonicContact OE1-NE 2.72Å; E498-R501 IonicContact OE1-NH2 3.49Å; E498-R501 PolarHBondContact OE1-NH2 3.48Å; E498-R501 IonicContact OE2-CZ 3.17Å; E498-R501 VanDerWaalsContact OE2-CZ 3.31Å; E498-R501 IonicContact OE2-NE 3.75Å; E498-R501 PolarHBondContact OE2-NE 2.83Å; E498-R501 IonicContact OE2-NH2 3.77Å; E498-R501 PolarHBondContact OE2-NH2 3.31Å; E498-R501 VanDerWaalsContact OE2-NH2 3.14Å; E498-K502 PolarHBondContact O-N 3.22Å; E498-K502 VanDerWaalsContact OE1-CE 3.27Å; E498-K502 WeakPolarHBondContact OE1-CE 3.46Å
499	P	87.8	Confident	87.2	Confident	8 Å²	8	54.6 Å²	54.6	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-52.8	-45.3	169.5	-26.2	31.2	0	0	0	113.2	T495 L496 K502 A503 L515 H591	T495-P499 WeakPolarHBondContact O-CD 3.29Å; L496-P499 WeakPolarHBondContact O-CD 3.27Å; P499-K502 PolarHBondContact O-N 2.65Å; P499-A503 WeakPolarHBondContact O-CB 3.04Å; P499-A503 PolarHBondContact O-N 2.99Å; P499-L515 HydrophobicContact CB-CD1 3.78Å; P499-H591 HydrophobicContact CG-CB 4.05Å
500	L	87.4	Confident	86.8	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-67.7	-42.4	-179.7	-178.7	64.2	0	0	0	111.6	L496 R497 E498 K502 A503 T504 R512 L515 Q516 I534	L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 PolarHBondContact O-N 2.76Å; R497-L500 PolarHBondContact O-N 2.94Å; E498-L500 VanDerWaalsContact C-N 3.3Å; E498-L500 PolarHBondContact O-N 3.03Å; L500-K502 PolarHBondContact O-N 2.89Å; L500-A503 PolarHBondContact O-N 2.95Å; L500-T504 WeakPolarHBondContact O-CB 3.46Å; L500-T504 PolarHBondContact O-N 3.16Å; L500-T504 PolarHBondContact O-OG1 2.86Å; L500-R512 HydrophobicContact CD1-CG 3.88Å; L500-L515 HydrophobicContact CB-CB 4.47Å; L500-L515 HydrophobicContact CB-CD1 4.4Å; L500-L515 HydrophobicContact CD1-CB 3.83Å; L500-Q516 HydrophobicContact CD1-CB 4.29Å; L500-I534 HydrophobicContact CD2-CG2 4.01Å; L500-I534 HydrophobicContact CG-CG2 4.22Å
501	R	84.5	Confident	86.6	Confident	86 Å²	86	55.7 Å²	55.7	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-60.5	-45.2	175	-168.1	-178.2	74.6	137.4	-1.4	111.4	R497 E498 T504 K505	R497-R501 WeakPolarHBondContact O-CB 3.34Å; R497-R501 PolarHBondContact O-N 3.46Å; E498-R501 PolarHBondContact O-N 3.11Å; E498-R501 IonicContact OE1-CZ 2.66Å; E498-R501 IonicContact OE1-NE 2.72Å; E498-R501 IonicContact OE1-NH2 3.49Å; E498-R501 PolarHBondContact OE1-NH2 3.48Å; E498-R501 IonicContact OE2-CZ 3.17Å; E498-R501 VanDerWaalsContact OE2-CZ 3.31Å; E498-R501 IonicContact OE2-NE 3.75Å; E498-R501 PolarHBondContact OE2-NE 2.83Å; E498-R501 IonicContact OE2-NH2 3.77Å; E498-R501 PolarHBondContact OE2-NH2 3.31Å; E498-R501 VanDerWaalsContact OE2-NH2 3.14Å; R501-T504 PolarHBondContact O-N 2.87Å; R501-K505 WeakPolarHBondContact O-CB 3.28Å; R501-K505 PolarHBondContact O-N 3.41Å
502	K	85.5	Confident	86.4	Confident	51 Å²	51	58.4 Å²	58.4	22%	0.222	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-43.3	177.1	-76	-174.8	-177.2	179.8	0	112.3	E498 P499 L500 T504 K505 N506 E588	E498-K502 PolarHBondContact O-N 3.22Å; E498-K502 VanDerWaalsContact OE1-CE 3.27Å; E498-K502 WeakPolarHBondContact OE1-CE 3.46Å; P499-K502 PolarHBondContact O-N 2.65Å; L500-K502 PolarHBondContact O-N 2.89Å; K502-T504 VanDerWaalsContact C-N 3.27Å; K502-T504 PolarHBondContact O-N 3.44Å; K502-K505 PolarHBondContact O-N 2.85Å; K502-N506 VanDerWaalsContact O-CB 3.26Å; K502-N506 WeakPolarHBondContact O-CB 3.44Å; K502-N506 PolarHBondContact O-N 3.31Å; K502-E588 IonicContact NZ-OE1 3.3Å; K502-E588 PolarHBondContact NZ-OE1 3.02Å; K502-E588 IonicContact NZ-OE2 3.74Å; K502-E588 PolarHBondContact NZ-OE2 3.22Å
503	A	86.4	Confident	86.3	Confident	7 Å²	7	60.5 Å²	60.5	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-41.1	176.5	0	0	0	0	0	111.4	P499 L500 K507 K508 I511 R512 L515	P499-A503 WeakPolarHBondContact O-CB 3.04Å; P499-A503 PolarHBondContact O-N 2.99Å; L500-A503 PolarHBondContact O-N 2.95Å; A503-K507 PolarHBondContact O-N 3.27Å; A503-K508 HydrophobicContact CB-CB 4.45Å; A503-K508 PolarHBondContact O-N 2.84Å; A503-I511 HydrophobicContact CB-CB 4.28Å; A503-I511 HydrophobicContact CB-CG2 3.96Å; A503-R512 HydrophobicContact CB-CB 4.06Å; A503-L515 HydrophobicContact CB-CD1 4.44Å
504	T	85.2	Confident	86.4	Confident	30 Å²	30	60.4 Å²	60.4	18%	0.184	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-50.3	175	-55.3	0	0	0	0	111.5	L500 R501 K502 N506 K507 R512 Y535	L500-T504 WeakPolarHBondContact O-CB 3.46Å; L500-T504 PolarHBondContact O-N 3.16Å; L500-T504 PolarHBondContact O-OG1 2.86Å; R501-T504 PolarHBondContact O-N 2.87Å; K502-T504 VanDerWaalsContact C-N 3.27Å; K502-T504 PolarHBondContact O-N 3.44Å; T504-N506 VanDerWaalsContact C-N 3.33Å; T504-N506 PolarHBondContact O-N 2.97Å; T504-K507 PolarHBondContact O-N 3.41Å; T504-R512 WeakPolarHBondContact OG1-CD 3.33Å; T504-Y535 HydrophobicContact CG2-CD1 4.03Å; T504-Y535 HydrophobicContact CG2-CE1 4.13Å
505	K	85	Confident	86.5	Confident	146 Å²	146	56.8 Å²	56.8	64%	0.635	27%	0.267	S	S	*	.	H	α-helix	trans	-60.5	-41.2	179.7	-177.3	179.8	176.6	-179.6	0	112.5	R501 K502 K507	R501-K505 WeakPolarHBondContact O-CB 3.28Å; R501-K505 PolarHBondContact O-N 3.41Å; K502-K505 PolarHBondContact O-N 2.85Å; K505-K507 VanDerWaalsContact C-N 3.27Å; K505-K507 PolarHBondContact O-N 3.26Å
506	N	85.4	Confident	86.4	Confident	103 Å²	103	55.9 Å²	55.9	55%	0.551	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	7.1	-177.8	-63.8	-13.6	0	0	0	113	K502 T504 K508	K502-N506 VanDerWaalsContact O-CB 3.26Å; K502-N506 WeakPolarHBondContact O-CB 3.44Å; K502-N506 PolarHBondContact O-N 3.31Å; T504-N506 VanDerWaalsContact C-N 3.33Å; T504-N506 PolarHBondContact O-N 2.97Å; N506-K508 HydrophobicContact CB-CG 4.17Å; N506-K508 PolarHBondContact O-N 3.28Å
507	K	83.3	Confident	86.4	Confident	177 Å²	177	56.1 Å²	56.1	77%	0.77	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	35.1	-179.1	-57.8	-176.6	178	-177.4	0	113.6	A503 T504 K505 E509	A503-K507 PolarHBondContact O-N 3.27Å; T504-K507 PolarHBondContact O-N 3.41Å; K505-K507 VanDerWaalsContact C-N 3.27Å; K505-K507 PolarHBondContact O-N 3.26Å; K507-E509 VanDerWaalsContact C-N 3.31Å; K507-E509 PolarHBondContact O-N 2.96Å; K507-E509 VanDerWaalsContact O-N 3.15Å
508	K	85.3	Confident	86.6	Confident	77 Å²	77	52.6 Å²	52.6	34%	0.335	25%	0.248	S	C	.	.			trans	-86.5	70.5	175.1	-66.8	-73.7	-171.6	166.2	0	109.5	A503 N506 L510 I511 R512 D586	A503-K508 HydrophobicContact CB-CB 4.45Å; A503-K508 PolarHBondContact O-N 2.84Å; N506-K508 HydrophobicContact CB-CG 4.17Å; N506-K508 PolarHBondContact O-N 3.28Å; K508-L510 VanDerWaalsContact C-N 3.32Å; K508-L510 PolarHBondContact O-N 2.97Å; K508-I511 HydrophobicContact CB-CB 4.36Å; K508-I511 HydrophobicContact CB-CD1 4.38Å; K508-I511 PolarHBondContact O-N 2.92Å; K508-I511 VanDerWaalsContact O-N 3.12Å; K508-R512 PolarHBondContact O-N 3.38Å; K508-D586 IonicContact NZ-OD1 3.89Å; K508-D586 PolarHBondContact NZ-OD1 3.08Å; K508-D586 IonicContact NZ-OD2 2.8Å; K508-D586 PolarHBondContact NZ-OD2 2.83Å
509	E	83.8	Confident	86.8	Confident	107 Å²	107	50.1 Å²	50.1	50%	0.5	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-36.1	-167.6	-79.5	-56.4	159	0	0	115	K507 R512 S513	K507-E509 VanDerWaalsContact C-N 3.31Å; K507-E509 PolarHBondContact O-N 2.96Å; K507-E509 VanDerWaalsContact O-N 3.15Å; E509-R512 PolarHBondContact O-N 3.32Å; E509-R512 IonicContact OE1-NH1 2.7Å; E509-R512 WeakPolarHBondContact OE2-CD 3.42Å; E509-S513 WeakPolarHBondContact O-CB 3.31Å; E509-S513 PolarHBondContact O-N 3.41Å
510	L	84.1	Confident	86.8	Confident	90 Å²	90	53.4 Å²	53.4	47%	0.471	25%	0.253	S	S	.	.	H	α-helix	trans	-69.1	-37.8	179.3	-138.5	93.1	0	0	0	112.8	K508 S513 I514 F583	K508-L510 VanDerWaalsContact C-N 3.32Å; K508-L510 PolarHBondContact O-N 2.97Å; L510-S513 PolarHBondContact O-OG 3.46Å; L510-I514 VanDerWaalsContact O-CG1 3.26Å; L510-I514 WeakPolarHBondContact O-CG1 3.2Å; L510-I514 PolarHBondContact O-N 3Å; L510-I514 VanDerWaalsContact O-N 3.14Å; L510-F583 HydrophobicContact CB-CE1 4.23Å; L510-F583 HydrophobicContact CD2-CE1 3.47Å; L510-F583 VanDerWaalsContact CD2-CE1 3.47Å; L510-F583 HydrophobicContact CD2-CE2 4.35Å; L510-F583 HydrophobicContact CD2-CZ 3.24Å; L510-F583 HydrophobicContact CG-CE1 4.47Å
511	I	86.9	Confident	86.9	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-70.2	-41.8	176.8	-63.8	177.1	0	0	0	109.1	A503 K508 S513 I514 L515 L573 F583 D586	A503-I511 HydrophobicContact CB-CB 4.28Å; A503-I511 HydrophobicContact CB-CG2 3.96Å; K508-I511 HydrophobicContact CB-CB 4.36Å; K508-I511 HydrophobicContact CB-CD1 4.38Å; K508-I511 PolarHBondContact O-N 2.92Å; K508-I511 VanDerWaalsContact O-N 3.12Å; I511-S513 PolarHBondContact O-N 2.86Å; I511-I514 PolarHBondContact O-N 3.37Å; I511-L515 HydrophobicContact CG2-CD1 3.77Å; I511-L515 HydrophobicContact CG2-CG 4.23Å; I511-L515 WeakPolarHBondContact O-CB 3.5Å; I511-L515 VanDerWaalsContact O-CG 3.29Å; I511-L515 WeakPolarHBondContact O-CG 3.31Å; I511-L515 PolarHBondContact O-N 3.21Å; I511-L573 HydrophobicContact CG1-CD2 4.39Å; I511-L573 HydrophobicContact CG2-CD2 4.25Å; I511-F583 HydrophobicContact CD1-CD1 4.35Å; I511-F583 HydrophobicContact CG1-CD1 3.89Å; I511-D586 HydrophobicContact CD1-CB 3.49Å; I511-D586 VanDerWaalsContact CD1-CB 3.49Å
512	R	87.3	Confident	87.1	Confident	65 Å²	65	50.1 Å²	50.1	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-57.7	-48.2	174.4	-179.3	-170.4	168.2	176.9	-1.9	110.9	L500 A503 T504 K508 E509 I514 L515 Q516 Y535	L500-R512 HydrophobicContact CD1-CG 3.88Å; A503-R512 HydrophobicContact CB-CB 4.06Å; T504-R512 WeakPolarHBondContact OG1-CD 3.33Å; K508-R512 PolarHBondContact O-N 3.38Å; E509-R512 PolarHBondContact O-N 3.32Å; E509-R512 IonicContact OE1-NH1 2.7Å; E509-R512 WeakPolarHBondContact OE2-CD 3.42Å; R512-I514 PolarHBondContact O-N 2.98Å; R512-L515 PolarHBondContact O-N 2.65Å; R512-Q516 VanDerWaalsContact O-CB 3.28Å; R512-Q516 WeakPolarHBondContact O-CB 2.97Å; R512-Q516 PolarHBondContact O-N 3.14Å; R512-Y535 VanDerWaalsContact CZ-CE1 3.49Å
513	S	88.3	Confident	87.3	Confident	43 Å²	43	49.4 Å²	49.4	30%	0.301	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-42.6	-178.1	75.1	0	0	0	0	111.8	E509 L510 I511 Q516 S517	E509-S513 WeakPolarHBondContact O-CB 3.31Å; E509-S513 PolarHBondContact O-N 3.41Å; L510-S513 PolarHBondContact O-OG 3.46Å; I511-S513 PolarHBondContact O-N 2.86Å; S513-Q516 PolarHBondContact O-N 3.46Å; S513-S517 WeakPolarHBondContact O-CB 3.12Å; S513-S517 PolarHBondContact O-N 2.74Å; S513-S517 PolarHBondContact O-OG 3.13Å
514	I	89	Confident	87.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-48.5	176.4	-64.4	166.9	0	0	0	110.7	I57 L510 I511 R512 Q516 S517 V518 M569 L573	I57-I514 HydrophobicContact CD1-CD1 4.19Å; I57-I514 HydrophobicContact CD1-CG1 3.54Å; L510-I514 VanDerWaalsContact O-CG1 3.26Å; L510-I514 WeakPolarHBondContact O-CG1 3.2Å; L510-I514 PolarHBondContact O-N 3Å; L510-I514 VanDerWaalsContact O-N 3.14Å; I511-I514 PolarHBondContact O-N 3.37Å; R512-I514 PolarHBondContact O-N 2.98Å; I514-Q516 PolarHBondContact O-N 3.45Å; I514-S517 WeakPolarHBondContact O-CB 3.24Å; I514-S517 PolarHBondContact O-N 3.4Å; I514-V518 WeakPolarHBondContact O-CG2 3.45Å; I514-V518 PolarHBondContact O-N 3.19Å; I514-M569 HydrophobicContact CG2-CB 3.98Å; I514-L573 HydrophobicContact CB-CD2 4.13Å; I514-L573 HydrophobicContact CD1-CD2 3.86Å; I514-L573 HydrophobicContact CG2-CD1 3.93Å; I514-L573 HydrophobicContact CG2-CD2 3.97Å; I514-L573 HydrophobicContact CG2-CG 3.88Å
515	L	89.7	Confident	87	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-40.5	179.8	-73	175.2	0	0	0	112.4	L496 P499 L500 A503 I511 R512 V518 R519 L573	L496-L515 HydrophobicContact CD1-CD2 4.44Å; L496-L515 HydrophobicContact CD2-CD2 3.92Å; P499-L515 HydrophobicContact CB-CD1 3.78Å; L500-L515 HydrophobicContact CB-CB 4.47Å; L500-L515 HydrophobicContact CB-CD1 4.4Å; L500-L515 HydrophobicContact CD1-CB 3.83Å; A503-L515 HydrophobicContact CB-CD1 4.44Å; I511-L515 HydrophobicContact CG2-CD1 3.77Å; I511-L515 HydrophobicContact CG2-CG 4.23Å; I511-L515 WeakPolarHBondContact O-CB 3.5Å; I511-L515 VanDerWaalsContact O-CG 3.29Å; I511-L515 WeakPolarHBondContact O-CG 3.31Å; I511-L515 PolarHBondContact O-N 3.21Å; R512-L515 PolarHBondContact O-N 2.65Å; L515-V518 PolarHBondContact O-N 3.09Å; L515-R519 PolarHBondContact O-N 3.23Å; L515-R519 VanDerWaalsContact O-N 3.09Å; L515-L573 HydrophobicContact CD2-CD1 3.59Å; L515-L573 HydrophobicContact CG-CD1 4.02Å
516	Q	88.8	Confident	86.2	Confident	35 Å²	35	48.6 Å²	48.6	16%	0.164	25%	0.245	C	C	.	.	H	α-helix	trans	-65.9	-42.9	175.2	-173.4	65.4	48.5	0	0	110.8	L500 R512 S513 I514 V518 R519 D520 Y535	L500-Q516 HydrophobicContact CD1-CB 4.29Å; R512-Q516 VanDerWaalsContact O-CB 3.28Å; R512-Q516 WeakPolarHBondContact O-CB 2.97Å; R512-Q516 PolarHBondContact O-N 3.14Å; S513-Q516 PolarHBondContact O-N 3.46Å; I514-Q516 PolarHBondContact O-N 3.45Å; Q516-V518 VanDerWaalsContact C-N 3.33Å; Q516-V518 PolarHBondContact O-N 3.42Å; Q516-R519 WeakPolarHBondContact O-CA 3.39Å; Q516-R519 WeakPolarHBondContact O-CB 3.07Å; Q516-R519 PolarHBondContact O-N 3.43Å; Q516-D520 PolarHBondContact NE2-OD1 2.66Å; Q516-D520 VanDerWaalsContact O-CG 3.23Å; Q516-D520 PolarHBondContact O-N 2.8Å; Q516-Y535 PolarHBondContact OE1-OH 3.12Å
517	S	89.4	Confident	84.8	Confident	7 Å²	7	46.2 Å²	46.2	5%	0.049	24%	0.237	C	C	.	.	H	α-helix	trans	-59.4	-43.5	176.2	-56.4	0	0	0	0	111.8	T55 S513 I514 R519 D520 T521 M569	T55-S517 PolarHBondContact O-OG 2.91Å; S513-S517 WeakPolarHBondContact O-CB 3.12Å; S513-S517 PolarHBondContact O-N 2.74Å; S513-S517 PolarHBondContact O-OG 3.13Å; I514-S517 WeakPolarHBondContact O-CB 3.24Å; I514-S517 PolarHBondContact O-N 3.4Å; S517-R519 VanDerWaalsContact C-N 3.28Å; S517-R519 PolarHBondContact O-N 3.24Å; S517-D520 PolarHBondContact O-N 2.99Å; S517-T521 WeakPolarHBondContact O-CB 2.88Å; S517-T521 PolarHBondContact O-N 2.93Å; S517-T521 VanDerWaalsContact O-N 3.08Å; S517-T521 PolarHBondContact O-OG1 3.14Å; S517-M569 VanDerWaalsContact CB-SD 3.52Å
518	V	90.7	Very high	83.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-44.9	173.8	169.7	0	0	0	0	110.5	V492 L496 I514 L515 Q516 V522 V566 M569 L570	V492-V518 HydrophobicContact CG1-CG1 4.24Å; L496-V518 HydrophobicContact CD1-CB 4.35Å; L496-V518 HydrophobicContact CD1-CG1 3.59Å; I514-V518 WeakPolarHBondContact O-CG2 3.45Å; I514-V518 PolarHBondContact O-N 3.19Å; L515-V518 PolarHBondContact O-N 3.09Å; Q516-V518 VanDerWaalsContact C-N 3.33Å; Q516-V518 PolarHBondContact O-N 3.42Å; V518-V522 WeakPolarHBondContact O-CG2 3.42Å; V518-V566 HydrophobicContact CG1-CG1 4.08Å; V518-V566 HydrophobicContact CG1-CG2 4.35Å; V518-M569 HydrophobicContact CB-CE 4.43Å; V518-M569 HydrophobicContact CG2-CB 3.44Å; V518-M569 VanDerWaalsContact CG2-CB 3.44Å; V518-M569 HydrophobicContact CG2-CE 3.86Å; V518-M569 HydrophobicContact CG2-CG 4.33Å; V518-M569 HydrophobicContact CG2-SD 4.03Å; V518-L570 HydrophobicContact CG1-CD1 4.5Å; V518-L570 HydrophobicContact CG1-CD2 4.3Å; V518-L570 HydrophobicContact CG1-CG 4.28Å; V518-L570 HydrophobicContact CG2-CD2 4.24Å; V518-L570 HydrophobicContact CG2-CG 4.18Å
519	R	89.4	Confident	81.7	Confident	10 Å²	10	51.8 Å²	51.8	4%	0.038	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-51.6	179.8	-151.2	175.3	175	-130.8	-2.8	111.2	V492 L515 Q516 S517 T521 V522 V523 I534	V492-R519 HydrophobicContact CB-CG 4.04Å; V492-R519 WeakPolarHBondContact O-CD 3.37Å; V492-R519 WeakPolarHBondContact O-CG 3.4Å; V492-R519 PolarHBondContact O-NE 3.04Å; L515-R519 PolarHBondContact O-N 3.23Å; L515-R519 VanDerWaalsContact O-N 3.09Å; Q516-R519 WeakPolarHBondContact O-CA 3.39Å; Q516-R519 WeakPolarHBondContact O-CB 3.07Å; Q516-R519 PolarHBondContact O-N 3.43Å; S517-R519 VanDerWaalsContact C-N 3.28Å; S517-R519 PolarHBondContact O-N 3.24Å; R519-T521 PolarHBondContact O-N 3.18Å; R519-V522 PolarHBondContact O-N 3.16Å; R519-V523 HydrophobicContact CG-CB 4.4Å; R519-V523 WeakPolarHBondContact O-CB 3.44Å; R519-V523 WeakPolarHBondContact O-CG1 3.27Å; R519-V523 PolarHBondContact O-N 3.15Å; R519-I534 VanDerWaalsContact NH2-CD1 3.33Å
520	D	87.5	Confident	80.1	Confident	76 Å²	76	49.7 Å²	49.7	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-24.2	-177.4	-62.9	-16.2	0	0	0	113.1	T55 Q516 S517	T55-D520 HydrophobicContact CG2-CB 4.37Å; Q516-D520 PolarHBondContact NE2-OD1 2.66Å; Q516-D520 VanDerWaalsContact O-CG 3.23Å; Q516-D520 PolarHBondContact O-N 2.8Å; S517-D520 PolarHBondContact O-N 2.99Å
521	T	88.9	Confident	78.6	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-71.3	-31.9	-179.4	-59.4	0	0	0	0	112.8	F53 S517 R519 Q562 M565 V566	F53-T521 HydrophobicContact CB-CG2 4.47Å; F53-T521 HydrophobicContact CD1-CG2 3.95Å; F53-T521 HydrophobicContact CG-CG2 4.26Å; S517-T521 WeakPolarHBondContact O-CB 2.88Å; S517-T521 PolarHBondContact O-N 2.93Å; S517-T521 VanDerWaalsContact O-N 3.08Å; S517-T521 PolarHBondContact O-OG1 3.14Å; R519-T521 PolarHBondContact O-N 3.18Å; T521-Q562 HydrophobicContact CG2-CB 4.24Å; T521-Q562 HydrophobicContact CG2-CG 3.96Å; T521-Q562 WeakPolarHBondContact O-CG 3.38Å; T521-Q562 PolarHBondContact O-NE2 2.76Å; T521-M565 HydrophobicContact CG2-CB 4.18Å; T521-V566 HydrophobicContact CG2-CG2 4.3Å
522	V	89.3	Confident	76.7	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-135	-10.4	-167.4	-87.1	0	0	0	0	115.2	Q489 V492 V518 R519 D524 P558 Q562 V566	Q489-V522 PolarHBondContact NE2-O 3.09Å; V492-V522 HydrophobicContact CG1-CG2 3.72Å; V518-V522 WeakPolarHBondContact O-CG2 3.42Å; R519-V522 PolarHBondContact O-N 3.16Å; V522-D524 PolarHBondContact O-N 3.29Å; V522-P558 HydrophobicContact CG1-CB 4.1Å; V522-Q562 HydrophobicContact CG1-CB 3.64Å; V522-Q562 HydrophobicContact CG1-CG 4Å; V522-V566 HydrophobicContact CB-CG2 4.34Å; V522-V566 HydrophobicContact CG1-CG2 3.86Å; V522-V566 HydrophobicContact CG2-CG2 3.48Å; V522-V566 VanDerWaalsContact CG2-CG2 3.48Å
523	V	88.5	Confident	75	Confident	36 Å²	36	57.3 Å²	57.3	22%	0.218	30%	0.297	C	S	.	.			trans	-64.4	132.2	-177	70.7	0	0	0	0	111.7	V492 Q493 R519 F525	V492-V523 HydrophobicContact CG2-CB 4.18Å; V492-V523 HydrophobicContact CG2-CG2 4.26Å; Q493-V523 HydrophobicContact CG-CG2 4Å; R519-V523 HydrophobicContact CG-CB 4.4Å; R519-V523 WeakPolarHBondContact O-CB 3.44Å; R519-V523 WeakPolarHBondContact O-CG1 3.27Å; R519-V523 PolarHBondContact O-N 3.15Å; V523-F525 HydrophobicContact CB-CE2 4.29Å; V523-F525 HydrophobicContact CG1-CD2 4.26Å; V523-F525 HydrophobicContact CG1-CE2 3.81Å; V523-F525 HydrophobicContact CG2-CD1 4.3Å; V523-F525 HydrophobicContact CG2-CD2 3.85Å; V523-F525 HydrophobicContact CG2-CE1 3.95Å; V523-F525 HydrophobicContact CG2-CE2 3.46Å; V523-F525 VanDerWaalsContact CG2-CE2 3.46Å; V523-F525 HydrophobicContact CG2-CG 4.26Å; V523-F525 HydrophobicContact CG2-CZ 3.52Å
524	D	87.4	Confident	73.4	Confident	49 Å²	49	55.7 Å²	55.7	26%	0.262	29%	0.285	S	S	.	.			trans	-124.5	103.1	171.1	-178.3	22.2	0	0	0	108.8	Y485 Q493 V522 R554	Y485-D524 PolarHBondContact OH-OD2 3.1Å; Q493-D524 PolarHBondContact NE2-O 2.76Å; V522-D524 PolarHBondContact O-N 3.29Å; D524-R554 IonicContact OD1-NH2 2.73Å; D524-R554 WeakPolarHBondContact OD2-CD 3.22Å; D524-R554 IonicContact OD2-CZ 3.61Å; D524-R554 IonicContact OD2-NE 3.61Å; D524-R554 PolarHBondContact OD2-NE 3.29Å; D524-R554 IonicContact OD2-NH2 3.68Å; D524-R554 PolarHBondContact OD2-NH2 2.98Å
525	F	78.9	Confident	71.7	Confident	53 Å²	53	60.4 Å²	60.4	23%	0.232	30%	0.303	C	S	.	.			trans	-84.8	131.1	179.6	-70.4	-72.6	0	0	0	110.8	V523 S527 E530 V531	V523-F525 HydrophobicContact CB-CE2 4.29Å; V523-F525 HydrophobicContact CG1-CD2 4.26Å; V523-F525 HydrophobicContact CG1-CE2 3.81Å; V523-F525 HydrophobicContact CG2-CD1 4.3Å; V523-F525 HydrophobicContact CG2-CD2 3.85Å; V523-F525 HydrophobicContact CG2-CE1 3.95Å; V523-F525 HydrophobicContact CG2-CE2 3.46Å; V523-F525 VanDerWaalsContact CG2-CE2 3.46Å; V523-F525 HydrophobicContact CG2-CG 4.26Å; V523-F525 HydrophobicContact CG2-CZ 3.52Å; F525-S527 VanDerWaalsContact C-N 3.3Å; F525-E530 HydrophobicContact CD1-CB 4.24Å; F525-E530 HydrophobicContact CE1-CB 4.27Å; F525-V531 HydrophobicContact CD2-CG2 4.39Å; F525-V531 HydrophobicContact CE2-CG2 4.05Å; F525-V531 HydrophobicContact CZ-CG2 4.3Å
526	S	67.5	Low	69.7	Low	63 Å²	63	62.4 Å²	62.4	44%	0.441	32%	0.324	S	S	.	.	S	Bend	trans	-70	-25.7	172.2	48	0	0	0	0	112.5
527	S	57.7	Low	67.4	Low	54 Å²	54	71 Å²	71	38%	0.378	36%	0.361	S	S	.	.	S	Bend	trans	-148.2	144.5	168.9	94.3	0	0	0	0	112.6	F525 H529	F525-S527 VanDerWaalsContact C-N 3.3Å; S527-H529 PolarHBondContact O-N 3.2Å; S527-H529 VanDerWaalsContact O-N 3.1Å
528	F	53.7	Low	64.8	Low	198 Å²	198	74.9 Å²	74.9	87%	0.868	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-65	-10.7	-175.7	-81	-87.5	0	0	0	115.2	E530	F528-E530 PolarHBondContact O-N 2.94Å
529	H	49.7	Very low	62.1	Low	173 Å²	173	85.8 Å²	85.8	80%	0.801	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-80	-6.3	-173.1	-79.8	-43.3	0	0	0	115.5	S527 V531	S527-H529 PolarHBondContact O-N 3.2Å; S527-H529 VanDerWaalsContact O-N 3.1Å; H529-V531 PolarHBondContact O-N 3.37Å
530	E	49.7	Very low	59.6	Low	63 Å²	63	92.5 Å²	92.5	29%	0.294	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-86.8	-2.7	-174.9	-64.5	-173.7	160.3	0	0	114.9	F525 F528	F525-E530 HydrophobicContact CD1-CB 4.24Å; F525-E530 HydrophobicContact CE1-CB 4.27Å; F528-E530 PolarHBondContact O-N 2.94Å
531	V	51.7	Low	56.8	Low	67 Å²	67	95.3 Å²	95.3	41%	0.406	47%	0.472	S	S	.	.	S	Bend	trans	-79.4	-25.4	-171.2	-173.1	0	0	0	0	113.1	F525 H529 D533	F525-V531 HydrophobicContact CD2-CG2 4.39Å; F525-V531 HydrophobicContact CE2-CG2 4.05Å; F525-V531 HydrophobicContact CZ-CG2 4.3Å; H529-V531 PolarHBondContact O-N 3.37Å; V531-D533 PolarHBondContact O-N 2.94Å
532	E	47.9	Very low	53.9	Low	167 Å²	167	101.2 Å²	101.2	78%	0.78	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-77.2	-20.3	-169.1	-68.3	-170.4	153.6	0	0	114.8	I534	E532-I534 VanDerWaalsContact C-N 3.32Å; E532-I534 PolarHBondContact O-N 3.48Å
533	D	51.7	Low	51	Low	89 Å²	89	108 Å²	108	48%	0.476	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-81.6	-4.3	-166.3	-153.4	24.7	0	0	0	114.8	R497 V531	R497-D533 IonicContact CZ-OD2 2.7Å; R497-D533 IonicContact NH2-OD2 3.25Å; R497-D533 PolarHBondContact NH2-OD2 2.85Å; V531-D533 PolarHBondContact O-N 2.94Å
534	I	54.4	Low	48.3	Very low	8 Å²	8	113.9 Å²	113.9	4%	0.041	58%	0.578	C	S	.	*	G	3₁₀ helix	trans	-91.3	-25.9	-177.5	-67.1	163.2	0	0	0	112.4	R497 L500 R519 E532	R497-I534 HydrophobicContact CG-CD1 4.22Å; R497-I534 HydrophobicContact CG-CG1 4.12Å; L500-I534 HydrophobicContact CD2-CG2 4.01Å; L500-I534 HydrophobicContact CG-CG2 4.22Å; R519-I534 VanDerWaalsContact NH2-CD1 3.33Å; E532-I534 VanDerWaalsContact C-N 3.32Å; E532-I534 PolarHBondContact O-N 3.48Å
535	Y	54.3	Low	45.6	Very low	101 Å²	101	114.5 Å²	114.5	40%	0.396	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.7	-11.2	-176.6	-62.1	-64.5	0	0	0	113.3	T504 R512 Q516	T504-Y535 HydrophobicContact CG2-CD1 4.03Å; T504-Y535 HydrophobicContact CG2-CE1 4.13Å; R512-Y535 VanDerWaalsContact CZ-CE1 3.49Å; Q516-Y535 PolarHBondContact OE1-OH 3.12Å
536	G	45.9	Very low	43.6	Very low	42 Å²	42	117 Å²	117	43%	0.433	61%	0.61	S	S	.	*	S	Bend	trans	-64.8	137.8	173.4	0	0	0	0	0	112.3	C538	G536-C538 PolarHBondContact O-N 3.48Å
537	K	40.5	Very low	42.4	Very low	216 Å²	216	118.8 Å²	118.8	94%	0.939	62%	0.622	S	S	*	*			trans	-67.3	55.4	165.6	-76.4	177	175.1	171.9	0	110.5	R539	K537-R539 PolarHBondContact O-N 3.35Å
538	C	35.7	Very low	42.3	Very low	89 Å²	89	124.6 Å²	124.6	60%	0.601	64%	0.644	S	S	*	*			trans	-78	117.3	172.3	-87.1	0	0	0	0	109.2	G536	G536-C538 PolarHBondContact O-N 3.48Å
539	R	34.2	Very low	42.8	Very low	228 Å²	228	117.2 Å²	117.2	86%	0.86	61%	0.613	S	S	*	*			trans	-55	147.5	-178.2	-71.3	178	172.9	177.5	-2.4	110.2	K537 D541	K537-R539 PolarHBondContact O-N 3.35Å; R539-D541 PolarHBondContact O-N 3.47Å; R539-D541 VanDerWaalsContact O-N 3.09Å
540	K	35.7	Very low	43.8	Very low	152 Å²	152	116.9 Å²	116.9	66%	0.661	61%	0.611	S	S	*	*	S	Bend	trans	-65.6	-11	-176	-133.9	-176.7	179.5	-166.9	0	114
541	D	30.4	Very low	45.2	Very low	134 Å²	134	115.4 Å²	115.4	72%	0.717	61%	0.605	S	S	*	*	S	Bend	trans	-143.8	78.6	-164.3	-55.6	-56.9	0	0	0	111.7	R539	R539-D541 PolarHBondContact O-N 3.47Å; R539-D541 VanDerWaalsContact O-N 3.09Å
542	T	26.6	Very low	46.4	Very low	128 Å²	128	114.7 Å²	114.7	79%	0.785	60%	0.603	S	S	*	*			trans	169.5	88.8	150	19.8	0	0	0	0	108.8
543	M	28.1	Very low	47.9	Very low	157 Å²	157	109.5 Å²	109.5	77%	0.773	58%	0.583	S	S	*	*			trans	-163.5	104.5	151.7	-86.4	-124.5	134.2	0	0	109.5	S545	M543-S545 PolarHBondContact O-N 3.01Å
544	T	32.7	Very low	49.5	Very low	161 Å²	161	111 Å²	111	99%	0.988	58%	0.582	S	S	*	*	S	Bend	trans	-72.5	23.9	160.5	33.5	0	0	0	0	112.3
545	S	31.4	Very low	51	Low	62 Å²	62	113.2 Å²	113.2	43%	0.434	60%	0.598	S	S	.	*			trans	-146.9	82.6	171.7	42.7	0	0	0	0	108.2	M543 S547	M543-S545 PolarHBondContact O-N 3.01Å; S545-S547 VanDerWaalsContact C-N 3.26Å; S545-S547 PolarHBondContact O-N 3.24Å
546	S	35.8	Very low	52.5	Low	105 Å²	105	112.1 Å²	112.1	73%	0.734	60%	0.601	S	S	*	*			trans	-59	103.2	149.3	46.8	0	0	0	0	105.7	E548	S546-E548 VanDerWaalsContact C-N 3.35Å; S546-E548 PolarHBondContact O-N 2.85Å
547	S	43.7	Very low	54.4	Low	100 Å²	100	111.4 Å²	111.4	70%	0.699	59%	0.591	S	S	*	*			trans	-49.8	107.1	164.8	-46.4	0	0	0	0	106.3	S545 I549	S545-S547 VanDerWaalsContact C-N 3.26Å; S545-S547 PolarHBondContact O-N 3.24Å; S547-I549 PolarHBondContact O-N 3.27Å
548	E	54.6	Low	56.8	Low	177 Å²	177	101.8 Å²	101.8	83%	0.827	55%	0.551	S	S	*	*			trans	-60.4	109.7	177.9	-77.2	-178.8	155.5	0	0	106.4	S546 Q550	S546-E548 VanDerWaalsContact C-N 3.35Å; S546-E548 PolarHBondContact O-N 2.85Å; E548-Q550 PolarHBondContact O-N 3.13Å
549	I	65.2	Low	59.3	Low	43 Å²	43	99.2 Å²	99.2	22%	0.221	53%	0.534	C	S	.	.			trans	-60.7	110.2	176.8	-64.2	169.7	0	0	0	106.4	Q493 V494 S547 I551	Q493-I549 HydrophobicContact CB-CG2 4.26Å; Q493-I549 WeakPolarHBondContact O-CD1 3.27Å; V494-I549 HydrophobicContact CG2-CB 4.46Å; V494-I549 HydrophobicContact CG2-CD1 4.45Å; S547-I549 PolarHBondContact O-N 3.27Å; I549-I551 HydrophobicContact CG2-CG1 4.37Å; I549-I551 PolarHBondContact O-N 3Å
550	Q	70.1	Confident	62	Low	165 Å²	165	89.4 Å²	89.4	77%	0.771	50%	0.498	S	S	*	.			trans	-86.8	102.6	-179.8	-110.5	-171.6	-3.2	0	0	109.5	E548 S552	E548-Q550 PolarHBondContact O-N 3.13Å; Q550-S552 PolarHBondContact O-N 3.46Å
551	I	78.8	Confident	64.5	Low	32 Å²	32	82.2 Å²	82.2	16%	0.164	47%	0.467	C	S	.	.			trans	-79.4	115.2	176.3	-59.4	170.7	0	0	0	108.8	L486 Q489 E490 V494 I549 V553	L486-I551 HydrophobicContact CD1-CB 4.43Å; L486-I551 HydrophobicContact CD1-CG2 4.14Å; Q489-I551 HydrophobicContact CB-CD1 4.23Å; Q489-I551 HydrophobicContact CB-CG2 3.61Å; Q489-I551 HydrophobicContact CG-CG2 4.24Å; E490-I551 HydrophobicContact CB-CD1 4.23Å; E490-I551 HydrophobicContact CG-CD1 3.61Å; V494-I551 HydrophobicContact CG2-CD1 4.3Å; I549-I551 HydrophobicContact CG2-CG1 4.37Å; I549-I551 PolarHBondContact O-N 3Å; I551-V553 PolarHBondContact O-N 2.81Å
552	S	77.6	Confident	67.4	Low	52 Å²	52	77.9 Å²	77.9	36%	0.364	44%	0.442	S	S	.	.			trans	-73.7	114.5	171.6	58.1	0	0	0	0	110.4	Y485 Q550	Y485-S552 VanDerWaalsContact CE1-O 3.23Å; Y485-S552 WeakPolarHBondContact CE1-O 3.23Å; Q550-S552 PolarHBondContact O-N 3.46Å
553	V	79.5	Confident	70.4	Confident	58 Å²	58	72.1 Å²	72.1	35%	0.352	41%	0.406	S	S	.	.			trans	-72.2	127.2	-179.3	-175.1	0	0	0	0	110.8	I393 R482 L486 I551	I393-V553 HydrophobicContact CD1-CG2 4.18Å; I393-V553 HydrophobicContact CG1-CG2 4.48Å; R482-V553 HydrophobicContact CB-CG1 4.09Å; R482-V553 HydrophobicContact CG-CG1 4.18Å; L486-V553 HydrophobicContact CD1-CG2 4.16Å; I551-V553 PolarHBondContact O-N 2.81Å
554	R	85.3	Confident	73.4	Confident	121 Å²	121	65.5 Å²	65.5	46%	0.457	37%	0.373	S	S	.	.			trans	-113.6	152.9	172.2	-62	-175.5	-173.4	-105.9	9.3	111	Y485 D524 V556	Y485-R554 HydrophobicContact CD1-CB 4.16Å; Y485-R554 HydrophobicContact CD2-CB 4.25Å; Y485-R554 HydrophobicContact CE1-CB 4Å; Y485-R554 HydrophobicContact CE1-CG 4.12Å; Y485-R554 HydrophobicContact CE2-CB 4.06Å; Y485-R554 HydrophobicContact CE2-CG 4.3Å; Y485-R554 HydrophobicContact CG-CB 4.28Å; D524-R554 IonicContact OD1-NH2 2.73Å; D524-R554 WeakPolarHBondContact OD2-CD 3.22Å; D524-R554 IonicContact OD2-CZ 3.61Å; D524-R554 IonicContact OD2-NE 3.61Å; D524-R554 PolarHBondContact OD2-NE 3.29Å; D524-R554 IonicContact OD2-NH2 3.68Å; D524-R554 PolarHBondContact OD2-NH2 2.98Å; R554-V556 HydrophobicContact CB-CG1 3.88Å; R554-V556 PolarHBondContact O-N 3.19Å
555	S	84.2	Confident	76.1	Confident	55 Å²	55	57.9 Å²	57.9	39%	0.385	33%	0.326	S	S	.	.	S	Bend	trans	-88.4	54.9	170.6	-56.7	0	0	0	0	110.9	Q481 R482	Q481-S555 PolarHBondContact OE1-O 3.36Å; R482-S555 VanDerWaalsContact CG-OG 3.31Å; R482-S555 WeakPolarHBondContact CG-OG 3.49Å; R482-S555 PolarHBondContact NE-OG 3.37Å
556	V	86.3	Confident	79	Confident	77 Å²	77	55.2 Å²	55.2	47%	0.467	31%	0.307	S	S	.	.			trans	-142.9	130.4	177.8	68.2	0	0	0	0	109.9	Y485 R554	Y485-V556 VanDerWaalsContact CB-O 3.29Å; Y485-V556 WeakPolarHBondContact CB-O 3.47Å; Y485-V556 HydrophobicContact CD2-CG1 4.06Å; Y485-V556 WeakPolarHBondContact CD2-O 3.21Å; Y485-V556 HydrophobicContact CE2-CG1 4.22Å; R554-V556 HydrophobicContact CB-CG1 3.88Å; R554-V556 PolarHBondContact O-N 3.19Å
557	A	86.3	Confident	81.6	Confident	27 Å²	27	51.4 Å²	51.4	22%	0.223	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-88	156.5	179.4	0	0	0	0	0	111.9	Q481 L609	Q481-A557 HydrophobicContact CG-CB 4.43Å; A557-L609 HydrophobicContact CB-CD1 3.96Å; A557-L609 HydrophobicContact CB-CD2 3.22Å; A557-L609 HydrophobicContact CB-CG 4.24Å
558	P	89.9	Confident	83.8	Confident	14 Å²	14	46.7 Å²	46.7	9%	0.091	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-59.9	145	165.3	27.2	-33.2	0	0	0	110.1	I484 V522 Q562	I484-P558 HydrophobicContact CG2-CG 4.12Å; V522-P558 HydrophobicContact CG1-CB 4.1Å; P558-Q562 HydrophobicContact CB-CB 4.11Å
559	S	90.1	Very high	85.6	Confident	36 Å²	36	38.2 Å²	38.2	25%	0.252	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-59.4	157.9	172.8	62.8	0	0	0	0	111.4	T561 Q562 L563	S559-T561 PolarHBondContact O-N 2.92Å; S559-Q562 WeakPolarHBondContact O-CB 3.13Å; S559-Q562 PolarHBondContact O-N 3.19Å; S559-Q562 VanDerWaalsContact OG-CB 3.31Å; S559-Q562 WeakPolarHBondContact OG-CB 3.21Å; S559-Q562 WeakPolarHBondContact OG-CG 3.49Å; S559-Q562 PolarHBondContact OG-N 3.11Å; S559-Q562 VanDerWaalsContact OG-N 3.16Å; S559-Q562 PolarHBondContact OG-OE1 2.78Å; S559-L563 PolarHBondContact O-N 2.66Å
560	F	89.1	Confident	86.8	Confident	22 Å²	22	36.2 Å²	36.2	10%	0.096	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-35.5	177.8	-68.2	-85.2	0	0	0	112.1	F43 D44 L563 Y564 T606 L609 Q610	F43-F560 HydrophobicContact CB-CE2 4Å; F43-F560 WeakPolarHBondContact O-CD2 3.39Å; D44-F560 VanDerWaalsContact CA-CD2 3.48Å; D44-F560 HydrophobicContact CB-CD2 3.93Å; D44-F560 HydrophobicContact CB-CE2 4.26Å; D44-F560 HydrophobicContact CB-CG 4.06Å; F560-L563 PolarHBondContact O-N 2.93Å; F560-Y564 VanDerWaalsContact O-CB 3.31Å; F560-Y564 WeakPolarHBondContact O-CB 3.24Å; F560-Y564 PolarHBondContact O-N 2.99Å; F560-T606 HydrophobicContact CD1-CG2 4.02Å; F560-T606 HydrophobicContact CE1-CG2 3.72Å; F560-L609 HydrophobicContact CZ-CB 4.32Å; F560-Q610 HydrophobicContact CE1-CG 4.15Å; F560-Q610 HydrophobicContact CZ-CG 3.72Å
561	T	89.3	Confident	87.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-45.8	175.1	-56.5	0	0	0	0	111.7	T45 F47 D49 R50 F53 S559 L563 Y564 M565	T45-T561 PolarHBondContact OG1-OG1 2.95Å; F47-T561 WeakPolarHBondContact CA-OG1 3.48Å; F47-T561 HydrophobicContact CD1-CG2 4.28Å; D49-T561 VanDerWaalsContact OD1-CB 3.3Å; D49-T561 WeakPolarHBondContact OD1-CB 3.34Å; D49-T561 PolarHBondContact OD1-OG1 3.44Å; R50-T561 HydrophobicContact CB-CG2 4.13Å; F53-T561 HydrophobicContact CD2-CG2 3.76Å; F53-T561 HydrophobicContact CE2-CG2 3.75Å; S559-T561 PolarHBondContact O-N 2.92Å; T561-L563 VanDerWaalsContact C-N 3.34Å; T561-L563 PolarHBondContact O-N 2.75Å; T561-Y564 PolarHBondContact O-N 3.02Å; T561-M565 HydrophobicContact CG2-CG 4.31Å; T561-M565 WeakPolarHBondContact O-CB 3.13Å; T561-M565 WeakPolarHBondContact O-CG 3.49Å; T561-M565 PolarHBondContact O-N 3.05Å
562	Q	90.4	Very high	88.2	Confident	44 Å²	44	27.4 Å²	27.4	21%	0.206	15%	0.152	C	C	.	.	H	α-helix	trans	-56.7	-48.6	173	-79.6	172.2	-45.3	0	0	111.6	F53 T521 V522 P558 S559 Y564 M565 V566	F53-Q562 HydrophobicContact CD1-CG 4.17Å; F53-Q562 HydrophobicContact CE1-CG 3.42Å; F53-Q562 VanDerWaalsContact CE1-CG 3.42Å; F53-Q562 HydrophobicContact CE2-CG 4.22Å; F53-Q562 HydrophobicContact CZ-CG 3.47Å; F53-Q562 VanDerWaalsContact CZ-CG 3.47Å; T521-Q562 HydrophobicContact CG2-CB 4.24Å; T521-Q562 HydrophobicContact CG2-CG 3.96Å; T521-Q562 WeakPolarHBondContact O-CG 3.38Å; T521-Q562 PolarHBondContact O-NE2 2.76Å; V522-Q562 HydrophobicContact CG1-CB 3.64Å; V522-Q562 HydrophobicContact CG1-CG 4Å; P558-Q562 HydrophobicContact CB-CB 4.11Å; S559-Q562 WeakPolarHBondContact O-CB 3.13Å; S559-Q562 PolarHBondContact O-N 3.19Å; S559-Q562 VanDerWaalsContact OG-CB 3.31Å; S559-Q562 WeakPolarHBondContact OG-CB 3.21Å; S559-Q562 WeakPolarHBondContact OG-CG 3.49Å; S559-Q562 PolarHBondContact OG-N 3.11Å; S559-Q562 VanDerWaalsContact OG-N 3.16Å; S559-Q562 PolarHBondContact OG-OE1 2.78Å; Q562-Y564 VanDerWaalsContact C-N 3.34Å; Q562-Y564 PolarHBondContact O-N 3.2Å; Q562-M565 PolarHBondContact O-N 3.43Å; Q562-V566 WeakPolarHBondContact O-CB 3.48Å; Q562-V566 VanDerWaalsContact O-CG2 3.23Å; Q562-V566 WeakPolarHBondContact O-CG2 3.46Å; Q562-V566 PolarHBondContact O-N 3.12Å
563	L	91	Very high	88.8	Confident	6 Å²	6	25 Å²	25	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-42.4	179.9	-176.9	59.2	0	0	0	111.7	S559 F560 T561 R567 W605	S559-L563 PolarHBondContact O-N 2.66Å; F560-L563 PolarHBondContact O-N 2.93Å; T561-L563 VanDerWaalsContact C-N 3.34Å; T561-L563 PolarHBondContact O-N 2.75Å; L563-R567 HydrophobicContact CD1-CG 4.17Å; L563-R567 VanDerWaalsContact O-CB 3.32Å; L563-R567 WeakPolarHBondContact O-CB 3.25Å; L563-R567 VanDerWaalsContact O-CG 3.23Å; L563-R567 WeakPolarHBondContact O-CG 3.48Å; L563-R567 PolarHBondContact O-N 3.35Å; L563-W605 HydrophobicContact CD1-CE3 3.58Å; L563-W605 HydrophobicContact CD1-CZ3 4.13Å; L563-W605 HydrophobicContact CD2-CB 3.95Å
564	Y	89.7	Confident	89.2	Confident	19 Å²	19	22.5 Å²	22.5	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-50.1	175.1	179.6	-93.4	0	0	0	111.6	F47 A64 H67 V157 F560 T561 Q562 V566 R567 T568	F47-Y564 HydrophobicContact CD1-CD1 4.32Å; F47-Y564 HydrophobicContact CD1-CG 4.32Å; F47-Y564 AromaticContact CE1-CD1 3.77Å; F47-Y564 HydrophobicContact CE1-CD1 3.77Å; F47-Y564 AromaticContact CE1-CD2 3.76Å; F47-Y564 HydrophobicContact CE1-CD2 3.76Å; F47-Y564 HydrophobicContact CE1-CE1 4.39Å; F47-Y564 HydrophobicContact CE1-CE2 4.37Å; F47-Y564 AromaticContact CE1-CG 3.41Å; F47-Y564 HydrophobicContact CE1-CG 3.41Å; F47-Y564 VanDerWaalsContact CE1-CG 3.41Å; F47-Y564 HydrophobicContact CZ-CD1 4.16Å; F47-Y564 AromaticContact CZ-CD2 3.65Å; F47-Y564 HydrophobicContact CZ-CD2 3.65Å; F47-Y564 HydrophobicContact CZ-CE1 4.39Å; F47-Y564 AromaticContact CZ-CE2 3.88Å; F47-Y564 HydrophobicContact CZ-CE2 3.88Å; F47-Y564 AromaticContact CZ-CG 3.79Å; F47-Y564 HydrophobicContact CZ-CG 3.79Å; A64-Y564 HydrophobicContact CB-CD1 4.39Å; A64-Y564 HydrophobicContact CB-CE1 3.88Å; H67-Y564 AromaticContact CE1-CE2 3.78Å; H67-Y564 AromaticContact ND1-CE2 3.47Å; H67-Y564 WeakPolarHBondContact ND1-CE2 3.31Å; H67-Y564 AromaticContact ND1-CZ 3.52Å; H67-Y564 PolarHBondContact ND1-OH 2.87Å; V157-Y564 HydrophobicContact CB-CE2 4.32Å; V157-Y564 HydrophobicContact CG1-CE2 4.42Å; F560-Y564 VanDerWaalsContact O-CB 3.31Å; F560-Y564 WeakPolarHBondContact O-CB 3.24Å; F560-Y564 PolarHBondContact O-N 2.99Å; T561-Y564 PolarHBondContact O-N 3.02Å; Q562-Y564 VanDerWaalsContact C-N 3.34Å; Q562-Y564 PolarHBondContact O-N 3.2Å; Y564-V566 PolarHBondContact O-N 2.95Å; Y564-R567 PolarHBondContact O-N 3.41Å; Y564-T568 VanDerWaalsContact O-CB 3.26Å; Y564-T568 WeakPolarHBondContact O-CB 3.37Å; Y564-T568 PolarHBondContact O-N 3.38Å; Y564-T568 PolarHBondContact O-OG1 3.18Å
565	M	90	Very high	88.9	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-62.4	-46.4	-178.1	-69.5	-63.1	-76.4	0	0	111.2	I61 T521 T561 Q562 T568 M569	I61-M565 HydrophobicContact CG1-CE 3.78Å; T521-M565 HydrophobicContact CG2-CB 4.18Å; T561-M565 HydrophobicContact CG2-CG 4.31Å; T561-M565 WeakPolarHBondContact O-CB 3.13Å; T561-M565 WeakPolarHBondContact O-CG 3.49Å; T561-M565 PolarHBondContact O-N 3.05Å; Q562-M565 PolarHBondContact O-N 3.43Å; M565-T568 PolarHBondContact O-N 2.98Å; M565-M569 HydrophobicContact CB-CE 4.09Å; M565-M569 VanDerWaalsContact O-CB 3.28Å; M565-M569 WeakPolarHBondContact O-CB 3.49Å; M565-M569 WeakPolarHBondContact O-CE 3.4Å; M565-M569 VanDerWaalsContact O-CG 3.26Å; M565-M569 WeakPolarHBondContact O-CG 3.21Å; M565-M569 PolarHBondContact O-N 3.14Å
566	V	91.6	Very high	88.2	Confident	5 Å²	5	19.2 Å²	19.2	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-58.8	-50.5	176.3	167.9	0	0	0	0	111.1	L491 V518 T521 V522 Q562 Y564 L570 F598	L491-V566 HydrophobicContact CD2-CG1 4.21Å; V518-V566 HydrophobicContact CG1-CG1 4.08Å; V518-V566 HydrophobicContact CG1-CG2 4.35Å; T521-V566 HydrophobicContact CG2-CG2 4.3Å; V522-V566 HydrophobicContact CB-CG2 4.34Å; V522-V566 HydrophobicContact CG1-CG2 3.86Å; V522-V566 HydrophobicContact CG2-CG2 3.48Å; V522-V566 VanDerWaalsContact CG2-CG2 3.48Å; Q562-V566 WeakPolarHBondContact O-CB 3.48Å; Q562-V566 VanDerWaalsContact O-CG2 3.23Å; Q562-V566 WeakPolarHBondContact O-CG2 3.46Å; Q562-V566 PolarHBondContact O-N 3.12Å; Y564-V566 PolarHBondContact O-N 2.95Å; V566-L570 HydrophobicContact CG1-CD1 3.83Å; V566-L570 HydrophobicContact CG1-CG 4.5Å; V566-L570 WeakPolarHBondContact O-CB 3.39Å; V566-L570 VanDerWaalsContact O-CG 3.27Å; V566-L570 WeakPolarHBondContact O-CG 3.32Å; V566-L570 PolarHBondContact O-N 3.28Å; V566-F598 HydrophobicContact CG1-CE1 4.04Å; V566-F598 HydrophobicContact CG1-CZ 4.24Å
567	R	91.9	Very high	87.1	Confident	25 Å²	25	19.7 Å²	19.7	9%	0.094	10%	0.101	C	C	.	.	H	α-helix	trans	-63	-47.6	-179	-74.3	175.9	54.2	71	8.9	111.6	L563 Y564 M569 L570 E571 L599 S602	L563-R567 HydrophobicContact CD1-CG 4.17Å; L563-R567 VanDerWaalsContact O-CB 3.32Å; L563-R567 WeakPolarHBondContact O-CB 3.25Å; L563-R567 VanDerWaalsContact O-CG 3.23Å; L563-R567 WeakPolarHBondContact O-CG 3.48Å; L563-R567 PolarHBondContact O-N 3.35Å; Y564-R567 PolarHBondContact O-N 3.41Å; R567-M569 PolarHBondContact O-N 3.36Å; R567-L570 PolarHBondContact O-N 2.79Å; R567-E571 VanDerWaalsContact O-CB 3.26Å; R567-E571 WeakPolarHBondContact O-CB 3.43Å; R567-E571 PolarHBondContact O-N 3.22Å; R567-L599 HydrophobicContact CB-CD2 4.16Å; R567-L599 HydrophobicContact CG-CD2 4.3Å; R567-L599 PolarHBondContact NH1-O 2.88Å; R567-L599 WeakPolarHBondContact O-CD2 3.35Å; R567-S602 VanDerWaalsContact NH1-C 3.32Å; R567-S602 PolarHBondContact NH1-OG 3.26Å
568	T	90.2	Very high	85.5	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-62.7	-43.2	-179.3	-62.9	0	0	0	0	112	Y60 F153 Y564 M565 E571 S572	Y60-T568 HydrophobicContact CD1-CG2 3.73Å; Y60-T568 HydrophobicContact CE1-CG2 4.22Å; F153-T568 HydrophobicContact CE1-CG2 4.13Å; Y564-T568 VanDerWaalsContact O-CB 3.26Å; Y564-T568 WeakPolarHBondContact O-CB 3.37Å; Y564-T568 PolarHBondContact O-N 3.38Å; Y564-T568 PolarHBondContact O-OG1 3.18Å; M565-T568 PolarHBondContact O-N 2.98Å; T568-E571 PolarHBondContact O-N 3.4Å; T568-S572 PolarHBondContact O-N 3.43Å; T568-S572 VanDerWaalsContact O-N 3.11Å
569	M	90.5	Very high	83.4	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-44.7	176.4	-76.2	-170.2	-75.9	0	0	112.1	Y60 I514 S517 V518 M565 R567 S572	Y60-M569 HydrophobicContact CD2-CG 3.62Å; Y60-M569 HydrophobicContact CD2-SD 4.22Å; Y60-M569 HydrophobicContact CE2-CG 3.64Å; Y60-M569 HydrophobicContact CE2-SD 4.38Å; Y60-M569 HydrophobicContact CG-CG 4.11Å; I514-M569 HydrophobicContact CG2-CB 3.98Å; S517-M569 VanDerWaalsContact CB-SD 3.52Å; V518-M569 HydrophobicContact CB-CE 4.43Å; V518-M569 HydrophobicContact CG2-CB 3.44Å; V518-M569 VanDerWaalsContact CG2-CB 3.44Å; V518-M569 HydrophobicContact CG2-CE 3.86Å; V518-M569 HydrophobicContact CG2-CG 4.33Å; V518-M569 HydrophobicContact CG2-SD 4.03Å; M565-M569 HydrophobicContact CB-CE 4.09Å; M565-M569 VanDerWaalsContact O-CB 3.28Å; M565-M569 WeakPolarHBondContact O-CB 3.49Å; M565-M569 WeakPolarHBondContact O-CE 3.4Å; M565-M569 VanDerWaalsContact O-CG 3.26Å; M565-M569 WeakPolarHBondContact O-CG 3.21Å; M565-M569 PolarHBondContact O-N 3.14Å; R567-M569 PolarHBondContact O-N 3.36Å; M569-S572 WeakPolarHBondContact O-CB 3.49Å; M569-S572 PolarHBondContact O-N 3.46Å; M569-S572 PolarHBondContact O-OG 3.25Å
570	L	91.8	Very high	81.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.6	-40.5	177.2	-74.4	177.1	0	0	0	112.2	L491 L496 V518 V566 R567 S572 L573 V574 I595 F598 L599	L491-L570 HydrophobicContact CD2-CD1 3.67Å; L496-L570 HydrophobicContact CD1-CD2 4.24Å; L496-L570 HydrophobicContact CD2-CD2 4.2Å; V518-L570 HydrophobicContact CG1-CD1 4.5Å; V518-L570 HydrophobicContact CG1-CD2 4.3Å; V518-L570 HydrophobicContact CG1-CG 4.28Å; V518-L570 HydrophobicContact CG2-CD2 4.24Å; V518-L570 HydrophobicContact CG2-CG 4.18Å; V566-L570 HydrophobicContact CG1-CD1 3.83Å; V566-L570 HydrophobicContact CG1-CG 4.5Å; V566-L570 WeakPolarHBondContact O-CB 3.39Å; V566-L570 VanDerWaalsContact O-CG 3.27Å; V566-L570 WeakPolarHBondContact O-CG 3.32Å; V566-L570 PolarHBondContact O-N 3.28Å; R567-L570 PolarHBondContact O-N 2.79Å; L570-S572 VanDerWaalsContact C-N 3.26Å; L570-S572 PolarHBondContact O-N 3.09Å; L570-L573 HydrophobicContact CD2-CD1 4.37Å; L570-L573 WeakPolarHBondContact O-CB 3.48Å; L570-L573 PolarHBondContact O-N 3.08Å; L570-L573 VanDerWaalsContact O-N 3.09Å; L570-V574 PolarHBondContact O-N 3.15Å; L570-I595 HydrophobicContact CB-CG2 3.89Å; L570-I595 HydrophobicContact CD2-CD1 4.34Å; L570-I595 HydrophobicContact CD2-CG1 4.26Å; L570-I595 HydrophobicContact CD2-CG2 4.13Å; L570-I595 HydrophobicContact CG-CG2 4.44Å; L570-F598 HydrophobicContact CD1-CD1 3.72Å; L570-F598 HydrophobicContact CD1-CE1 3.83Å; L570-L599 HydrophobicContact CB-CD1 4.42Å; L570-L599 HydrophobicContact CB-CD2 4.07Å; L570-L599 HydrophobicContact CB-CG 4.38Å
571	E	90.3	Very high	79.8	Confident	10 Å²	10	27.5 Å²	27.5	5%	0.047	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-39.2	176.4	-167.8	-165.6	152.5	0	0	111.1	F153 E156 R567 T568 L573 V574 S575 R577 L599	F153-E571 HydrophobicContact CE2-CB 4.24Å; F153-E571 HydrophobicContact CE2-CG 3.83Å; F153-E571 HydrophobicContact CZ-CB 3.8Å; F153-E571 HydrophobicContact CZ-CG 3.78Å; E156-E571 VanDerWaalsContact CG-OE1 3.25Å; E156-E571 WeakPolarHBondContact CG-OE1 3.23Å; E156-E571 PolarHBondContact N-OE1 3.15Å; E156-E571 PolarHBondContact N-OE2 3.39Å; E156-E571 VanDerWaalsContact N-OE2 3.16Å; R567-E571 VanDerWaalsContact O-CB 3.26Å; R567-E571 WeakPolarHBondContact O-CB 3.43Å; R567-E571 PolarHBondContact O-N 3.22Å; T568-E571 PolarHBondContact O-N 3.4Å; E571-L573 PolarHBondContact O-N 2.96Å; E571-V574 PolarHBondContact O-N 3.41Å; E571-V574 VanDerWaalsContact O-N 3.16Å; E571-S575 WeakPolarHBondContact O-CB 3.31Å; E571-S575 PolarHBondContact O-N 2.82Å; E571-R577 IonicContact OE1-NH2 2.81Å; E571-L599 HydrophobicContact CB-CD1 4.24Å; E571-L599 HydrophobicContact CB-CD2 4.49Å
572	S	88.3	Confident	78.6	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-28.7	176.8	83.7	0	0	0	0	113.7	Y60 T568 M569 L570	Y60-S572 WeakPolarHBondContact OH-CB 3.36Å; Y60-S572 PolarHBondContact OH-OG 3.38Å; T568-S572 PolarHBondContact O-N 3.43Å; T568-S572 VanDerWaalsContact O-N 3.11Å; M569-S572 WeakPolarHBondContact O-CB 3.49Å; M569-S572 PolarHBondContact O-N 3.46Å; M569-S572 PolarHBondContact O-OG 3.25Å; L570-S572 VanDerWaalsContact C-N 3.26Å; L570-S572 PolarHBondContact O-N 3.09Å
573	L	88.5	Confident	77.7	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-78.6	-30.2	-179.8	-66.1	175.2	0	0	0	112.6	I511 I514 L515 L570 E571 F583 R584 L587	I511-L573 HydrophobicContact CG1-CD2 4.39Å; I511-L573 HydrophobicContact CG2-CD2 4.25Å; I514-L573 HydrophobicContact CB-CD2 4.13Å; I514-L573 HydrophobicContact CD1-CD2 3.86Å; I514-L573 HydrophobicContact CG2-CD1 3.93Å; I514-L573 HydrophobicContact CG2-CD2 3.97Å; I514-L573 HydrophobicContact CG2-CG 3.88Å; L515-L573 HydrophobicContact CD2-CD1 3.59Å; L515-L573 HydrophobicContact CG-CD1 4.02Å; L570-L573 HydrophobicContact CD2-CD1 4.37Å; L570-L573 WeakPolarHBondContact O-CB 3.48Å; L570-L573 PolarHBondContact O-N 3.08Å; L570-L573 VanDerWaalsContact O-N 3.09Å; E571-L573 PolarHBondContact O-N 2.96Å; L573-F583 HydrophobicContact CD2-CB 4.4Å; L573-R584 PolarHBondContact O-N 3.4Å; L573-L587 HydrophobicContact CB-CD1 3.87Å; L573-L587 HydrophobicContact CD2-CD1 4.42Å
574	V	88.9	Confident	76.8	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-109	-11.6	-172.4	-65.9	0	0	0	0	114.3	L570 E571 R584 A592 I595 N596 L599	L570-V574 PolarHBondContact O-N 3.15Å; E571-V574 PolarHBondContact O-N 3.41Å; E571-V574 VanDerWaalsContact O-N 3.16Å; V574-R584 WeakPolarHBondContact O-CD 3.43Å; V574-R584 PolarHBondContact O-NH1 2.95Å; V574-A592 HydrophobicContact CG1-CB 4.37Å; V574-I595 HydrophobicContact CG1-CB 3.87Å; V574-I595 HydrophobicContact CG1-CD1 4.32Å; V574-I595 HydrophobicContact CG1-CG2 3.59Å; V574-I595 HydrophobicContact CG2-CG2 4.15Å; V574-N596 WeakPolarHBondContact CG2-OD1 3.44Å; V574-L599 HydrophobicContact CG2-CD1 3.56Å
575	S	78.9	Confident	76.1	Confident	10 Å²	10	42 Å²	42	7%	0.07	21%	0.21	C	C	.	.			trans	-69	127.1	-178.7	-178.5	0	0	0	0	112.5	E571 R577	E571-S575 WeakPolarHBondContact O-CB 3.31Å; E571-S575 PolarHBondContact O-N 2.82Å; S575-R577 PolarHBondContact OG-N 3.07Å
576	D	68.9	Low	75.5	Confident	96 Å²	96	45.9 Å²	45.9	51%	0.513	23%	0.231	S	C	.	.	S	Bend	trans	-87.8	-5.2	172.6	-75.5	-45.7	0	0	0	113.4	S578 R584	D576-S578 PolarHBondContact O-N 3.27Å; D576-R584 WeakPolarHBondContact OD1-CD 3.45Å; D576-R584 WeakPolarHBondContact OD2-CD 3.38Å; D576-R584 IonicContact OD2-NE 3.46Å
577	R	63.3	Low	75.1	Confident	87 Å²	87	46.5 Å²	46.5	33%	0.328	23%	0.234	S	C	.	.			trans	-77	-17.5	-173.9	-75.4	179.9	-82.1	-140.8	-8	114	E156 E571 S575 G579	E156-R577 VanDerWaalsContact CD-NH2 3.3Å; E156-R577 IonicContact OE1-CZ 3.25Å; E156-R577 IonicContact OE1-NH1 2.68Å; E156-R577 IonicContact OE1-NH2 3.93Å; E156-R577 PolarHBondContact OE1-NH2 3.19Å; E571-R577 IonicContact OE1-NH2 2.81Å; S575-R577 PolarHBondContact OG-N 3.07Å; R577-G579 PolarHBondContact O-N 3.27Å
578	S	53	Low	74.7	Confident	8 Å²	8	49.8 Å²	49.8	6%	0.056	25%	0.251	C	S	.	.			trans	-71.3	117.5	175.8	19.5	0	0	0	0	111.3	D576 G580	D576-S578 PolarHBondContact O-N 3.27Å; S578-G580 PolarHBondContact O-N 2.79Å
579	G	46.2	Very low	74.5	Confident	59 Å²	59	57.1 Å²	57.1	61%	0.608	29%	0.285	S	S	*	.	S	Bend	trans	-65.2	-10.1	170.6	0	0	0	0	0	113.9	R577	R577-G579 PolarHBondContact O-N 3.27Å
580	G	50.2	Low	74.4	Confident	25 Å²	25	63 Å²	63	26%	0.258	31%	0.312	S	S	.	.	S	Bend	trans	-93.6	-150.2	176.7	0	0	0	0	0	115.1	K151 S578 K582	K151-G580 PolarHBondContact O-N 2.8Å; S578-G580 PolarHBondContact O-N 2.79Å; G580-K582 PolarHBondContact O-N 3.43Å
581	K	54.1	Low	74.3	Confident	172 Å²	172	63.8 Å²	63.8	75%	0.748	32%	0.316	S	S	*	.			trans	-54.4	107.6	-175.9	-74.8	179.6	178.7	174.6	0	111	F583	K581-F583 HydrophobicContact CB-CE1 4.48Å; K581-F583 HydrophobicContact CB-CZ 4.36Å; K581-F583 PolarHBondContact O-N 2.88Å; K581-F583 VanDerWaalsContact O-N 3.1Å
582	K	63.3	Low	74.1	Confident	100 Å²	100	63.4 Å²	63.4	44%	0.435	32%	0.315	S	S	.	.			trans	-78.4	89	-179.8	-63.8	-168.5	176.1	-163.5	0	111.1	G580 R584 K585	G580-K582 PolarHBondContact O-N 3.43Å; K582-R584 PolarHBondContact O-N 3.2Å; K582-K585 HydrophobicContact CB-CG 4.46Å; K582-K585 PolarHBondContact O-N 2.87Å
583	F	71.1	Confident	74.2	Confident	37 Å²	37	66.1 Å²	66.1	16%	0.162	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29	175.5	-59.1	-62.6	0	0	0	112.8	L510 I511 L573 K581 K585 D586 L587	L510-F583 HydrophobicContact CB-CE1 4.23Å; L510-F583 HydrophobicContact CD2-CE1 3.47Å; L510-F583 VanDerWaalsContact CD2-CE1 3.47Å; L510-F583 HydrophobicContact CD2-CE2 4.35Å; L510-F583 HydrophobicContact CD2-CZ 3.24Å; L510-F583 HydrophobicContact CG-CE1 4.47Å; I511-F583 HydrophobicContact CD1-CD1 4.35Å; I511-F583 HydrophobicContact CG1-CD1 3.89Å; L573-F583 HydrophobicContact CD2-CB 4.4Å; K581-F583 HydrophobicContact CB-CE1 4.48Å; K581-F583 HydrophobicContact CB-CZ 4.36Å; K581-F583 PolarHBondContact O-N 2.88Å; K581-F583 VanDerWaalsContact O-N 3.1Å; F583-K585 PolarHBondContact O-N 3.39Å; F583-D586 WeakPolarHBondContact O-CB 3.39Å; F583-D586 PolarHBondContact O-N 3.47Å; F583-L587 PolarHBondContact O-N 3.34Å
584	R	72.7	Confident	74.3	Confident	60 Å²	60	67.7 Å²	67.7	23%	0.226	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-54.8	-36	178.8	-167	177.1	-177.1	79.5	10.9	113.5	L573 V574 D576 K582 D586 L587 N596	L573-R584 PolarHBondContact O-N 3.4Å; V574-R584 WeakPolarHBondContact O-CD 3.43Å; V574-R584 PolarHBondContact O-NH1 2.95Å; D576-R584 WeakPolarHBondContact OD1-CD 3.45Å; D576-R584 WeakPolarHBondContact OD2-CD 3.38Å; D576-R584 IonicContact OD2-NE 3.46Å; K582-R584 PolarHBondContact O-N 3.2Å; R584-D586 PolarHBondContact O-N 2.97Å; R584-L587 PolarHBondContact O-N 3.33Å; R584-N596 PolarHBondContact NH1-ND2 3.35Å; R584-N596 PolarHBondContact NH2-ND2 3.4Å
585	K	75.4	Confident	74.4	Confident	176 Å²	176	67.4 Å²	67.4	77%	0.765	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-70.8	-21.4	178.5	-70.2	-170.6	174.8	-171.7	0	113.5	K582 F583	K582-K585 HydrophobicContact CB-CG 4.46Å; K582-K585 PolarHBondContact O-N 2.87Å; F583-K585 PolarHBondContact O-N 3.39Å
586	D	77.3	Confident	74.9	Confident	83 Å²	83	69.1 Å²	69.1	44%	0.444	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-92.5	-3	179.7	-74.7	-26.3	0	0	0	112.4	K508 I511 F583 R584	K508-D586 IonicContact NZ-OD1 3.89Å; K508-D586 PolarHBondContact NZ-OD1 3.08Å; K508-D586 IonicContact NZ-OD2 2.8Å; K508-D586 PolarHBondContact NZ-OD2 2.83Å; I511-D586 HydrophobicContact CD1-CB 3.49Å; I511-D586 VanDerWaalsContact CD1-CB 3.49Å; F583-D586 WeakPolarHBondContact O-CB 3.39Å; F583-D586 PolarHBondContact O-N 3.47Å; R584-D586 PolarHBondContact O-N 2.97Å
587	L	82.1	Confident	75.9	Confident	18 Å²	18	68.8 Å²	68.8	9%	0.094	35%	0.349	C	S	.	.	S	Bend	trans	-106.7	133.5	174.4	-91.7	139.9	0	0	0	110	L573 F583 R584 H591 I595	L573-L587 HydrophobicContact CB-CD1 3.87Å; L573-L587 HydrophobicContact CD2-CD1 4.42Å; F583-L587 PolarHBondContact O-N 3.34Å; R584-L587 PolarHBondContact O-N 3.33Å; L587-H591 HydrophobicContact CD2-CB 3.98Å; L587-I595 HydrophobicContact CD2-CD1 4.3Å
588	E	84.3	Confident	77.3	Confident	94 Å²	94	65.5 Å²	65.5	44%	0.439	34%	0.337	S	S	.	.			trans	-65.2	148.4	173	-66.6	173.8	-174.2	0	0	111.1	K502 Q590 H591 A592	K502-E588 IonicContact NZ-OE1 3.3Å; K502-E588 PolarHBondContact NZ-OE1 3.02Å; K502-E588 IonicContact NZ-OE2 3.74Å; K502-E588 PolarHBondContact NZ-OE2 3.22Å; E588-Q590 VanDerWaalsContact C-N 3.26Å; E588-Q590 PolarHBondContact O-N 3.28Å; E588-H591 PolarHBondContact O-N 3.43Å; E588-H591 IonicContact OE2-CD2 3.43Å; E588-H591 IonicContact OE2-NE2 2.92Å; E588-A592 PolarHBondContact O-N 3.16Å
589	E	85.5	Confident	79	Confident	155 Å²	155	65.8 Å²	65.8	72%	0.724	34%	0.338	S	S	*	.	H	α-helix	trans	-60.1	-34.8	-173.1	-171.2	152.1	-163.1	0	0	113	H591 A592 T593	E589-H591 VanDerWaalsContact C-N 3.31Å; E589-H591 PolarHBondContact O-N 3.49Å; E589-A592 PolarHBondContact O-N 3.35Å; E589-T593 VanDerWaalsContact O-CB 3.28Å; E589-T593 WeakPolarHBondContact O-CB 3.38Å; E589-T593 PolarHBondContact O-N 3.44Å; E589-T593 PolarHBondContact O-OG1 2.88Å
590	Q	89	Confident	80.9	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	33%	0.332	S	S	*	.	H	α-helix	trans	-59.7	-42.4	175	83.4	176.4	3.1	0	0	111.9	E588 T593 A594	E588-Q590 VanDerWaalsContact C-N 3.26Å; E588-Q590 PolarHBondContact O-N 3.28Å; Q590-T593 PolarHBondContact O-N 3.48Å; Q590-A594 PolarHBondContact O-N 2.89Å
591	H	88.5	Confident	82.6	Confident	17 Å²	17	71.3 Å²	71.3	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-76.5	-40.9	-176.1	-61.7	-51.5	0	0	0	110.5	P499 L587 E588 E589 T593 A594 I595	P499-H591 HydrophobicContact CG-CB 4.05Å; L587-H591 HydrophobicContact CD2-CB 3.98Å; E588-H591 PolarHBondContact O-N 3.43Å; E588-H591 IonicContact OE2-CD2 3.43Å; E588-H591 IonicContact OE2-NE2 2.92Å; E589-H591 VanDerWaalsContact C-N 3.31Å; E589-H591 PolarHBondContact O-N 3.49Å; H591-T593 VanDerWaalsContact C-N 3.25Å; H591-T593 PolarHBondContact O-N 3.47Å; H591-A594 PolarHBondContact O-N 3Å; H591-I595 VanDerWaalsContact O-CG1 3.32Å; H591-I595 WeakPolarHBondContact O-CG1 3.29Å; H591-I595 PolarHBondContact O-N 3.17Å
592	A	86.9	Confident	84.3	Confident	2 Å²	2	63.1 Å²	63.1	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-36.9	172.3	0	0	0	0	0	111.7	V574 E588 E589 N596	V574-A592 HydrophobicContact CG1-CB 4.37Å; E588-A592 PolarHBondContact O-N 3.16Å; E589-A592 PolarHBondContact O-N 3.35Å; A592-N596 VanDerWaalsContact O-CB 3.28Å; A592-N596 WeakPolarHBondContact O-CB 3.15Å; A592-N596 PolarHBondContact O-N 3.42Å; A592-N596 PolarHBondContact O-ND2 2.94Å
593	T	90.8	Very high	85.3	Confident	59 Å²	59	59 Å²	59	36%	0.362	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-43	176.9	-54.1	0	0	0	0	111.6	E589 Q590 H591 N596 N597	E589-T593 VanDerWaalsContact O-CB 3.28Å; E589-T593 WeakPolarHBondContact O-CB 3.38Å; E589-T593 PolarHBondContact O-N 3.44Å; E589-T593 PolarHBondContact O-OG1 2.88Å; Q590-T593 PolarHBondContact O-N 3.48Å; H591-T593 VanDerWaalsContact C-N 3.25Å; H591-T593 PolarHBondContact O-N 3.47Å; T593-N596 PolarHBondContact O-N 3.19Å; T593-N597 WeakPolarHBondContact O-CB 3.15Å; T593-N597 VanDerWaalsContact O-CG 3.29Å; T593-N597 PolarHBondContact O-N 3Å
594	A	89.5	Confident	85.8	Confident	33 Å²	33	58.7 Å²	58.7	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-46.2	174.8	0	0	0	0	0	111.9	T495 Q590 H591 N597 F598	T495-A594 HydrophobicContact CG2-CB 3.98Å; Q590-A594 PolarHBondContact O-N 2.89Å; H591-A594 PolarHBondContact O-N 3Å; A594-N597 PolarHBondContact O-N 3.41Å; A594-F598 PolarHBondContact O-N 3.1Å
595	I	91.9	Very high	86.6	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-45.2	175.5	-66.4	168.4	0	0	0	110.7	L496 L570 V574 L587 H591 N597 F598 L599	L496-I595 HydrophobicContact CD2-CD1 4.46Å; L496-I595 HydrophobicContact CD2-CG1 4.26Å; L570-I595 HydrophobicContact CB-CG2 3.89Å; L570-I595 HydrophobicContact CD2-CD1 4.34Å; L570-I595 HydrophobicContact CD2-CG1 4.26Å; L570-I595 HydrophobicContact CD2-CG2 4.13Å; L570-I595 HydrophobicContact CG-CG2 4.44Å; V574-I595 HydrophobicContact CG1-CB 3.87Å; V574-I595 HydrophobicContact CG1-CD1 4.32Å; V574-I595 HydrophobicContact CG1-CG2 3.59Å; V574-I595 HydrophobicContact CG2-CG2 4.15Å; L587-I595 HydrophobicContact CD2-CD1 4.3Å; H591-I595 VanDerWaalsContact O-CG1 3.32Å; H591-I595 WeakPolarHBondContact O-CG1 3.29Å; H591-I595 PolarHBondContact O-N 3.17Å; I595-N597 VanDerWaalsContact C-N 3.32Å; I595-N597 PolarHBondContact O-N 3.48Å; I595-F598 PolarHBondContact O-N 3.47Å; I595-L599 HydrophobicContact CG2-CD1 3.89Å; I595-L599 HydrophobicContact CG2-CG 4.29Å; I595-L599 WeakPolarHBondContact O-CB 3.32Å; I595-L599 WeakPolarHBondContact O-CG 3.43Å; I595-L599 PolarHBondContact O-N 3.4Å
596	N	89.6	Confident	87.1	Confident	46 Å²	46	50.1 Å²	50.1	25%	0.246	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-40.2	176.4	-85.9	-23	0	0	0	112.2	V574 R584 A592 T593 L599 K600	V574-N596 WeakPolarHBondContact CG2-OD1 3.44Å; R584-N596 PolarHBondContact NH1-ND2 3.35Å; R584-N596 PolarHBondContact NH2-ND2 3.4Å; A592-N596 VanDerWaalsContact O-CB 3.28Å; A592-N596 WeakPolarHBondContact O-CB 3.15Å; A592-N596 PolarHBondContact O-N 3.42Å; A592-N596 PolarHBondContact O-ND2 2.94Å; T593-N596 PolarHBondContact O-N 3.19Å; N596-L599 PolarHBondContact O-N 2.97Å; N596-K600 WeakPolarHBondContact O-CB 3.42Å; N596-K600 VanDerWaalsContact O-CG 3.22Å; N596-K600 WeakPolarHBondContact O-CG 3.38Å; N596-K600 PolarHBondContact O-N 3.19Å
597	N	90	Very high	87.3	Confident	90 Å²	90	46.2 Å²	46.2	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-65.6	-44	177.2	-74	-12.5	0	0	0	111.4	T593 A594 I595 K600 Q601	T593-N597 WeakPolarHBondContact O-CB 3.15Å; T593-N597 VanDerWaalsContact O-CG 3.29Å; T593-N597 PolarHBondContact O-N 3Å; A594-N597 PolarHBondContact O-N 3.41Å; I595-N597 VanDerWaalsContact C-N 3.32Å; I595-N597 PolarHBondContact O-N 3.48Å; N597-K600 WeakPolarHBondContact O-CB 3.13Å; N597-K600 PolarHBondContact O-N 3.29Å; N597-K600 VanDerWaalsContact O-N 3.16Å; N597-Q601 PolarHBondContact O-N 3.02Å
598	F	92.4	Very high	87.5	Confident	17 Å²	17	45.7 Å²	45.7	8%	0.075	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-49.3	173.1	176.3	-89.3	0	0	0	111.7	L491 V566 L570 A594 I595 K600 Q601 S602 W605	L491-F598 HydrophobicContact CB-CD2 4.1Å; L491-F598 HydrophobicContact CB-CE2 4.01Å; L491-F598 HydrophobicContact CD1-CB 4.2Å; L491-F598 HydrophobicContact CD1-CD2 3.95Å; L491-F598 HydrophobicContact CD1-CE2 4.49Å; L491-F598 HydrophobicContact CD1-CG 3.98Å; L491-F598 HydrophobicContact CD2-CD1 3.84Å; L491-F598 HydrophobicContact CD2-CD2 3.64Å; L491-F598 HydrophobicContact CD2-CE1 3.63Å; L491-F598 HydrophobicContact CD2-CE2 3.37Å; L491-F598 HydrophobicContact CD2-CG 3.86Å; L491-F598 HydrophobicContact CD2-CZ 3.39Å; L491-F598 HydrophobicContact CG-CD2 4.08Å; L491-F598 HydrophobicContact CG-CE2 4.13Å; L491-F598 HydrophobicContact CG-CG 4.43Å; V566-F598 HydrophobicContact CG1-CE1 4.04Å; V566-F598 HydrophobicContact CG1-CZ 4.24Å; L570-F598 HydrophobicContact CD1-CD1 3.72Å; L570-F598 HydrophobicContact CD1-CE1 3.83Å; A594-F598 PolarHBondContact O-N 3.1Å; I595-F598 PolarHBondContact O-N 3.47Å; F598-K600 PolarHBondContact O-N 2.97Å; F598-Q601 PolarHBondContact O-N 3.15Å; F598-S602 WeakPolarHBondContact CE1-OG 3.46Å; F598-S602 WeakPolarHBondContact O-CB 3.26Å; F598-S602 PolarHBondContact O-N 3.28Å; F598-S602 PolarHBondContact O-OG 2.8Å; F598-W605 HydrophobicContact CD2-CH2 4.21Å; F598-W605 AromaticContact CE2-CH2 3.32Å; F598-W605 HydrophobicContact CE2-CH2 3.32Å; F598-W605 HydrophobicContact CE2-CZ2 4.12Å; F598-W605 AromaticContact CE2-CZ3 3.79Å; F598-W605 HydrophobicContact CE2-CZ3 3.79Å; F598-W605 AromaticContact CZ-CH2 3.75Å; F598-W605 HydrophobicContact CZ-CH2 3.75Å; F598-W605 AromaticContact CZ-CZ3 3.71Å; F598-W605 HydrophobicContact CZ-CZ3 3.71Å
599	L	89.4	Confident	87.7	Confident	15 Å²	15	43 Å²	43	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-32.4	177.4	-73.6	171.9	0	0	0	111.5	R567 L570 E571 V574 I595 N596 V603	R567-L599 HydrophobicContact CB-CD2 4.16Å; R567-L599 HydrophobicContact CG-CD2 4.3Å; R567-L599 PolarHBondContact NH1-O 2.88Å; R567-L599 WeakPolarHBondContact O-CD2 3.35Å; L570-L599 HydrophobicContact CB-CD1 4.42Å; L570-L599 HydrophobicContact CB-CD2 4.07Å; L570-L599 HydrophobicContact CB-CG 4.38Å; E571-L599 HydrophobicContact CB-CD1 4.24Å; E571-L599 HydrophobicContact CB-CD2 4.49Å; V574-L599 HydrophobicContact CG2-CD1 3.56Å; I595-L599 HydrophobicContact CG2-CD1 3.89Å; I595-L599 HydrophobicContact CG2-CG 4.29Å; I595-L599 WeakPolarHBondContact O-CB 3.32Å; I595-L599 WeakPolarHBondContact O-CG 3.43Å; I595-L599 PolarHBondContact O-N 3.4Å; N596-L599 PolarHBondContact O-N 2.97Å; L599-V603 VanDerWaalsContact O-CG2 3.28Å; L599-V603 WeakPolarHBondContact O-CG2 3.48Å
600	K	85.1	Confident	87.7	Confident	110 Å²	110	37 Å²	37	48%	0.478	19%	0.191	S	C	.	.	H	α-helix	trans	-70.1	-43.2	176.2	-80	179.8	179.4	179	0	112.6	R254 N596 N597 F598	R254-K600 VanDerWaalsContact NH2-CG 3.29Å; R254-K600 PolarHBondContact NH2-O 2.94Å; N596-K600 WeakPolarHBondContact O-CB 3.42Å; N596-K600 VanDerWaalsContact O-CG 3.22Å; N596-K600 WeakPolarHBondContact O-CG 3.38Å; N596-K600 PolarHBondContact O-N 3.19Å; N597-K600 WeakPolarHBondContact O-CB 3.13Å; N597-K600 PolarHBondContact O-N 3.29Å; N597-K600 VanDerWaalsContact O-N 3.16Å; F598-K600 PolarHBondContact O-N 2.97Å
601	Q	86.2	Confident	87.6	Confident	89 Å²	89	31.2 Å²	31.2	42%	0.416	16%	0.164	S	C	.	.	H	α-helix	trans	-74.9	-43.7	-178.8	-169.5	179.5	10.1	0	0	111.6	N597 F598 V603 F604	N597-Q601 PolarHBondContact O-N 3.02Å; F598-Q601 PolarHBondContact O-N 3.15Å; Q601-V603 PolarHBondContact O-N 2.84Å; Q601-F604 PolarHBondContact O-N 3.37Å
602	S	90.2	Very high	87.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-69.7	-4.2	-176.2	57.6	0	0	0	0	115	R567 F598 F604 W605	R567-S602 VanDerWaalsContact NH1-C 3.32Å; R567-S602 PolarHBondContact NH1-OG 3.26Å; F598-S602 WeakPolarHBondContact CE1-OG 3.46Å; F598-S602 WeakPolarHBondContact O-CB 3.26Å; F598-S602 PolarHBondContact O-N 3.28Å; F598-S602 PolarHBondContact O-OG 2.8Å; S602-F604 PolarHBondContact O-N 2.97Å; S602-W605 PolarHBondContact O-N 3.09Å
603	V	83	Confident	87.3	Confident	15 Å²	15	35.9 Å²	35.9	9%	0.091	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-59.9	-36.8	169.2	175.5	0	0	0	0	111.1	R254 L599 Q601 W605	R254-V603 VanDerWaalsContact NH1-CG2 3.34Å; L599-V603 VanDerWaalsContact O-CG2 3.28Å; L599-V603 WeakPolarHBondContact O-CG2 3.48Å; Q601-V603 PolarHBondContact O-N 2.84Å; V603-W605 VanDerWaalsContact C-N 3.34Å
604	F	82.9	Confident	86.9	Confident	29 Å²	29	33.9 Å²	33.9	13%	0.127	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-88	-3.9	-174.5	-57.3	-68.3	0	0	0	113.5	L307 L404 Q601 S602 P607 L608	L307-F604 HydrophobicContact CB-CD1 3.76Å; L307-F604 HydrophobicContact CB-CE1 3.94Å; L307-F604 HydrophobicContact CD2-CB 4.22Å; L307-F604 HydrophobicContact CD2-CD1 3.95Å; L307-F604 HydrophobicContact CG-CD1 4.48Å; L404-F604 HydrophobicContact CD1-CB 3.51Å; L404-F604 HydrophobicContact CD1-CD1 4.15Å; L404-F604 HydrophobicContact CD1-CD2 4.41Å; L404-F604 HydrophobicContact CD1-CG 3.78Å; Q601-F604 PolarHBondContact O-N 3.37Å; S602-F604 PolarHBondContact O-N 2.97Å; F604-P607 WeakPolarHBondContact O-CD 3.17Å; F604-L608 HydrophobicContact CB-CD1 4.49Å; F604-L608 WeakPolarHBondContact O-CB 3.37Å; F604-L608 VanDerWaalsContact O-CG 3.27Å; F604-L608 WeakPolarHBondContact O-CG 3.49Å; F604-L608 PolarHBondContact O-N 3.18Å
605	W	89.2	Confident	86.8	Confident	6 Å²	6	32.4 Å²	32.4	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-68.7	-40.6	-175.6	-68.9	2.8	0	0	0	112.1	I484 L487 L563 F598 S602 V603 L608 L609	I484-W605 HydrophobicContact CD1-CB 3.84Å; I484-W605 HydrophobicContact CD1-CD2 4.38Å; I484-W605 HydrophobicContact CD1-CG 3.85Å; I484-W605 HydrophobicContact CG1-CB 4.46Å; I484-W605 HydrophobicContact CG1-CD2 4.05Å; I484-W605 HydrophobicContact CG1-CG 3.97Å; I484-W605 HydrophobicContact CG2-CD2 3.96Å; I484-W605 HydrophobicContact CG2-CE3 3.64Å; I484-W605 HydrophobicContact CG2-CG 4.46Å; I484-W605 HydrophobicContact CG2-CZ3 3.95Å; L487-W605 HydrophobicContact CB-CH2 3.82Å; L487-W605 HydrophobicContact CB-CZ2 3.75Å; L487-W605 HydrophobicContact CD1-CZ2 3.9Å; L563-W605 HydrophobicContact CD1-CE3 3.58Å; L563-W605 HydrophobicContact CD1-CZ3 4.13Å; L563-W605 HydrophobicContact CD2-CB 3.95Å; F598-W605 HydrophobicContact CD2-CH2 4.21Å; F598-W605 AromaticContact CE2-CH2 3.32Å; F598-W605 HydrophobicContact CE2-CH2 3.32Å; F598-W605 HydrophobicContact CE2-CZ2 4.12Å; F598-W605 AromaticContact CE2-CZ3 3.79Å; F598-W605 HydrophobicContact CE2-CZ3 3.79Å; F598-W605 AromaticContact CZ-CH2 3.75Å; F598-W605 HydrophobicContact CZ-CH2 3.75Å; F598-W605 AromaticContact CZ-CZ3 3.71Å; F598-W605 HydrophobicContact CZ-CZ3 3.71Å; S602-W605 PolarHBondContact O-N 3.09Å; V603-W605 VanDerWaalsContact C-N 3.34Å; W605-L608 PolarHBondContact O-N 3.1Å; W605-L609 WeakPolarHBondContact O-CB 3.48Å; W605-L609 WeakPolarHBondContact O-CG 2.96Å; W605-L609 PolarHBondContact O-N 3.15Å
606	T	84.7	Confident	86.4	Confident	50 Å²	50	33.5 Å²	33.5	31%	0.307	17%	0.168	S	C	.	.	H	α-helix	trans	-58.1	-52.5	174.3	-61.4	0	0	0	0	111.4	F560 L608 L609 Q610	F560-T606 HydrophobicContact CD1-CG2 4.02Å; F560-T606 HydrophobicContact CE1-CG2 3.72Å; T606-L608 PolarHBondContact O-N 3.15Å; T606-L609 PolarHBondContact O-N 3.05Å; T606-Q610 PolarHBondContact O-N 3.27Å
607	P	81.7	Confident	85.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-56.3	-41.7	173	-29.9	33.9	0	0	0	115.6	L307 F604 Q610 F611 F614	L307-P607 HydrophobicContact CD2-CB 3.42Å; L307-P607 VanDerWaalsContact CD2-CB 3.42Å; L307-P607 HydrophobicContact CD2-CG 4.09Å; F604-P607 WeakPolarHBondContact O-CD 3.17Å; P607-Q610 CarbonylContact O-C 3.59Å; P607-Q610 PolarHBondContact O-N 2.65Å; P607-F611 PolarHBondContact O-N 2.65Å; P607-F614 VanDerWaalsContact CA-CD2 3.5Å; P607-F614 HydrophobicContact CB-CD1 3.78Å; P607-F614 HydrophobicContact CB-CD2 4.02Å; P607-F614 HydrophobicContact CB-CE1 3.89Å; P607-F614 HydrophobicContact CB-CE2 4.11Å; P607-F614 HydrophobicContact CB-CG 3.83Å; P607-F614 HydrophobicContact CB-CZ 4.04Å; P607-F614 HydrophobicContact CG-CD1 4.29Å; P607-F614 HydrophobicContact CG-CE1 3.89Å; P607-F614 HydrophobicContact CG-CE2 4.34Å; P607-F614 HydrophobicContact CG-CZ 3.9Å
608	L	87.7	Confident	85.5	Confident	7 Å²	7	27.6 Å²	27.6	4%	0.037	14%	0.138	C	C	.	.	H	α-helix	trans	-68	-38.9	179	-74	171.2	0	0	0	111.9	T400 A403 L404 L407 I480 I484 F604 W605 T606 Q610 F611	T400-L608 HydrophobicContact CG2-CD1 4.22Å; A403-L608 HydrophobicContact CB-CD2 4.22Å; L404-L608 HydrophobicContact CB-CD2 4.11Å; L404-L608 HydrophobicContact CD1-CD1 3.94Å; L404-L608 HydrophobicContact CD1-CD2 4.1Å; L404-L608 HydrophobicContact CD1-CG 4.04Å; L407-L608 HydrophobicContact CD1-CD2 4.42Å; I480-L608 HydrophobicContact CD1-CB 4.18Å; I480-L608 HydrophobicContact CD1-CD2 3.97Å; I480-L608 HydrophobicContact CG1-CB 4.37Å; I480-L608 HydrophobicContact CG1-CD2 4.33Å; I480-L608 HydrophobicContact CG2-CB 3.75Å; I484-L608 HydrophobicContact CD1-CB 4.46Å; F604-L608 HydrophobicContact CB-CD1 4.49Å; F604-L608 WeakPolarHBondContact O-CB 3.37Å; F604-L608 VanDerWaalsContact O-CG 3.27Å; F604-L608 WeakPolarHBondContact O-CG 3.49Å; F604-L608 PolarHBondContact O-N 3.18Å; W605-L608 PolarHBondContact O-N 3.1Å; T606-L608 PolarHBondContact O-N 3.15Å; L608-Q610 PolarHBondContact O-N 2.84Å; L608-F611 WeakPolarHBondContact O-CB 3.12Å; L608-F611 PolarHBondContact O-N 3.08Å
609	L	88.7	Confident	85.1	Confident	38 Å²	38	26.8 Å²	26.8	20%	0.199	14%	0.135	C	C	.	.	H	α-helix	trans	-67.4	-28.7	176.2	-69.8	173	0	0	0	112	I480 Q481 I484 A557 F560 W605 T606	I480-L609 HydrophobicContact CG2-CD2 4.12Å; Q481-L609 HydrophobicContact CG-CD2 4.44Å; I484-L609 HydrophobicContact CD1-CD1 4.3Å; I484-L609 HydrophobicContact CD1-CD2 3.77Å; I484-L609 HydrophobicContact CD1-CG 3.75Å; A557-L609 HydrophobicContact CB-CD1 3.96Å; A557-L609 HydrophobicContact CB-CD2 3.22Å; A557-L609 HydrophobicContact CB-CG 4.24Å; F560-L609 HydrophobicContact CZ-CB 4.32Å; W605-L609 WeakPolarHBondContact O-CB 3.48Å; W605-L609 WeakPolarHBondContact O-CG 2.96Å; W605-L609 PolarHBondContact O-N 3.15Å; T606-L609 PolarHBondContact O-N 3.05Å
610	Q	84.5	Confident	84.8	Confident	29 Å²	29	27.7 Å²	27.7	14%	0.136	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	39.2	172.6	-63.9	177.6	-56.3	0	0	111.4	N42 F560 T606 P607 L608 S612 E613 F614	N42-Q610 PolarHBondContact OD1-NE2 3.04Å; F560-Q610 HydrophobicContact CE1-CG 4.15Å; F560-Q610 HydrophobicContact CZ-CG 3.72Å; T606-Q610 PolarHBondContact O-N 3.27Å; P607-Q610 CarbonylContact O-C 3.59Å; P607-Q610 PolarHBondContact O-N 2.65Å; L608-Q610 PolarHBondContact O-N 2.84Å; Q610-S612 VanDerWaalsContact C-N 3.3Å; Q610-S612 PolarHBondContact O-N 3.23Å; Q610-S612 VanDerWaalsContact O-N 3.15Å; Q610-E613 PolarHBondContact O-N 3.34Å; Q610-E613 VanDerWaalsContact O-N 3.14Å; Q610-F614 HydrophobicContact CB-CD2 3.76Å; Q610-F614 HydrophobicContact CB-CE2 4.02Å; Q610-F614 PolarHBondContact O-N 2.81Å
611	F	86.9	Confident	84.9	Confident	1 Å²	1	22.5 Å²	22.5	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-49	-46.3	-171	-179	-97.2	0	0	0	113.9	A403 L407 M469 E473 F476 V477 I480 P607 L608 F614 L615	A403-F611 HydrophobicContact CB-CD2 4.33Å; A403-F611 HydrophobicContact CB-CE2 3.89Å; L407-F611 HydrophobicContact CD1-CD2 3.75Å; L407-F611 HydrophobicContact CD1-CE2 3.91Å; L407-F611 HydrophobicContact CD2-CE2 4.29Å; L407-F611 HydrophobicContact CG-CD2 4.25Å; L407-F611 HydrophobicContact CG-CE2 3.91Å; M469-F611 HydrophobicContact CB-CZ 4.43Å; M469-F611 HydrophobicContact CE-CE2 3.72Å; M469-F611 HydrophobicContact CE-CZ 3.56Å; E473-F611 HydrophobicContact CB-CE1 4.34Å; E473-F611 HydrophobicContact CG-CD1 4.07Å; E473-F611 HydrophobicContact CG-CE1 4.39Å; F476-F611 HydrophobicContact CB-CZ 4.41Å; F476-F611 AromaticContact CD2-CE1 3.97Å; F476-F611 HydrophobicContact CD2-CE1 3.97Å; F476-F611 HydrophobicContact CD2-CE2 4.21Å; F476-F611 AromaticContact CD2-CZ 3.54Å; F476-F611 HydrophobicContact CD2-CZ 3.54Å; F476-F611 HydrophobicContact CE2-CZ 4.05Å; F476-F611 HydrophobicContact CG-CZ 4.24Å; V477-F611 HydrophobicContact CG2-CB 4.24Å; I480-F611 HydrophobicContact CD1-CB 4.37Å; I480-F611 HydrophobicContact CD1-CD2 4.13Å; I480-F611 HydrophobicContact CD1-CG 4.47Å; P607-F611 PolarHBondContact O-N 2.65Å; L608-F611 WeakPolarHBondContact O-CB 3.12Å; L608-F611 PolarHBondContact O-N 3.08Å; F611-F614 PolarHBondContact O-N 2.84Å; F611-L615 HydrophobicContact CE1-CD2 4.02Å; F611-L615 HydrophobicContact CZ-CD2 4.45Å; F611-L615 VanDerWaalsContact O-CB 3.26Å; F611-L615 WeakPolarHBondContact O-CB 3.46Å; F611-L615 PolarHBondContact O-N 2.76Å
612	S	86.3	Confident	85.1	Confident	28 Å²	28	18.2 Å²	18.2	20%	0.196	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-50	-178.6	-147.8	0	0	0	0	112.3	E473 Q610 F614 L615 D616	E473-S612 WeakPolarHBondContact OE1-CB 3.37Å; E473-S612 PolarHBondContact OE1-OG 3.4Å; Q610-S612 VanDerWaalsContact C-N 3.3Å; Q610-S612 PolarHBondContact O-N 3.23Å; Q610-S612 VanDerWaalsContact O-N 3.15Å; S612-F614 VanDerWaalsContact C-N 3.35Å; S612-F614 PolarHBondContact O-N 3.25Å; S612-L615 PolarHBondContact O-N 3.24Å; S612-D616 PolarHBondContact O-N 3.18Å
613	E	82.3	Confident	85	Confident	89 Å²	89	19.9 Å²	19.9	42%	0.416	11%	0.105	S	C	.	.	H	α-helix	trans	-65	-40.7	179.3	-174.5	179.3	172.7	0	0	111.1	Q610 D616 A617	Q610-E613 PolarHBondContact O-N 3.34Å; Q610-E613 VanDerWaalsContact O-N 3.14Å; E613-D616 PolarHBondContact O-N 3.38Å; E613-A617 VanDerWaalsContact O-CB 3.24Å; E613-A617 WeakPolarHBondContact O-CB 2.87Å; E613-A617 PolarHBondContact O-N 2.75Å
614	F	83.7	Confident	85.4	Confident	18 Å²	18	19.3 Å²	19.3	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-72.4	-28.7	177.1	-86	-90	0	0	0	113.3	H308 P607 Q610 F611 S612 C618	H308-F614 AromaticContact CD2-CE1 3.75Å; H308-F614 AromaticContact NE2-CE1 3.92Å; P607-F614 VanDerWaalsContact CA-CD2 3.5Å; P607-F614 HydrophobicContact CB-CD1 3.78Å; P607-F614 HydrophobicContact CB-CD2 4.02Å; P607-F614 HydrophobicContact CB-CE1 3.89Å; P607-F614 HydrophobicContact CB-CE2 4.11Å; P607-F614 HydrophobicContact CB-CG 3.83Å; P607-F614 HydrophobicContact CB-CZ 4.04Å; P607-F614 HydrophobicContact CG-CD1 4.29Å; P607-F614 HydrophobicContact CG-CE1 3.89Å; P607-F614 HydrophobicContact CG-CE2 4.34Å; P607-F614 HydrophobicContact CG-CZ 3.9Å; Q610-F614 HydrophobicContact CB-CD2 3.76Å; Q610-F614 HydrophobicContact CB-CE2 4.02Å; Q610-F614 PolarHBondContact O-N 2.81Å; F611-F614 PolarHBondContact O-N 2.84Å; S612-F614 VanDerWaalsContact C-N 3.35Å; S612-F614 PolarHBondContact O-N 3.25Å; F614-C618 VanDerWaalsContact O-CB 3.27Å; F614-C618 WeakPolarHBondContact O-CB 3.38Å; F614-C618 PolarHBondContact O-N 2.7Å; F614-C618 PolarHBondContact O-SG 3.03Å
615	L	86.3	Confident	86	Confident	1 Å²	1	18 Å²	18	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-65.4	-43.8	174.2	-179	61.8	0	0	0	110.7	L407 L410 Q466 M469 A470 F611 S612 C618 C619	L407-L615 VanDerWaalsContact CD2-CA 3.5Å; L407-L615 HydrophobicContact CD2-CB 3.97Å; L407-L615 HydrophobicContact CD2-CD1 3.92Å; L410-L615 HydrophobicContact CD1-CD1 3.51Å; Q466-L615 HydrophobicContact CG-CD1 4.27Å; Q466-L615 HydrophobicContact CG-CD2 4.49Å; Q466-L615 HydrophobicContact CG-CG 4.12Å; M469-L615 HydrophobicContact CB-CD1 4Å; M469-L615 HydrophobicContact CB-CD2 4.2Å; M469-L615 HydrophobicContact CE-CD1 4.44Å; M469-L615 HydrophobicContact SD-CD1 4.29Å; A470-L615 HydrophobicContact CB-CD2 3.94Å; F611-L615 HydrophobicContact CE1-CD2 4.02Å; F611-L615 HydrophobicContact CZ-CD2 4.45Å; F611-L615 VanDerWaalsContact O-CB 3.26Å; F611-L615 WeakPolarHBondContact O-CB 3.46Å; F611-L615 PolarHBondContact O-N 2.76Å; S612-L615 PolarHBondContact O-N 3.24Å; L615-C618 PolarHBondContact O-N 3.27Å; L615-C619 PolarHBondContact O-N 3.08Å; L615-C619 PolarHBondContact O-SG 2.98Å
616	D	82.9	Confident	86.3	Confident	24 Å²	24	17.7 Å²	17.7	13%	0.128	9%	0.094	C	C	.	.	H	α-helix	trans	-63.2	-49.7	176.1	-65.6	-19.8	0	0	0	112	R35 Q38 S612 E613 C618 C619 D620	R35-D616 IonicContact CZ-OD1 2.79Å; R35-D616 IonicContact CZ-OD2 3.93Å; R35-D616 IonicContact NH1-OD1 3.93Å; R35-D616 PolarHBondContact NH1-OD1 2.99Å; R35-D616 IonicContact NH1-OD2 2.68Å; R35-D616 PolarHBondContact NH1-OD2 3.39Å; R35-D616 IonicContact NH2-OD1 3.79Å; R35-D616 PolarHBondContact NH2-OD1 3.12Å; R35-D616 IonicContact NH2-OD2 3.7Å; Q38-D616 PolarHBondContact NE2-OD2 3.22Å; S612-D616 PolarHBondContact O-N 3.18Å; E613-D616 PolarHBondContact O-N 3.38Å; D616-C618 PolarHBondContact O-N 2.97Å; D616-C619 CarbonylContact O-C 3.17Å; D616-C619 PolarHBondContact O-N 3Å; D616-D620 PolarHBondContact O-N 2.86Å
617	A	79.6	Confident	86.9	Confident	11 Å²	11	15.4 Å²	15.4	9%	0.091	8%	0.08	C	C	.	.	H	α-helix	trans	-51.5	-56.9	173.6	0	0	0	0	0	110	F310 E613 C619 D620	F310-A617 HydrophobicContact CB-CB 4.07Å; F310-A617 HydrophobicContact CD1-CB 3.29Å; F310-A617 VanDerWaalsContact CD2-CA 3.49Å; F310-A617 HydrophobicContact CD2-CB 3.59Å; F310-A617 WeakPolarHBondContact CD2-O 3.33Å; F310-A617 HydrophobicContact CE1-CB 3.47Å; F310-A617 VanDerWaalsContact CE1-CB 3.47Å; F310-A617 HydrophobicContact CE2-CB 3.87Å; F310-A617 WeakPolarHBondContact CE2-O 3.46Å; F310-A617 HydrophobicContact CG-CB 3.33Å; F310-A617 HydrophobicContact CZ-CB 3.77Å; E613-A617 VanDerWaalsContact O-CB 3.24Å; E613-A617 WeakPolarHBondContact O-CB 2.87Å; E613-A617 PolarHBondContact O-N 2.75Å; A617-C619 PolarHBondContact O-N 2.61Å; A617-D620 PolarHBondContact O-N 3.22Å
618	C	82	Confident	87.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-58.7	-11.9	-179.2	-70	0	0	0	0	114.7	L407 L410 T414 F614 L615 D616	L407-C618 HydrophobicContact CD2-CB 4.36Å; L410-C618 CarbonylContact C-O 3.32Å; L410-C618 HydrophobicContact CB-CB 4.04Å; T414-C618 VanDerWaalsContact CB-O 3.31Å; T414-C618 WeakPolarHBondContact CB-O 3.4Å; T414-C618 PolarHBondContact OG1-O 2.87Å; F614-C618 VanDerWaalsContact O-CB 3.27Å; F614-C618 WeakPolarHBondContact O-CB 3.38Å; F614-C618 PolarHBondContact O-N 2.7Å; F614-C618 PolarHBondContact O-SG 3.03Å; L615-C618 PolarHBondContact O-N 3.27Å; D616-C618 PolarHBondContact O-N 2.97Å
619	C	84.3	Confident	87.8	Confident	1 Å²	1	17 Å²	17	1%	0.007	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	8.2	179.4	-63.1	0	0	0	0	114.9	I462 Q466 L615 D616 A617 L621	I462-C619 HydrophobicContact CG2-CB 4.12Å; Q466-C619 HydrophobicContact CB-CB 4.39Å; Q466-C619 VanDerWaalsContact CD-CB 3.47Å; Q466-C619 HydrophobicContact CG-CB 4.06Å; L615-C619 PolarHBondContact O-N 3.08Å; L615-C619 PolarHBondContact O-SG 2.98Å; D616-C619 CarbonylContact O-C 3.17Å; D616-C619 PolarHBondContact O-N 3Å; A617-C619 PolarHBondContact O-N 2.61Å; C619-L621 PolarHBondContact O-N 3.08Å
620	D	82.4	Confident	88.1	Confident	34 Å²	34	15.7 Å²	15.7	18%	0.182	8%	0.079	C	C	.	.			trans	-72	114.3	-177.7	178.6	15.9	0	0	0	111.1	F310 D616 A617 S622	F310-D620 HydrophobicContact CE2-CB 3.61Å; F310-D620 HydrophobicContact CZ-CB 3.62Å; D616-D620 PolarHBondContact O-N 2.86Å; A617-D620 PolarHBondContact O-N 3.22Å; D620-S622 WeakPolarHBondContact OD1-CB 3.37Å; D620-S622 PolarHBondContact OD1-N 3.22Å; D620-S622 PolarHBondContact OD1-OG 3.22Å; D620-S622 PolarHBondContact OD2-OG 3.44Å
621	L	88.2	Confident	88.6	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.076	C	C	.	.			trans	-116.7	17.8	175	-65.1	169.3	0	0	0	111.8	T414 V417 V418 I459 I462 C619 Q623 L624 L673 D676	T414-L621 HydrophobicContact CG2-CD2 3.92Å; V417-L621 HydrophobicContact CB-CD2 4.39Å; V417-L621 HydrophobicContact CG1-CD2 3.94Å; V418-L621 HydrophobicContact CG2-CD2 4.15Å; I459-L621 HydrophobicContact CG2-CD1 3.49Å; I459-L621 VanDerWaalsContact CG2-CD1 3.49Å; I462-L621 HydrophobicContact CD1-CD1 4.39Å; C619-L621 PolarHBondContact O-N 3.08Å; L621-Q623 PolarHBondContact O-N 3.3Å; L621-Q623 VanDerWaalsContact O-N 3.13Å; L621-L624 HydrophobicContact CB-CD1 4.1Å; L621-L624 HydrophobicContact CD2-CD1 4.41Å; L621-L624 WeakPolarHBondContact O-CB 3.24Å; L621-L624 WeakPolarHBondContact O-CG 3.14Å; L621-L624 PolarHBondContact O-N 3.47Å; L621-L624 VanDerWaalsContact O-N 3.13Å; L621-L673 HydrophobicContact CB-CD2 3.56Å; L621-L673 HydrophobicContact CD1-CD2 3.67Å; L621-L673 HydrophobicContact CG-CD2 4.29Å; L621-D676 PolarHBondContact N-OD2 3.3Å
622	S	90	Very high	89	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-57.1	-29.9	-178.3	62.7	0	0	0	0	113.6	D620 L624 W625 F626 D676 S677	D620-S622 WeakPolarHBondContact OD1-CB 3.37Å; D620-S622 PolarHBondContact OD1-N 3.22Å; D620-S622 PolarHBondContact OD1-OG 3.22Å; D620-S622 PolarHBondContact OD2-OG 3.44Å; S622-L624 PolarHBondContact O-N 3.27Å; S622-L624 VanDerWaalsContact O-N 3.15Å; S622-W625 PolarHBondContact O-N 2.89Å; S622-F626 WeakPolarHBondContact O-CD2 3.27Å; S622-F626 WeakPolarHBondContact O-CE2 3.33Å; S622-D676 WeakPolarHBondContact CB-O 3.3Å; S622-S677 PolarHBondContact O-OG 3.2Å
623	Q	87.5	Confident	89.2	Confident	34 Å²	34	18.7 Å²	18.7	16%	0.159	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-63.9	-18.3	-179.6	-58.8	-56.2	-34.8	0	0	113.9	L621 W625	L621-Q623 PolarHBondContact O-N 3.3Å; L621-Q623 VanDerWaalsContact O-N 3.13Å; Q623-W625 PolarHBondContact O-N 3.05Å
624	L	92.3	Very high	89.8	Confident	3 Å²	3	15.7 Å²	15.7	2%	0.016	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-67.4	-23.5	179.8	-64.7	-180	0	0	0	112.9	Y421 I459 L621 S622 M647 L673	Y421-L624 HydrophobicContact CD1-CD2 3.81Å; Y421-L624 HydrophobicContact CD2-CD2 3.56Å; Y421-L624 HydrophobicContact CE1-CD2 4.21Å; Y421-L624 HydrophobicContact CE2-CD2 4.03Å; Y421-L624 HydrophobicContact CG-CD2 3.45Å; Y421-L624 VanDerWaalsContact CG-CD2 3.45Å; I459-L624 HydrophobicContact CD1-CD1 4.1Å; L621-L624 HydrophobicContact CB-CD1 4.1Å; L621-L624 HydrophobicContact CD2-CD1 4.41Å; L621-L624 WeakPolarHBondContact O-CB 3.24Å; L621-L624 WeakPolarHBondContact O-CG 3.14Å; L621-L624 PolarHBondContact O-N 3.47Å; L621-L624 VanDerWaalsContact O-N 3.13Å; S622-L624 PolarHBondContact O-N 3.27Å; S622-L624 VanDerWaalsContact O-N 3.15Å; L624-M647 HydrophobicContact CB-CB 4.02Å; L624-M647 WeakPolarHBondContact O-CB 3.39Å; L624-L673 HydrophobicContact CD1-CD1 4.17Å; L624-L673 HydrophobicContact CD1-CD2 4.43Å
625	W	95.9	Very high	90.1	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.008	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-38.9	-179.6	-175.7	84.7	0	0	0	113.3	S622 Q623 R627 P648 Y674 S677 L690 E693 V694 E697	S622-W625 PolarHBondContact O-N 2.89Å; Q623-W625 PolarHBondContact O-N 3.05Å; W625-R627 PolarHBondContact O-NH1 2.79Å; W625-P648 HydrophobicContact CB-CG 4.13Å; W625-Y674 AromaticContact CD1-CE1 3.68Å; W625-Y674 AromaticContact NE1-CE1 3.89Å; W625-S677 WeakPolarHBondContact CB-OG 3.42Å; W625-L690 HydrophobicContact CZ3-CD2 4.4Å; W625-E693 HydrophobicContact CH2-CB 3.79Å; W625-E693 HydrophobicContact CZ2-CB 4.08Å; W625-V694 HydrophobicContact CD2-CG2 3.69Å; W625-V694 HydrophobicContact CE3-CG2 3.6Å; W625-V694 HydrophobicContact CH2-CG2 3.53Å; W625-V694 HydrophobicContact CZ2-CB 4.31Å; W625-V694 HydrophobicContact CZ2-CG2 3.6Å; W625-V694 HydrophobicContact CZ3-CG2 3.52Å; W625-E697 PolarHBondContact NE1-OE1 2.71Å; W625-E697 PolarHBondContact NE1-OE2 3.47Å
626	F	95.5	Very high	90.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.			trans	-64.5	141.8	-175.4	-63.5	-64.7	0	0	0	111.8	Y85 D323 S622 S677 C680 A681 F685 L690	Y85-F626 WeakPolarHBondContact OH-CB 3.23Å; D323-F626 WeakPolarHBondContact CB-O 3.34Å; S622-F626 WeakPolarHBondContact O-CD2 3.27Å; S622-F626 WeakPolarHBondContact O-CE2 3.33Å; F626-S677 WeakPolarHBondContact CZ-O 3.44Å; F626-C680 HydrophobicContact CE2-CB 3.82Å; F626-C680 HydrophobicContact CZ-CB 3.91Å; F626-A681 HydrophobicContact CE1-CB 4.44Å; F626-A681 HydrophobicContact CZ-CB 4.4Å; F626-F685 HydrophobicContact CD1-CD2 4.32Å; F626-F685 AromaticContact CD1-CE2 3.77Å; F626-F685 HydrophobicContact CD1-CE2 3.77Å; F626-F685 AromaticContact CD2-CE2 3.82Å; F626-F685 HydrophobicContact CD2-CE2 3.82Å; F626-F685 HydrophobicContact CD2-CZ 4.47Å; F626-F685 AromaticContact CE1-CD2 3.74Å; F626-F685 HydrophobicContact CE1-CD2 3.74Å; F626-F685 AromaticContact CE1-CE2 3.56Å; F626-F685 HydrophobicContact CE1-CE2 3.56Å; F626-F685 HydrophobicContact CE2-CD2 4.27Å; F626-F685 AromaticContact CE2-CE2 3.6Å; F626-F685 HydrophobicContact CE2-CE2 3.6Å; F626-F685 HydrophobicContact CE2-CZ 4.43Å; F626-F685 AromaticContact CG-CE2 3.91Å; F626-F685 HydrophobicContact CG-CE2 3.91Å; F626-F685 AromaticContact CZ-CD2 3.71Å; F626-F685 HydrophobicContact CZ-CD2 3.71Å; F626-F685 AromaticContact CZ-CE2 3.47Å; F626-F685 HydrophobicContact CZ-CE2 3.47Å; F626-F685 VanDerWaalsContact CZ-CE2 3.47Å; F626-L690 HydrophobicContact CE1-CD1 4.16Å
627	R	95.9	Very high	90.7	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	16%	0.158	C	C	.	.			trans	-154	27.5	-170.8	53.6	-157.4	-177.7	-119.9	11.4	114.3	D323 Y444 W625 F629 Y630 L631 F641 S646 E697	D323-R627 WeakPolarHBondContact OD2-CA 3.42Å; Y444-R627 HydrophobicContact CE1-CB 4.26Å; Y444-R627 HydrophobicContact CE2-CB 4.05Å; Y444-R627 WeakPolarHBondContact OH-CD 3.4Å; W625-R627 PolarHBondContact O-NH1 2.79Å; R627-F629 VanDerWaalsContact C-N 3.28Å; R627-F629 PolarHBondContact O-N 2.89Å; R627-Y630 PolarHBondContact O-N 2.93Å; R627-L631 HydrophobicContact CG-CD1 4.49Å; R627-L631 WeakPolarHBondContact O-CG 3.42Å; R627-L631 PolarHBondContact O-N 2.99Å; R627-F641 HydrophobicContact CB-CD2 4.38Å; R627-F641 HydrophobicContact CG-CD2 3.98Å; R627-F641 PolarHBondContact NH2-O 3.18Å; R627-S646 PolarHBondContact NH1-OG 3.43Å; R627-E697 IonicContact CZ-OE2 2.92Å; R627-E697 IonicContact NH1-OE2 3.65Å; R627-E697 IonicContact NH2-OE2 2.79Å; R627-E697 PolarHBondContact NH2-OE2 3.1Å
628	E	94.9	Very high	91.2	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.009	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-29	-176.1	-64.2	-62.6	122.8	0	0	113.2	Y85 R88 D323 E632	Y85-E628 HydrophobicContact CD1-CB 4.43Å; Y85-E628 HydrophobicContact CD1-CG 4.31Å; Y85-E628 HydrophobicContact CD2-CB 4.27Å; Y85-E628 HydrophobicContact CE1-CB 3.95Å; Y85-E628 HydrophobicContact CE1-CG 3.77Å; Y85-E628 HydrophobicContact CE2-CB 3.77Å; Y85-E628 PolarHBondContact OH-N 3.08Å; R88-E628 IonicContact CZ-OE1 3.35Å; R88-E628 IonicContact CZ-OE2 2.73Å; R88-E628 IonicContact NE-OE1 3.53Å; R88-E628 PolarHBondContact NE-OE1 3.46Å; R88-E628 IonicContact NE-OE2 3.75Å; R88-E628 PolarHBondContact NE-OE2 2.68Å; R88-E628 IonicContact NH2-OE1 2.94Å; R88-E628 PolarHBondContact NH2-OE1 3.41Å; R88-E628 IonicContact NH2-OE2 2.86Å; D323-E628 PolarHBondContact OD1-N 3.31Å; E628-E632 WeakPolarHBondContact O-CB 3.41Å; E628-E632 PolarHBondContact O-N 3.32Å
629	F	93.9	Very high	91.8	Very high	40 Å²	40	37.9 Å²	37.9	18%	0.175	20%	0.195	C	C	.	.	H	α-helix	trans	-69.2	-47.7	175.4	163.1	-97.8	0	0	0	110.8	M178 D323 M324 R627 L631 E632 M633	M178-F629 HydrophobicContact CB-CD2 4.33Å; M178-F629 HydrophobicContact CB-CE2 4.42Å; M178-F629 HydrophobicContact CE-CD2 3.81Å; M178-F629 HydrophobicContact SD-CB 4.39Å; M178-F629 HydrophobicContact SD-CD2 3.82Å; D323-F629 WeakPolarHBondContact OD1-CB 3.47Å; D323-F629 PolarHBondContact OD1-N 3.22Å; D323-F629 WeakPolarHBondContact OD2-CA 3.27Å; D323-F629 VanDerWaalsContact OD2-CB 3.29Å; D323-F629 WeakPolarHBondContact OD2-CB 3.35Å; D323-F629 PolarHBondContact OD2-N 3.03Å; M324-F629 HydrophobicContact CB-CB 4.24Å; M324-F629 HydrophobicContact CB-CD2 4.35Å; M324-F629 HydrophobicContact CB-CG 4.22Å; M324-F629 HydrophobicContact CG-CD2 4.41Å; R627-F629 VanDerWaalsContact C-N 3.28Å; R627-F629 PolarHBondContact O-N 2.89Å; F629-L631 VanDerWaalsContact C-N 3.31Å; F629-L631 PolarHBondContact O-N 3.2Å; F629-E632 WeakPolarHBondContact O-CB 3.04Å; F629-E632 PolarHBondContact O-N 2.94Å; F629-M633 HydrophobicContact CD1-SD 4.13Å; F629-M633 HydrophobicContact CE1-CG 4.41Å; F629-M633 HydrophobicContact CE1-SD 3.35Å; F629-M633 WeakPolarHBondContact CE1-SD 3.5Å; F629-M633 HydrophobicContact CE2-CG 4.26Å; F629-M633 HydrophobicContact CE2-SD 3.94Å; F629-M633 HydrophobicContact CZ-CG 4.14Å; F629-M633 HydrophobicContact CZ-SD 3.24Å; F629-M633 WeakPolarHBondContact CZ-SD 3.27Å; F629-M633 WeakPolarHBondContact O-CG 3.4Å; F629-M633 PolarHBondContact O-N 3.16Å
630	Y	94.4	Very high	92.3	Very high	10 Å²	10	40 Å²	40	4%	0.039	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-33.3	175.7	-76.4	-85.2	0	0	0	112.8	D323 L425 E443 Y444 R627 M633 T634	D323-Y630 HydrophobicContact CB-CD2 4.41Å; D323-Y630 VanDerWaalsContact OD2-CD2 3.25Å; D323-Y630 WeakPolarHBondContact OD2-CD2 3.32Å; D323-Y630 PolarHBondContact OD2-N 3.17Å; L425-Y630 HydrophobicContact CB-CE2 4.29Å; L425-Y630 HydrophobicContact CD1-CE2 4.24Å; L425-Y630 HydrophobicContact CD2-CE2 3.8Å; L425-Y630 HydrophobicContact CG-CE2 4.33Å; L425-Y630 PolarHBondContact O-OH 3.46Å; E443-Y630 HydrophobicContact CG-CE1 4.42Å; Y444-Y630 AromaticContact CD2-CD1 3.76Å; Y444-Y630 HydrophobicContact CD2-CD1 3.76Å; Y444-Y630 AromaticContact CD2-CD2 3.43Å; Y444-Y630 HydrophobicContact CD2-CD2 3.43Å; Y444-Y630 VanDerWaalsContact CD2-CD2 3.43Å; Y444-Y630 HydrophobicContact CD2-CE1 4.25Å; Y444-Y630 HydrophobicContact CD2-CE2 4.01Å; Y444-Y630 AromaticContact CD2-CG 3.32Å; Y444-Y630 HydrophobicContact CD2-CG 3.32Å; Y444-Y630 AromaticContact CE2-CD2 3.73Å; Y444-Y630 HydrophobicContact CE2-CD2 3.73Å; Y444-Y630 HydrophobicContact CE2-CE2 4.28Å; Y444-Y630 HydrophobicContact CE2-CG 4.05Å; Y444-Y630 HydrophobicContact CG-CD1 4.29Å; Y444-Y630 HydrophobicContact CG-CG 4.04Å; R627-Y630 PolarHBondContact O-N 2.93Å; Y630-M633 PolarHBondContact O-N 3.32Å; Y630-T634 VanDerWaalsContact O-CG2 3.25Å; Y630-T634 WeakPolarHBondContact O-CG2 3.22Å; Y630-T634 PolarHBondContact O-N 2.91Å
631	L	95.6	Very high	92.9	Very high	12 Å²	12	38.8 Å²	38.8	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-43.5	172.4	-72.6	173.2	0	0	0	112	R627 F629 M633 T634 N638 F641	R627-L631 HydrophobicContact CG-CD1 4.49Å; R627-L631 WeakPolarHBondContact O-CG 3.42Å; R627-L631 PolarHBondContact O-N 2.99Å; F629-L631 VanDerWaalsContact C-N 3.31Å; F629-L631 PolarHBondContact O-N 3.2Å; L631-M633 VanDerWaalsContact C-N 3.3Å; L631-M633 PolarHBondContact O-N 3.44Å; L631-T634 WeakPolarHBondContact O-CB 3.35Å; L631-T634 PolarHBondContact O-N 3.08Å; L631-T634 PolarHBondContact O-OG1 3.16Å; L631-N638 HydrophobicContact CD2-CB 4.41Å; L631-F641 HydrophobicContact CD2-CD2 3.61Å; L631-F641 HydrophobicContact CD2-CE2 3.5Å; L631-F641 HydrophobicContact CD2-CG 4.34Å; L631-F641 HydrophobicContact CD2-CZ 4.13Å; L631-F641 HydrophobicContact CG-CD2 4.05Å; L631-F641 HydrophobicContact CG-CE2 3.75Å
632	E	94.4	Very high	93.3	Very high	24 Å²	24	41.3 Å²	41.3	11%	0.112	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-41.7	174.9	-175.4	71	-163.6	0	0	111.3	K179 A180 S181 E628 F629 T634 M635	K179-E632 HydrophobicContact CD-CG 4.15Å; K179-E632 WeakPolarHBondContact CD-OE2 3.33Å; K179-E632 IonicContact NZ-OE2 3.3Å; K179-E632 PolarHBondContact NZ-OE2 3.46Å; A180-E632 WeakPolarHBondContact CA-OE1 3.32Å; A180-E632 PolarHBondContact N-OE1 3.25Å; S181-E632 PolarHBondContact N-OE1 3.42Å; S181-E632 PolarHBondContact OG-OE1 3.19Å; S181-E632 PolarHBondContact OG-OE2 3.11Å; E628-E632 WeakPolarHBondContact O-CB 3.41Å; E628-E632 PolarHBondContact O-N 3.32Å; F629-E632 WeakPolarHBondContact O-CB 3.04Å; F629-E632 PolarHBondContact O-N 2.94Å; E632-T634 PolarHBondContact O-N 3.35Å; E632-M635 PolarHBondContact O-N 3.46Å
633	M	92.3	Very high	93.5	Very high	85 Å²	85	42 Å²	42	42%	0.419	22%	0.217	S	C	.	.	H	α-helix	trans	-64.1	-23.9	178.4	-71.8	-173.6	69.4	0	0	113.9	F629 Y630 L631 M635	F629-M633 HydrophobicContact CD1-SD 4.13Å; F629-M633 HydrophobicContact CE1-CG 4.41Å; F629-M633 HydrophobicContact CE1-SD 3.35Å; F629-M633 WeakPolarHBondContact CE1-SD 3.5Å; F629-M633 HydrophobicContact CE2-CG 4.26Å; F629-M633 HydrophobicContact CE2-SD 3.94Å; F629-M633 HydrophobicContact CZ-CG 4.14Å; F629-M633 HydrophobicContact CZ-SD 3.24Å; F629-M633 WeakPolarHBondContact CZ-SD 3.27Å; F629-M633 WeakPolarHBondContact O-CG 3.4Å; F629-M633 PolarHBondContact O-N 3.16Å; Y630-M633 PolarHBondContact O-N 3.32Å; L631-M633 VanDerWaalsContact C-N 3.3Å; L631-M633 PolarHBondContact O-N 3.44Å; M633-M635 PolarHBondContact O-N 3.46Å; M633-M635 VanDerWaalsContact O-N 3.12Å
634	T	93.2	Very high	93.8	Very high	27 Å²	27	44 Å²	44	17%	0.166	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.4	174.3	75.4	0	0	0	0	112.8	Y630 L631 E632 G636 K637 N638 F641	Y630-T634 VanDerWaalsContact O-CG2 3.25Å; Y630-T634 WeakPolarHBondContact O-CG2 3.22Å; Y630-T634 PolarHBondContact O-N 2.91Å; L631-T634 WeakPolarHBondContact O-CB 3.35Å; L631-T634 PolarHBondContact O-N 3.08Å; L631-T634 PolarHBondContact O-OG1 3.16Å; E632-T634 PolarHBondContact O-N 3.35Å; T634-G636 PolarHBondContact O-N 2.97Å; T634-G636 VanDerWaalsContact O-N 3.16Å; T634-G636 PolarHBondContact OG1-N 3.2Å; T634-K637 VanDerWaalsContact O-CB 3.31Å; T634-K637 WeakPolarHBondContact O-CB 3.46Å; T634-K637 PolarHBondContact O-N 3.37Å; T634-N638 HydrophobicContact CG2-CB 4.02Å; T634-N638 PolarHBondContact OG1-N 3.33Å; T634-N638 PolarHBondContact OG1-O 2.9Å; T634-F641 HydrophobicContact CG2-CE1 4Å; T634-F641 HydrophobicContact CG2-CZ 3.69Å
635	M	90.8	Very high	94	Very high	147 Å²	147	44.3 Å²	44.3	72%	0.724	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	40.3	-176	-63.5	-169.8	-79.2	0	0	112	R92 E632 M633 K637	R92-M635 VanDerWaalsContact CZ-C 3.44Å; R92-M635 VanDerWaalsContact NH1-C 3.35Å; R92-M635 PolarHBondContact NH1-O 2.94Å; R92-M635 PolarHBondContact NH2-O 2.9Å; E632-M635 PolarHBondContact O-N 3.46Å; M633-M635 PolarHBondContact O-N 3.46Å; M633-M635 VanDerWaalsContact O-N 3.12Å; M635-K637 VanDerWaalsContact C-N 3.33Å
636	G	89	Confident	94	Very high	41 Å²	41	44.2 Å²	44.2	42%	0.423	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	15.4	176.8	0	0	0	0	0	115.4	T634 N638	T634-G636 PolarHBondContact O-N 2.97Å; T634-G636 VanDerWaalsContact O-N 3.16Å; T634-G636 PolarHBondContact OG1-N 3.2Å; G636-N638 VanDerWaalsContact C-N 3.32Å
637	K	91.7	Very high	94	Very high	164 Å²	164	44.5 Å²	44.5	71%	0.713	23%	0.229	S	C	*	.	S	Bend	trans	-62.6	-42.7	165.5	-178.5	-171.9	172	-166.1	0	110.6	T634 M635	T634-K637 VanDerWaalsContact O-CB 3.31Å; T634-K637 WeakPolarHBondContact O-CB 3.46Å; T634-K637 PolarHBondContact O-N 3.37Å; M635-K637 VanDerWaalsContact C-N 3.33Å
638	N	92	Very high	93.9	Very high	35 Å²	35	44.4 Å²	44.4	19%	0.187	23%	0.229	C	C	.	.			trans	-113.3	131.2	178.7	-61	-19.8	0	0	0	109.7	E442 L631 T634 G636 F641	E442-N638 PolarHBondContact OE2-ND2 3.34Å; L631-N638 HydrophobicContact CD2-CB 4.41Å; T634-N638 HydrophobicContact CG2-CB 4.02Å; T634-N638 PolarHBondContact OG1-N 3.33Å; T634-N638 PolarHBondContact OG1-O 2.9Å; G636-N638 VanDerWaalsContact C-N 3.32Å; N638-F641 WeakPolarHBondContact ND2-CE1 3.48Å
639	I	92.7	Very high	93.9	Very high	134 Å²	134	44.7 Å²	44.7	69%	0.687	23%	0.23	S	C	*	.	S	Bend	trans	-83.5	-29.5	170	-172.3	58.8	0	0	0	111.8	R88	R88-I639 PolarHBondContact NH1-O 2.67Å
640	Q	94.7	Very high	94	Very high	45 Å²	45	43.4 Å²	43.4	21%	0.21	23%	0.225	C	C	.	.	S	Bend	trans	-156.9	155.9	173.5	-168.2	46.2	-85.1	0	0	108.7	E693	Q640-E693 PolarHBondContact NE2-OE2 3.14Å
641	F	96	Very high	93.9	Very high	9 Å²	9	43.1 Å²	43.1	4%	0.039	22%	0.224	C	C	.	.			trans	-87.5	148.8	173.1	-64.6	-73.9	0	0	0	111.6	Y444 R627 L631 T634 N638 M645	Y444-F641 HydrophobicContact CD1-CB 4.26Å; Y444-F641 HydrophobicContact CD1-CD1 4.01Å; Y444-F641 AromaticContact CD1-CD2 3.59Å; Y444-F641 HydrophobicContact CD1-CD2 3.59Å; Y444-F641 HydrophobicContact CD1-CE1 4.22Å; Y444-F641 AromaticContact CD1-CE2 3.81Å; Y444-F641 HydrophobicContact CD1-CE2 3.81Å; Y444-F641 AromaticContact CD1-CG 3.69Å; Y444-F641 HydrophobicContact CD1-CG 3.69Å; Y444-F641 HydrophobicContact CD1-CZ 4.13Å; Y444-F641 HydrophobicContact CE1-CB 4.43Å; Y444-F641 AromaticContact CE1-CD2 3.92Å; Y444-F641 HydrophobicContact CE1-CD2 3.92Å; Y444-F641 HydrophobicContact CE1-CE2 4.39Å; Y444-F641 HydrophobicContact CE1-CG 4.2Å; Y444-F641 HydrophobicContact CG-CD2 4.23Å; Y444-F641 HydrophobicContact CG-CE1 4.37Å; Y444-F641 AromaticContact CG-CE2 3.96Å; Y444-F641 HydrophobicContact CG-CE2 3.96Å; Y444-F641 HydrophobicContact CG-CZ 4.05Å; R627-F641 HydrophobicContact CB-CD2 4.38Å; R627-F641 HydrophobicContact CG-CD2 3.98Å; R627-F641 PolarHBondContact NH2-O 3.18Å; L631-F641 HydrophobicContact CD2-CD2 3.61Å; L631-F641 HydrophobicContact CD2-CE2 3.5Å; L631-F641 HydrophobicContact CD2-CG 4.34Å; L631-F641 HydrophobicContact CD2-CZ 4.13Å; L631-F641 HydrophobicContact CG-CD2 4.05Å; L631-F641 HydrophobicContact CG-CE2 3.75Å; T634-F641 HydrophobicContact CG2-CE1 4Å; T634-F641 HydrophobicContact CG2-CZ 3.69Å; N638-F641 WeakPolarHBondContact ND2-CE1 3.48Å; F641-M645 HydrophobicContact CB-CB 4.24Å; F641-M645 HydrophobicContact CB-SD 4.21Å; F641-M645 HydrophobicContact CD1-SD 3.78Å; F641-M645 HydrophobicContact CG-SD 4.34Å
642	P	95.7	Very high	93.8	Very high	52 Å²	52	42.5 Å²	42.5	34%	0.338	22%	0.221	S	C	.	.			trans	-71.1	163.9	178.2	33.7	-37.8	0	0	0	112	E644 M645	P642-E644 VanDerWaalsContact C-N 3.26Å; P642-E644 HydrophobicContact CB-CG 4.43Å; P642-E644 WeakPolarHBondContact CB-OE1 2.93Å; P642-E644 HydrophobicContact CG-CG 4.16Å; P642-E644 WeakPolarHBondContact CG-OE1 3.43Å; P642-E644 PolarHBondContact O-N 2.87Å; P642-M645 HydrophobicContact CG-CE 3.75Å; P642-M645 HydrophobicContact CG-CG 4.08Å; P642-M645 HydrophobicContact CG-SD 4.16Å; P642-M645 PolarHBondContact O-N 3.33Å
643	I	95.9	Very high	93.7	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.072	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-64	-29.5	-169.3	67.9	175.3	0	0	0	113	M645 S646 W649 E697 L700	I643-M645 PolarHBondContact O-N 2.91Å; I643-M645 VanDerWaalsContact O-N 3.13Å; I643-S646 VanDerWaalsContact O-CB 3.32Å; I643-S646 WeakPolarHBondContact O-CB 3.48Å; I643-S646 PolarHBondContact O-N 3.2Å; I643-W649 HydrophobicContact CB-CB 4.35Å; I643-W649 HydrophobicContact CB-CG 4.06Å; I643-W649 HydrophobicContact CD1-CD2 4.25Å; I643-W649 HydrophobicContact CD1-CG 4.21Å; I643-W649 HydrophobicContact CD1-CZ2 4.43Å; I643-W649 HydrophobicContact CG1-CG 4.2Å; I643-W649 WeakPolarHBondContact O-CB 3.47Å; I643-W649 VanDerWaalsContact O-CD1 3.3Å; I643-E697 HydrophobicContact CG2-CG 3.75Å; I643-L700 HydrophobicContact CD1-CD2 4.11Å; I643-L700 HydrophobicContact CD1-CG 4.21Å; I643-L700 HydrophobicContact CG2-CD2 3.93Å
644	E	93.8	Very high	93.7	Very high	78 Å²	78	40.6 Å²	40.6	36%	0.364	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-64.3	-12.4	175.6	56.9	-90.5	-157	0	0	114.2	R449 P642 I650	R449-E644 WeakPolarHBondContact CB-O 2.8Å; R449-E644 WeakPolarHBondContact CG-O 3.45Å; P642-E644 VanDerWaalsContact C-N 3.26Å; P642-E644 HydrophobicContact CB-CG 4.43Å; P642-E644 WeakPolarHBondContact CB-OE1 2.93Å; P642-E644 HydrophobicContact CG-CG 4.16Å; P642-E644 WeakPolarHBondContact CG-OE1 3.43Å; P642-E644 PolarHBondContact O-N 2.87Å; E644-I650 WeakPolarHBondContact O-CD1 3.31Å; E644-I650 VanDerWaalsContact O-CG1 3.23Å; E644-I650 WeakPolarHBondContact O-CG1 3.38Å
645	M	95.9	Very high	93.6	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.044	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-101.1	-7.6	171.9	-52.1	-170.9	-170.4	0	0	112.6	E442 Y444 E445 T448 F641 P642 I643	E442-M645 HydrophobicContact CG-CE 4.06Å; E442-M645 HydrophobicContact CG-SD 4.18Å; E442-M645 WeakPolarHBondContact OE1-CE 3.24Å; E442-M645 VanDerWaalsContact OE1-SD 3.36Å; Y444-M645 HydrophobicContact CD1-CB 4Å; Y444-M645 HydrophobicContact CD1-SD 4.47Å; Y444-M645 HydrophobicContact CE1-CB 4.07Å; Y444-M645 WeakPolarHBondContact CE1-O 3.33Å; E445-M645 HydrophobicContact CB-CE 3.76Å; E445-M645 HydrophobicContact CB-CG 4.16Å; E445-M645 HydrophobicContact CB-SD 3.7Å; E445-M645 HydrophobicContact CG-CE 3.81Å; E445-M645 HydrophobicContact CG-CG 4.01Å; E445-M645 HydrophobicContact CG-SD 4.1Å; T448-M645 PolarHBondContact OG1-O 3.02Å; F641-M645 HydrophobicContact CB-CB 4.24Å; F641-M645 HydrophobicContact CB-SD 4.21Å; F641-M645 HydrophobicContact CD1-SD 3.78Å; F641-M645 HydrophobicContact CG-SD 4.34Å; P642-M645 HydrophobicContact CG-CE 3.75Å; P642-M645 HydrophobicContact CG-CG 4.08Å; P642-M645 HydrophobicContact CG-SD 4.16Å; P642-M645 PolarHBondContact O-N 3.33Å; I643-M645 PolarHBondContact O-N 2.91Å; I643-M645 VanDerWaalsContact O-N 3.13Å
646	S	96.3	Very high	93.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.			trans	-86.8	123.4	-177.9	-174.8	0	0	0	0	110.9	R627 I643 W649 I650 E697	R627-S646 PolarHBondContact NH1-OG 3.43Å; I643-S646 VanDerWaalsContact O-CB 3.32Å; I643-S646 WeakPolarHBondContact O-CB 3.48Å; I643-S646 PolarHBondContact O-N 3.2Å; S646-W649 PolarHBondContact O-N 2.89Å; S646-W649 VanDerWaalsContact O-N 3.15Å; S646-I650 VanDerWaalsContact O-CG1 3.27Å; S646-I650 WeakPolarHBondContact O-CG1 3.21Å; S646-I650 PolarHBondContact O-N 3.26Å; S646-E697 WeakPolarHBondContact CB-OE1 3.35Å; S646-E697 PolarHBondContact OG-OE1 2.99Å
647	M	94.2	Very high	93.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.025	17%	0.172	C	C	.	.	H	α-helix	trans	-58.1	-45.7	-175.2	-70.5	-61.2	-61.6	0	0	114.1	Y421 T448 Y452 L624 W649 I650 L651	Y421-M647 HydrophobicContact CD2-CG 4.11Å; Y421-M647 HydrophobicContact CE2-CG 3.54Å; Y421-M647 HydrophobicContact CE2-SD 4.28Å; T448-M647 HydrophobicContact CG2-CG 4.45Å; T448-M647 HydrophobicContact CG2-SD 4.23Å; Y452-M647 HydrophobicContact CD2-CE 4.05Å; Y452-M647 HydrophobicContact CD2-SD 4.18Å; Y452-M647 HydrophobicContact CE1-CE 4.09Å; Y452-M647 HydrophobicContact CE2-CE 3.62Å; Y452-M647 HydrophobicContact CE2-SD 3.61Å; L624-M647 HydrophobicContact CB-CB 4.02Å; L624-M647 WeakPolarHBondContact O-CB 3.39Å; M647-W649 VanDerWaalsContact C-N 3.27Å; M647-W649 PolarHBondContact O-N 3.14Å; M647-I650 PolarHBondContact O-N 3.44Å; M647-I650 HydrophobicContact SD-CD1 4.09Å; M647-L651 HydrophobicContact CE-CG 4.49Å; M647-L651 WeakPolarHBondContact O-CB 3.26Å; M647-L651 WeakPolarHBondContact O-CG 2.86Å; M647-L651 PolarHBondContact O-N 3.36Å
648	P	94.6	Very high	93.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-53.7	-42.8	175.4	-29.4	37.2	0	0	0	113.4	W625 T652 L673 Y674	W625-P648 HydrophobicContact CB-CG 4.13Å; P648-T652 WeakPolarHBondContact O-CB 2.94Å; P648-T652 PolarHBondContact O-N 3.44Å; P648-T652 VanDerWaalsContact O-N 3.1Å; P648-T652 PolarHBondContact O-OG1 3.34Å; P648-L673 HydrophobicContact CB-CB 4.06Å; P648-L673 HydrophobicContact CB-CD1 4.46Å; P648-L673 HydrophobicContact CG-CB 3.96Å; P648-Y674 HydrophobicContact CB-CD1 4.25Å; P648-Y674 HydrophobicContact CB-CD2 4.13Å; P648-Y674 HydrophobicContact CB-CE1 3.83Å; P648-Y674 HydrophobicContact CB-CE2 3.68Å; P648-Y674 HydrophobicContact CB-CG 4.4Å; P648-Y674 HydrophobicContact CG-CD1 4.46Å; P648-Y674 HydrophobicContact CG-CE1 4.19Å
649	W	95.9	Very high	92.2	Very high	8 Å²	8	39 Å²	39	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-73.6	-43.1	177.6	-176.4	-114	0	0	0	112.6	I643 S646 M647 L651 T652 D653 L656 G701 Q704 F705	I643-W649 HydrophobicContact CB-CB 4.35Å; I643-W649 HydrophobicContact CB-CG 4.06Å; I643-W649 HydrophobicContact CD1-CD2 4.25Å; I643-W649 HydrophobicContact CD1-CG 4.21Å; I643-W649 HydrophobicContact CD1-CZ2 4.43Å; I643-W649 HydrophobicContact CG1-CG 4.2Å; I643-W649 WeakPolarHBondContact O-CB 3.47Å; I643-W649 VanDerWaalsContact O-CD1 3.3Å; S646-W649 PolarHBondContact O-N 2.89Å; S646-W649 VanDerWaalsContact O-N 3.15Å; M647-W649 VanDerWaalsContact C-N 3.27Å; M647-W649 PolarHBondContact O-N 3.14Å; W649-L651 PolarHBondContact O-N 3.39Å; W649-T652 HydrophobicContact CE3-CG2 4.32Å; W649-T652 HydrophobicContact CZ3-CG2 4.09Å; W649-T652 PolarHBondContact O-N 2.97Å; W649-T652 VanDerWaalsContact O-N 3.15Å; W649-D653 HydrophobicContact CD2-CB 4.41Å; W649-D653 HydrophobicContact CZ2-CB 4.19Å; W649-D653 VanDerWaalsContact O-CB 3.27Å; W649-D653 WeakPolarHBondContact O-CB 3.23Å; W649-D653 PolarHBondContact O-N 3.27Å; W649-L656 HydrophobicContact CH2-CD1 4.45Å; W649-G701 WeakPolarHBondContact CH2-O 3.44Å; W649-G701 WeakPolarHBondContact CZ3-O 3.3Å; W649-Q704 HydrophobicContact CH2-CB 3.57Å; W649-Q704 HydrophobicContact CZ2-CB 3.78Å; W649-Q704 VanDerWaalsContact CZ2-OE1 3.28Å; W649-F705 HydrophobicContact CH2-CB 4.5Å; W649-F705 HydrophobicContact CZ3-CB 4.25Å
650	I	94.7	Very high	91.5	Very high	13 Å²	13	36.5 Å²	36.5	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-54.2	-42.5	176.6	-69.9	162.3	0	0	0	111	R449 K457 E644 S646 M647 H654	R449-I650 HydrophobicContact CB-CD1 4.26Å; K457-I650 HydrophobicContact CD-CG2 4.48Å; E644-I650 WeakPolarHBondContact O-CD1 3.31Å; E644-I650 VanDerWaalsContact O-CG1 3.23Å; E644-I650 WeakPolarHBondContact O-CG1 3.38Å; S646-I650 VanDerWaalsContact O-CG1 3.27Å; S646-I650 WeakPolarHBondContact O-CG1 3.21Å; S646-I650 PolarHBondContact O-N 3.26Å; M647-I650 PolarHBondContact O-N 3.44Å; M647-I650 HydrophobicContact SD-CD1 4.09Å; I650-H654 VanDerWaalsContact O-CB 3.22Å; I650-H654 WeakPolarHBondContact O-CB 3.43Å; I650-H654 PolarHBondContact O-N 2.72Å; I650-H654 VanDerWaalsContact O-N 3.08Å
651	L	93	Very high	90.4	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-43.8	179.4	-64.8	170.6	0	0	0	111.5	K457 I459 M647 W649 I655 Q670 L673	K457-L651 HydrophobicContact CB-CD2 3.68Å; K457-L651 HydrophobicContact CG-CD2 3.92Å; I459-L651 HydrophobicContact CD1-CD1 3.58Å; M647-L651 HydrophobicContact CE-CG 4.49Å; M647-L651 WeakPolarHBondContact O-CB 3.26Å; M647-L651 WeakPolarHBondContact O-CG 2.86Å; M647-L651 PolarHBondContact O-N 3.36Å; W649-L651 PolarHBondContact O-N 3.39Å; L651-I655 WeakPolarHBondContact O-CG1 3.2Å; L651-I655 PolarHBondContact O-N 3.45Å; L651-Q670 HydrophobicContact CB-CB 4.24Å; L651-Q670 HydrophobicContact CB-CG 4.07Å; L651-L673 HydrophobicContact CD1-CD1 3.81Å
652	T	93	Very high	89.4	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-49.3	177.9	-57.6	0	0	0	0	111.5	P648 W649 H654 I655 L656 Q670 L671 F705	P648-T652 WeakPolarHBondContact O-CB 2.94Å; P648-T652 PolarHBondContact O-N 3.44Å; P648-T652 VanDerWaalsContact O-N 3.1Å; P648-T652 PolarHBondContact O-OG1 3.34Å; W649-T652 HydrophobicContact CE3-CG2 4.32Å; W649-T652 HydrophobicContact CZ3-CG2 4.09Å; W649-T652 PolarHBondContact O-N 2.97Å; W649-T652 VanDerWaalsContact O-N 3.15Å; T652-H654 VanDerWaalsContact C-N 3.31Å; T652-H654 PolarHBondContact O-N 3.05Å; T652-I655 WeakPolarHBondContact O-CB 3.3Å; T652-I655 PolarHBondContact O-N 3.35Å; T652-I655 VanDerWaalsContact O-N 3.15Å; T652-L656 PolarHBondContact O-N 2.84Å; T652-Q670 WeakPolarHBondContact OG1-CB 3.37Å; T652-L671 HydrophobicContact CG2-CD1 4.43Å; T652-L671 HydrophobicContact CG2-CD2 4Å; T652-L671 HydrophobicContact CG2-CG 3.93Å; T652-F705 HydrophobicContact CG2-CD2 3.87Å; T652-F705 HydrophobicContact CG2-CE2 4.44Å
653	D	93	Very high	88.7	Confident	40 Å²	40	38.8 Å²	38.8	21%	0.214	20%	0.196	C	C	.	.	H	α-helix	trans	-65.1	-36.1	-179.2	-165.7	49.2	0	0	0	111.6	W649 I655 L656 E657 K708	W649-D653 HydrophobicContact CD2-CB 4.41Å; W649-D653 HydrophobicContact CZ2-CB 4.19Å; W649-D653 VanDerWaalsContact O-CB 3.27Å; W649-D653 WeakPolarHBondContact O-CB 3.23Å; W649-D653 PolarHBondContact O-N 3.27Å; D653-I655 VanDerWaalsContact C-N 3.33Å; D653-I655 PolarHBondContact O-N 2.82Å; D653-L656 PolarHBondContact O-N 2.99Å; D653-E657 WeakPolarHBondContact O-CG 3.37Å; D653-E657 PolarHBondContact O-N 3.42Å; D653-K708 IonicContact OD1-NZ 2.76Å; D653-K708 PolarHBondContact OD1-NZ 3.14Å; D653-K708 IonicContact OD2-NZ 3.78Å
654	H	91.7	Very high	88.3	Confident	28 Å²	28	38.5 Å²	38.5	13%	0.13	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-41.4	173.4	-179.8	64	0	0	0	112.5	S454 K457 I650 T652 L656 E657 S658	S454-H654 VanDerWaalsContact CB-CE1 3.46Å; S454-H654 WeakPolarHBondContact CB-CE1 3.27Å; S454-H654 PolarHBondContact O-NE2 2.95Å; S454-H654 PolarHBondContact OG-CE1 3.31Å; K457-H654 HydrophobicContact CD-CB 3.71Å; K457-H654 VanDerWaalsContact CD-CG 3.45Å; I650-H654 VanDerWaalsContact O-CB 3.22Å; I650-H654 WeakPolarHBondContact O-CB 3.43Å; I650-H654 PolarHBondContact O-N 2.72Å; I650-H654 VanDerWaalsContact O-N 3.08Å; T652-H654 VanDerWaalsContact C-N 3.31Å; T652-H654 PolarHBondContact O-N 3.05Å; H654-L656 VanDerWaalsContact C-N 3.34Å; H654-E657 PolarHBondContact O-N 3.42Å; H654-S658 VanDerWaalsContact O-CB 3.32Å; H654-S658 WeakPolarHBondContact O-CB 3.41Å; H654-S658 PolarHBondContact O-N 3.39Å
655	I	90.3	Very high	87.9	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-43.4	175.3	-68.8	171	0	0	0	110.4	L651 T652 D653 E657 S658 M663 I664 C666 A667 Q670	L651-I655 WeakPolarHBondContact O-CG1 3.2Å; L651-I655 PolarHBondContact O-N 3.45Å; T652-I655 WeakPolarHBondContact O-CB 3.3Å; T652-I655 PolarHBondContact O-N 3.35Å; T652-I655 VanDerWaalsContact O-N 3.15Å; D653-I655 VanDerWaalsContact C-N 3.33Å; D653-I655 PolarHBondContact O-N 2.82Å; I655-E657 VanDerWaalsContact C-N 3.34Å; I655-E657 PolarHBondContact O-N 3.23Å; I655-S658 WeakPolarHBondContact O-CB 3.5Å; I655-S658 PolarHBondContact O-N 3.02Å; I655-M663 HydrophobicContact CG1-CB 4.46Å; I655-M663 HydrophobicContact CG2-CB 4.2Å; I655-M663 WeakPolarHBondContact CG2-O 3.47Å; I655-I664 HydrophobicContact CG2-CD1 4.29Å; I655-C666 HydrophobicContact CD1-CB 3.97Å; I655-A667 HydrophobicContact CG2-CB 3.88Å; I655-Q670 HydrophobicContact CD1-CG 3.42Å; I655-Q670 VanDerWaalsContact CD1-CG 3.42Å
656	L	90.3	Very high	87.4	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-43.7	177.3	-68.5	176.2	0	0	0	111.1	W649 T652 D653 H654 I664 F705 K708 L709 K712	W649-L656 HydrophobicContact CH2-CD1 4.45Å; T652-L656 PolarHBondContact O-N 2.84Å; D653-L656 PolarHBondContact O-N 2.99Å; H654-L656 VanDerWaalsContact C-N 3.34Å; L656-I664 HydrophobicContact CD2-CD1 4.37Å; L656-F705 HydrophobicContact CD1-CD2 3.89Å; L656-F705 HydrophobicContact CD2-CD2 4.01Å; L656-F705 HydrophobicContact CD2-CE2 3.98Å; L656-F705 HydrophobicContact CG-CD2 4.27Å; L656-K708 HydrophobicContact CD1-CB 4.03Å; L656-K708 HydrophobicContact CD1-CD 4.09Å; L656-L709 HydrophobicContact CD2-CB 4.37Å; L656-K712 WeakPolarHBondContact O-CD 3.3Å; L656-K712 WeakPolarHBondContact O-CE 3.43Å; L656-K712 PolarHBondContact O-NZ 3.22Å
657	E	89.1	Confident	87.1	Confident	94 Å²	94	37.4 Å²	37.4	44%	0.439	19%	0.192	S	C	.	.	H	α-helix	trans	-80.2	-14.9	-179.4	-61.4	-55	168.7	0	0	115.2	D653 H654 I655 K708 K712	D653-E657 WeakPolarHBondContact O-CG 3.37Å; D653-E657 PolarHBondContact O-N 3.42Å; H654-E657 PolarHBondContact O-N 3.42Å; I655-E657 VanDerWaalsContact C-N 3.34Å; I655-E657 PolarHBondContact O-N 3.23Å; E657-K708 IonicContact OE1-NZ 3.64Å; E657-K708 PolarHBondContact OE1-NZ 2.92Å; E657-K712 IonicContact OE2-NZ 2.82Å; E657-K712 PolarHBondContact OE2-NZ 3.29Å
658	S	84	Confident	86.9	Confident	34 Å²	34	37.2 Å²	37.2	24%	0.238	19%	0.19	C	C	.	.			trans	-61.7	140.5	177.2	-176.3	0	0	0	0	112.1	H654 I655 N660 M663	H654-S658 VanDerWaalsContact O-CB 3.32Å; H654-S658 WeakPolarHBondContact O-CB 3.41Å; H654-S658 PolarHBondContact O-N 3.39Å; I655-S658 WeakPolarHBondContact O-CB 3.5Å; I655-S658 PolarHBondContact O-N 3.02Å; S658-N660 VanDerWaalsContact C-N 3.26Å; S658-N660 WeakPolarHBondContact OG-CB 3.44Å; S658-N660 PolarHBondContact OG-N 3.37Å; S658-N660 VanDerWaalsContact OG-N 3.08Å; S658-M663 WeakPolarHBondContact OG-CE 3.41Å
659	R	72.1	Confident	86.7	Confident	246 Å²	246	38.6 Å²	38.6	93%	0.928	20%	0.196	S	C	*	.	S	Bend	trans	-81.2	-7.3	170.3	-63.6	-175.3	-177.1	179.1	1.5	112.7	P661	R659-P661 VanDerWaalsContact O-CD 3.25Å; R659-P661 WeakPolarHBondContact O-CD 3.31Å
660	N	77	Confident	86.4	Confident	83 Å²	83	38.3 Å²	38.3	44%	0.444	20%	0.195	S	C	.	.			trans	-84.1	109.9	-177.6	-175.4	-5.9	0	0	0	110.7	S658 A662 M663	S658-N660 VanDerWaalsContact C-N 3.26Å; S658-N660 WeakPolarHBondContact OG-CB 3.44Å; S658-N660 PolarHBondContact OG-N 3.37Å; S658-N660 VanDerWaalsContact OG-N 3.08Å; N660-A662 PolarHBondContact O-N 3.31Å; N660-A662 VanDerWaalsContact O-N 3.13Å; N660-A662 VanDerWaalsContact OD1-CB 3.31Å; N660-A662 WeakPolarHBondContact OD1-CB 3.49Å; N660-A662 PolarHBondContact OD1-N 3.43Å; N660-M663 HydrophobicContact CB-CG 4.21Å; N660-M663 PolarHBondContact O-N 2.85Å
661	P	72.3	Confident	86.3	Confident	64 Å²	64	37.8 Å²	37.8	42%	0.416	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-63.7	-22	-178.2	-17.9	31.9	0	0	0	113.4	R659 M663 I664 T747	R659-P661 VanDerWaalsContact O-CD 3.25Å; R659-P661 WeakPolarHBondContact O-CD 3.31Å; P661-M663 PolarHBondContact O-N 2.99Å; P661-I664 WeakPolarHBondContact O-CG2 3.34Å; P661-T747 HydrophobicContact CB-CG2 3.99Å; P661-T747 HydrophobicContact CG-CG2 4.1Å
662	A	74.7	Confident	86.1	Confident	64 Å²	64	38.1 Å²	38.1	53%	0.529	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-70.6	-21.1	-179.2	0	0	0	0	0	112.9	N660	N660-A662 PolarHBondContact O-N 3.31Å; N660-A662 VanDerWaalsContact O-N 3.13Å; N660-A662 VanDerWaalsContact OD1-CB 3.31Å; N660-A662 WeakPolarHBondContact OD1-CB 3.49Å; N660-A662 PolarHBondContact OD1-N 3.43Å
663	M	81.9	Confident	86.1	Confident	26 Å²	26	38.2 Å²	38.2	13%	0.128	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-82.9	-18	-178.5	-63	-136.6	-64.9	0	0	113.3	V458 I655 S658 N660 P661 E665 C666	V458-M663 HydrophobicContact CG2-SD 3.91Å; I655-M663 HydrophobicContact CG1-CB 4.46Å; I655-M663 HydrophobicContact CG2-CB 4.2Å; I655-M663 WeakPolarHBondContact CG2-O 3.47Å; S658-M663 WeakPolarHBondContact OG-CE 3.41Å; N660-M663 HydrophobicContact CB-CG 4.21Å; N660-M663 PolarHBondContact O-N 2.85Å; P661-M663 PolarHBondContact O-N 2.99Å; M663-E665 VanDerWaalsContact C-N 3.26Å; M663-E665 PolarHBondContact O-N 3.42Å; M663-C666 WeakPolarHBondContact O-CA 3.48Å; M663-C666 WeakPolarHBondContact O-CB 3.45Å; M663-C666 PolarHBondContact O-N 3.15Å
664	I	86.3	Confident	86.2	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.041	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-65	-31.9	-170.9	-155.3	73.9	0	0	0	112.6	I655 L656 P661 C666 A667 L709 R748 Y749 L752	I655-I664 HydrophobicContact CG2-CD1 4.29Å; L656-I664 HydrophobicContact CD2-CD1 4.37Å; P661-I664 WeakPolarHBondContact O-CG2 3.34Å; I664-C666 PolarHBondContact O-N 3.48Å; I664-A667 WeakPolarHBondContact O-CB 3.28Å; I664-A667 PolarHBondContact O-N 3.05Å; I664-L709 HydrophobicContact CD1-CD1 4.42Å; I664-R748 HydrophobicContact CG2-CB 4.02Å; I664-Y749 HydrophobicContact CD1-CE1 3.89Å; I664-Y749 HydrophobicContact CG1-CD1 3.89Å; I664-Y749 HydrophobicContact CG1-CE1 3.63Å; I664-Y749 HydrophobicContact CG2-CD1 4.49Å; I664-L752 HydrophobicContact CG1-CD1 3.59Å
665	E	85	Confident	86.2	Confident	40 Å²	40	36.5 Å²	36.5	19%	0.187	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-68	-15.9	175.1	-53.9	-166.1	148.2	0	0	112.1	I30 M663 R748 T751	I30-E665 HydrophobicContact CG2-CB 4.37Å; M663-E665 VanDerWaalsContact C-N 3.26Å; M663-E665 PolarHBondContact O-N 3.42Å; E665-R748 HydrophobicContact CG-CB 4.02Å; E665-R748 IonicContact OE1-CZ 3.78Å; E665-R748 VanDerWaalsContact OE1-CZ 3.25Å; E665-R748 IonicContact OE1-NE 3.99Å; E665-R748 PolarHBondContact OE1-NE 3.09Å; E665-R748 IonicContact OE1-NH2 2.73Å; E665-R748 PolarHBondContact OE1-NH2 3.45Å; E665-R748 IonicContact OE2-CZ 3.51Å; E665-R748 IonicContact OE2-NE 3.96Å; E665-R748 IonicContact OE2-NH2 3.11Å; E665-R748 PolarHBondContact OE2-NH2 3.42Å; E665-R748 VanDerWaalsContact OE2-NH2 3.14Å; E665-T751 WeakPolarHBondContact CG-OG1 3.33Å; E665-T751 WeakPolarHBondContact OE1-CG2 3.36Å; E665-T751 PolarHBondContact OE1-OG1 3.15Å
666	C	86.5	Confident	86.1	Confident	24 Å²	24	37.1 Å²	37.1	16%	0.162	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-85.1	-9	178.5	-59.6	0	0	0	0	113.5	S460 I655 M663 I664 L668 Y669 Q670	S460-C666 PolarHBondContact OG-SG 3.37Å; I655-C666 HydrophobicContact CD1-CB 3.97Å; M663-C666 WeakPolarHBondContact O-CA 3.48Å; M663-C666 WeakPolarHBondContact O-CB 3.45Å; M663-C666 PolarHBondContact O-N 3.15Å; I664-C666 PolarHBondContact O-N 3.48Å; C666-L668 PolarHBondContact O-N 3.42Å; C666-Y669 PolarHBondContact O-N 3.19Å; C666-Q670 PolarHBondContact O-N 2.91Å
667	A	89.7	Confident	86.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-39.9	-169.8	0	0	0	0	0	112.9	I655 I664 Y669 Q670 L671 F705	I655-A667 HydrophobicContact CG2-CB 3.88Å; I664-A667 WeakPolarHBondContact O-CB 3.28Å; I664-A667 PolarHBondContact O-N 3.05Å; A667-Y669 VanDerWaalsContact C-N 3.32Å; A667-Y669 PolarHBondContact O-N 3.15Å; A667-Q670 PolarHBondContact O-N 3.42Å; A667-Q670 VanDerWaalsContact O-N 3.1Å; A667-L671 PolarHBondContact O-N 2.84Å; A667-F705 HydrophobicContact CB-CE2 3.89Å; A667-F705 HydrophobicContact CB-CZ 4.47Å
668	L	90.8	Very high	86.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.1	-29.9	-179.2	-59.2	-175.8	0	0	0	112.5	I30 C666 Q670 L671 D672 F705 L752 Q755 F758	I30-L668 HydrophobicContact CD1-CD1 3.86Å; I30-L668 HydrophobicContact CG1-CD1 4.06Å; C666-L668 PolarHBondContact O-N 3.42Å; L668-Q670 VanDerWaalsContact C-N 3.26Å; L668-Q670 PolarHBondContact O-N 2.86Å; L668-L671 HydrophobicContact CD2-CD1 4.09Å; L668-L671 PolarHBondContact O-N 3.47Å; L668-D672 PolarHBondContact O-N 3.42Å; L668-F705 HydrophobicContact CD2-CE1 4.23Å; L668-F705 HydrophobicContact CD2-CZ 3.88Å; L668-L752 HydrophobicContact CD1-CD2 3.81Å; L668-L752 HydrophobicContact CD2-CD2 4.1Å; L668-L752 HydrophobicContact CG-CD2 3.7Å; L668-Q755 HydrophobicContact CD1-CG 3.89Å; L668-F758 HydrophobicContact CB-CD2 4.46Å; L668-F758 HydrophobicContact CB-CE2 4.01Å; L668-F758 HydrophobicContact CB-CZ 4.43Å; L668-F758 HydrophobicContact CD1-CD2 4.13Å; L668-F758 HydrophobicContact CD1-CE2 4.48Å; L668-F758 HydrophobicContact CD2-CD1 4.39Å; L668-F758 HydrophobicContact CD2-CD2 4.41Å; L668-F758 HydrophobicContact CD2-CE1 4.18Å; L668-F758 HydrophobicContact CD2-CE2 4.25Å; L668-F758 HydrophobicContact CD2-CG 4.5Å; L668-F758 HydrophobicContact CD2-CZ 4.14Å; L668-F758 HydrophobicContact CG-CE2 4.46Å
669	Y	89.6	Confident	86.7	Confident	30 Å²	30	34.5 Å²	34.5	12%	0.118	17%	0.174	C	C	.	.	H	α-helix	trans	-66.8	-27.3	171.9	-62.2	-68.2	0	0	0	113	E31 A32 K463 C666 A667	E31-Y669 WeakPolarHBondContact O-CE1 3.47Å; A32-Y669 HydrophobicContact CB-CD1 4.26Å; K463-Y669 HydrophobicContact CB-CD1 3.47Å; K463-Y669 VanDerWaalsContact CB-CD1 3.47Å; K463-Y669 HydrophobicContact CB-CE1 4.15Å; K463-Y669 HydrophobicContact CB-CG 4.21Å; K463-Y669 HydrophobicContact CG-CD1 4.48Å; C666-Y669 PolarHBondContact O-N 3.19Å; A667-Y669 VanDerWaalsContact C-N 3.32Å; A667-Y669 PolarHBondContact O-N 3.15Å
670	Q	90.2	Very high	87.6	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-77.3	-37.7	175.1	-55.8	-47.4	-48.4	0	0	111.3	L651 T652 I655 C666 A667 L668 D672 L673	L651-Q670 HydrophobicContact CB-CB 4.24Å; L651-Q670 HydrophobicContact CB-CG 4.07Å; T652-Q670 WeakPolarHBondContact OG1-CB 3.37Å; I655-Q670 HydrophobicContact CD1-CG 3.42Å; I655-Q670 VanDerWaalsContact CD1-CG 3.42Å; C666-Q670 PolarHBondContact O-N 2.91Å; A667-Q670 PolarHBondContact O-N 3.42Å; A667-Q670 VanDerWaalsContact O-N 3.1Å; L668-Q670 VanDerWaalsContact C-N 3.26Å; L668-Q670 PolarHBondContact O-N 2.86Å; Q670-D672 PolarHBondContact O-N 2.87Å; Q670-L673 VanDerWaalsContact O-CB 3.31Å; Q670-L673 WeakPolarHBondContact O-CB 3.41Å; Q670-L673 VanDerWaalsContact O-CG 3.27Å; Q670-L673 WeakPolarHBondContact O-CG 3.46Å; Q670-L673 PolarHBondContact O-N 2.71Å
671	L	91.6	Very high	88.3	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-64.2	-30.1	172.4	-75	169.7	0	0	0	112.3	T652 A667 L668 L673 Y674 F702 F705 F758	T652-L671 HydrophobicContact CG2-CD1 4.43Å; T652-L671 HydrophobicContact CG2-CD2 4Å; T652-L671 HydrophobicContact CG2-CG 3.93Å; A667-L671 PolarHBondContact O-N 2.84Å; L668-L671 HydrophobicContact CD2-CD1 4.09Å; L668-L671 PolarHBondContact O-N 3.47Å; L671-L673 PolarHBondContact O-N 3.39Å; L671-Y674 HydrophobicContact CD2-CD2 4.31Å; L671-Y674 HydrophobicContact CD2-CE2 4.17Å; L671-Y674 WeakPolarHBondContact O-CB 3.42Å; L671-Y674 WeakPolarHBondContact O-CD2 3.48Å; L671-Y674 PolarHBondContact O-N 3.2Å; L671-Y674 VanDerWaalsContact O-N 3.13Å; L671-F702 HydrophobicContact CD1-CD2 4.3Å; L671-F702 HydrophobicContact CD1-CE2 4.48Å; L671-F705 HydrophobicContact CD1-CD1 4.07Å; L671-F705 HydrophobicContact CD1-CD2 3.88Å; L671-F705 HydrophobicContact CD1-CE1 4.13Å; L671-F705 HydrophobicContact CD1-CE2 3.97Å; L671-F705 HydrophobicContact CD1-CG 3.95Å; L671-F705 HydrophobicContact CD1-CZ 4.08Å; L671-F758 HydrophobicContact CB-CZ 4.09Å; L671-F758 HydrophobicContact CD1-CE1 4.43Å
672	D	89.7	Confident	89.3	Confident	9 Å²	9	20.4 Å²	20.4	5%	0.048	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.4	175.9	-171.9	67	0	0	0	113.9	A32 K463 L668 Q670 Y674 N675 D676	A32-D672 HydrophobicContact CB-CB 3.7Å; A32-D672 WeakPolarHBondContact CB-OD1 3.45Å; A32-D672 WeakPolarHBondContact CB-OD2 3.48Å; K463-D672 WeakPolarHBondContact CD-OD2 3.21Å; K463-D672 WeakPolarHBondContact CE-OD2 3.37Å; K463-D672 IonicContact NZ-OD2 2.65Å; K463-D672 PolarHBondContact NZ-OD2 2.87Å; L668-D672 PolarHBondContact O-N 3.42Å; Q670-D672 PolarHBondContact O-N 2.87Å; D672-Y674 PolarHBondContact O-N 2.86Å; D672-Y674 VanDerWaalsContact O-N 3.09Å; D672-N675 WeakPolarHBondContact O-CA 3.46Å; D672-N675 VanDerWaalsContact O-CB 3.29Å; D672-N675 WeakPolarHBondContact O-CB 3.39Å; D672-N675 PolarHBondContact O-N 2.86Å; D672-N675 PolarHBondContact OD1-ND2 3.16Å; D672-D676 PolarHBondContact O-N 3.29Å
673	L	92	Very high	89.9	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-59.6	-23.6	173.9	-60.4	175.4	0	0	0	112.4	L621 L624 P648 L651 Q670 L671 S677	L621-L673 HydrophobicContact CB-CD2 3.56Å; L621-L673 HydrophobicContact CD1-CD2 3.67Å; L621-L673 HydrophobicContact CG-CD2 4.29Å; L624-L673 HydrophobicContact CD1-CD1 4.17Å; L624-L673 HydrophobicContact CD1-CD2 4.43Å; P648-L673 HydrophobicContact CB-CB 4.06Å; P648-L673 HydrophobicContact CB-CD1 4.46Å; P648-L673 HydrophobicContact CG-CB 3.96Å; L651-L673 HydrophobicContact CD1-CD1 3.81Å; Q670-L673 VanDerWaalsContact O-CB 3.31Å; Q670-L673 WeakPolarHBondContact O-CB 3.41Å; Q670-L673 VanDerWaalsContact O-CG 3.27Å; Q670-L673 WeakPolarHBondContact O-CG 3.46Å; Q670-L673 PolarHBondContact O-N 2.71Å; L671-L673 PolarHBondContact O-N 3.39Å; L673-S677 PolarHBondContact O-N 3.29Å; L673-S677 VanDerWaalsContact O-N 3.16Å; L673-S677 PolarHBondContact O-OG 3.32Å
674	Y	94.8	Very high	90.1	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-70.6	-32.7	171.3	-69.2	-66	0	0	0	112.9	W625 P648 L671 D672 S677 A678 V694 E697 V698	W625-Y674 AromaticContact CD1-CE1 3.68Å; W625-Y674 AromaticContact NE1-CE1 3.89Å; P648-Y674 HydrophobicContact CB-CD1 4.25Å; P648-Y674 HydrophobicContact CB-CD2 4.13Å; P648-Y674 HydrophobicContact CB-CE1 3.83Å; P648-Y674 HydrophobicContact CB-CE2 3.68Å; P648-Y674 HydrophobicContact CB-CG 4.4Å; P648-Y674 HydrophobicContact CG-CD1 4.46Å; P648-Y674 HydrophobicContact CG-CE1 4.19Å; L671-Y674 HydrophobicContact CD2-CD2 4.31Å; L671-Y674 HydrophobicContact CD2-CE2 4.17Å; L671-Y674 WeakPolarHBondContact O-CB 3.42Å; L671-Y674 WeakPolarHBondContact O-CD2 3.48Å; L671-Y674 PolarHBondContact O-N 3.2Å; L671-Y674 VanDerWaalsContact O-N 3.13Å; D672-Y674 PolarHBondContact O-N 2.86Å; D672-Y674 VanDerWaalsContact O-N 3.09Å; Y674-S677 PolarHBondContact O-N 3.34Å; Y674-A678 VanDerWaalsContact O-CB 3.24Å; Y674-A678 WeakPolarHBondContact O-CB 3.37Å; Y674-A678 PolarHBondContact O-N 3.33Å; Y674-V694 HydrophobicContact CD1-CG1 4.19Å; Y674-E697 HydrophobicContact CE1-CB 4.45Å; Y674-E697 HydrophobicContact CE1-CG 4.06Å; Y674-E697 WeakPolarHBondContact CE1-OE1 3.47Å; Y674-E697 PolarHBondContact OH-OE1 2.69Å; Y674-V698 VanDerWaalsContact CB-CG2 3.43Å; Y674-V698 HydrophobicContact CD1-CG2 3.56Å; Y674-V698 HydrophobicContact CD2-CG2 3.6Å; Y674-V698 HydrophobicContact CE1-CG2 4.13Å; Y674-V698 HydrophobicContact CE2-CG2 4.17Å; Y674-V698 HydrophobicContact CG-CG2 3.25Å
675	N	91.7	Very high	90.4	Very high	31 Å²	31	24.5 Å²	24.5	17%	0.166	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-44.2	173.9	-70.4	-32.5	0	0	0	110.6	D672 S677 A678 Q679 Q759 L761	D672-N675 WeakPolarHBondContact O-CA 3.46Å; D672-N675 VanDerWaalsContact O-CB 3.29Å; D672-N675 WeakPolarHBondContact O-CB 3.39Å; D672-N675 PolarHBondContact O-N 2.86Å; D672-N675 PolarHBondContact OD1-ND2 3.16Å; N675-S677 VanDerWaalsContact C-N 3.33Å; N675-S677 PolarHBondContact O-N 3.02Å; N675-A678 PolarHBondContact O-N 3.13Å; N675-Q679 VanDerWaalsContact O-CB 3.29Å; N675-Q679 WeakPolarHBondContact O-CB 3.29Å; N675-Q679 PolarHBondContact O-N 3.45Å; N675-Q759 PolarHBondContact ND2-O 3.33Å; N675-Q759 VanDerWaalsContact ND2-O 3.16Å; N675-L761 PolarHBondContact OD1-N 2.68Å
676	D	89.7	Confident	90.9	Very high	18 Å²	18	30.1 Å²	30.1	10%	0.096	15%	0.151	C	C	.	.	H	α-helix	trans	-57.8	-47.8	175.2	-65.7	-11.8	0	0	0	111.3	K463 L621 S622 D672 Q679 C680	K463-D676 WeakPolarHBondContact CE-OD2 3.11Å; K463-D676 IonicContact NZ-OD1 3.45Å; K463-D676 PolarHBondContact NZ-OD1 3.44Å; K463-D676 IonicContact NZ-OD2 3.67Å; K463-D676 PolarHBondContact NZ-OD2 2.87Å; L621-D676 PolarHBondContact N-OD2 3.3Å; S622-D676 WeakPolarHBondContact CB-O 3.3Å; D672-D676 PolarHBondContact O-N 3.29Å; D676-Q679 PolarHBondContact O-N 2.88Å; D676-C680 VanDerWaalsContact O-CB 3.28Å; D676-C680 WeakPolarHBondContact O-CB 3.25Å; D676-C680 PolarHBondContact O-N 3.15Å
677	S	93.6	Very high	91.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65	-43.7	-178.2	-54.2	0	0	0	0	111.6	S622 W625 F626 L673 Y674 N675 C680 A681	S622-S677 PolarHBondContact O-OG 3.2Å; W625-S677 WeakPolarHBondContact CB-OG 3.42Å; F626-S677 WeakPolarHBondContact CZ-O 3.44Å; L673-S677 PolarHBondContact O-N 3.29Å; L673-S677 VanDerWaalsContact O-N 3.16Å; L673-S677 PolarHBondContact O-OG 3.32Å; Y674-S677 PolarHBondContact O-N 3.34Å; N675-S677 VanDerWaalsContact C-N 3.33Å; N675-S677 PolarHBondContact O-N 3.02Å; S677-C680 PolarHBondContact O-N 2.91Å; S677-A681 WeakPolarHBondContact O-CB 3.41Å; S677-A681 PolarHBondContact O-N 3.2Å
678	A	93.2	Very high	91.6	Very high	5 Å²	5	38 Å²	38	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-65.2	-44.4	176.6	0	0	0	0	0	112.4	Y674 N675 C680 A681 L682 Y691 V694 L761	Y674-A678 VanDerWaalsContact O-CB 3.24Å; Y674-A678 WeakPolarHBondContact O-CB 3.37Å; Y674-A678 PolarHBondContact O-N 3.33Å; N675-A678 PolarHBondContact O-N 3.13Å; A678-C680 VanDerWaalsContact C-N 3.32Å; A678-C680 PolarHBondContact O-N 2.76Å; A678-A681 PolarHBondContact O-N 2.84Å; A678-L682 WeakPolarHBondContact O-CG 3.48Å; A678-L682 PolarHBondContact O-N 3.4Å; A678-Y691 HydrophobicContact CB-CD2 3.86Å; A678-Y691 HydrophobicContact CB-CE2 3.86Å; A678-V694 HydrophobicContact CB-CG1 4.03Å; A678-L761 HydrophobicContact CB-CD2 3.39Å
679	Q	88.8	Confident	91.8	Very high	69 Å²	69	41 Å²	41	32%	0.322	20%	0.198	S	C	.	.	H	α-helix	trans	-60.9	-44.5	176.1	178.6	174.3	-15.2	0	0	110.9	N675 D676 A681 L682 V683	N675-Q679 VanDerWaalsContact O-CB 3.29Å; N675-Q679 WeakPolarHBondContact O-CB 3.29Å; N675-Q679 PolarHBondContact O-N 3.45Å; D676-Q679 PolarHBondContact O-N 2.88Å; Q679-A681 PolarHBondContact O-N 3.31Å; Q679-L682 PolarHBondContact O-N 3.01Å; Q679-V683 HydrophobicContact CG-CG2 4.21Å; Q679-V683 WeakPolarHBondContact O-CB 3.48Å; Q679-V683 WeakPolarHBondContact O-CG2 3.18Å; Q679-V683 PolarHBondContact O-N 3.1Å
680	C	89.7	Confident	92.2	Very high	9 Å²	9	39.6 Å²	39.6	6%	0.061	19%	0.192	C	C	.	.	I	π-helix	trans	-62	-43	176.2	-170.8	0	0	0	0	111.4	F626 D676 S677 A678 L682 K684 F685	F626-C680 HydrophobicContact CE2-CB 3.82Å; F626-C680 HydrophobicContact CZ-CB 3.91Å; D676-C680 VanDerWaalsContact O-CB 3.28Å; D676-C680 WeakPolarHBondContact O-CB 3.25Å; D676-C680 PolarHBondContact O-N 3.15Å; S677-C680 PolarHBondContact O-N 2.91Å; A678-C680 VanDerWaalsContact C-N 3.32Å; A678-C680 PolarHBondContact O-N 2.76Å; C680-L682 PolarHBondContact O-N 3.23Å; C680-K684 WeakPolarHBondContact O-CA 3.28Å; C680-K684 WeakPolarHBondContact O-CB 3.47Å; C680-K684 PolarHBondContact O-N 3.03Å; C680-F685 PolarHBondContact O-N 3.42Å
681	A	93.5	Very high	92.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	I	π-helix	trans	-60.3	-42.4	176.6	0	0	0	0	0	112.9	F626 S677 A678 Q679 K686 K687 L690	F626-A681 HydrophobicContact CE1-CB 4.44Å; F626-A681 HydrophobicContact CZ-CB 4.4Å; S677-A681 WeakPolarHBondContact O-CB 3.41Å; S677-A681 PolarHBondContact O-N 3.2Å; A678-A681 PolarHBondContact O-N 2.84Å; Q679-A681 PolarHBondContact O-N 3.31Å; A681-K686 WeakPolarHBondContact O-CA 3.39Å; A681-K686 PolarHBondContact O-N 2.95Å; A681-K687 PolarHBondContact O-N 3.25Å; A681-K687 VanDerWaalsContact O-N 3.07Å; A681-L690 HydrophobicContact CB-CB 3.85Å
682	L	91.5	Very high	92.8	Very high	88 Å²	88	44.6 Å²	44.6	46%	0.461	22%	0.216	S	C	.	.	I	π-helix	trans	-79.6	-46.4	-177.3	-68.4	174.5	0	0	0	113.3	A678 Q679 C680 K686 Y691	A678-L682 WeakPolarHBondContact O-CG 3.48Å; A678-L682 PolarHBondContact O-N 3.4Å; Q679-L682 PolarHBondContact O-N 3.01Å; C680-L682 PolarHBondContact O-N 3.23Å; L682-K686 WeakPolarHBondContact O-CA 3.16Å; L682-Y691 HydrophobicContact CD1-CD2 3.63Å; L682-Y691 HydrophobicContact CD1-CE2 3.74Å; L682-Y691 HydrophobicContact CD1-CG 4.37Å; L682-Y691 HydrophobicContact CD2-CD2 3.94Å; L682-Y691 HydrophobicContact CD2-CG 3.87Å; L682-Y691 HydrophobicContact CG-CD2 3.69Å; L682-Y691 HydrophobicContact CG-CE2 4.32Å; L682-Y691 HydrophobicContact CG-CG 4.13Å
683	V	87.7	Confident	93.1	Very high	96 Å²	96	46 Å²	46	58%	0.582	22%	0.223	S	C	*	.	I	π-helix	trans	-92.1	-46.2	-169.8	-177.6	0	0	0	0	111.7	Q679 K686	Q679-V683 HydrophobicContact CG-CG2 4.21Å; Q679-V683 WeakPolarHBondContact O-CB 3.48Å; Q679-V683 WeakPolarHBondContact O-CG2 3.18Å; Q679-V683 PolarHBondContact O-N 3.1Å; V683-K686 WeakPolarHBondContact O-CE 3.46Å; V683-K686 WeakPolarHBondContact O-CG 3.35Å
684	K	86.9	Confident	93.4	Very high	85 Å²	85	46 Å²	46	37%	0.37	22%	0.222	S	C	.	.	I	π-helix	trans	-87.5	-54.7	-175.3	-171	174.3	-176.3	174.1	0	111.7	E78 C680	E78-K684 VanDerWaalsContact OE1-CE 3.26Å; E78-K684 WeakPolarHBondContact OE1-CE 3.33Å; C680-K684 WeakPolarHBondContact O-CA 3.28Å; C680-K684 WeakPolarHBondContact O-CB 3.47Å; C680-K684 PolarHBondContact O-N 3.03Å
685	F	92.7	Very high	93.5	Very high	3 Å²	3	48.3 Å²	48.3	1%	0.013	23%	0.233	C	C	.	.	I	π-helix	trans	-79.1	-29.7	-179.2	-65.6	-28.6	0	0	0	113.6	V82 Y85 T86 F321 F626 C680 K687 L690	V82-F685 HydrophobicContact CB-CD1 4.39Å; V82-F685 HydrophobicContact CG1-CB 4.1Å; V82-F685 HydrophobicContact CG1-CD1 3.89Å; V82-F685 HydrophobicContact CG1-CG 4.41Å; V82-F685 VanDerWaalsContact CG1-O 3.26Å; V82-F685 WeakPolarHBondContact CG1-O 3.32Å; V82-F685 HydrophobicContact CG2-CD1 3.83Å; V82-F685 HydrophobicContact CG2-CE1 4.3Å; Y85-F685 HydrophobicContact CD1-CE1 4.41Å; Y85-F685 HydrophobicContact CD1-CE2 4.48Å; Y85-F685 HydrophobicContact CD1-CZ 4.07Å; Y85-F685 HydrophobicContact CE1-CE2 4.15Å; Y85-F685 AromaticContact CE1-CZ 3.96Å; Y85-F685 HydrophobicContact CE1-CZ 3.96Å; T86-F685 HydrophobicContact CG2-CB 4.43Å; T86-F685 HydrophobicContact CG2-CG 4.32Å; F321-F685 AromaticContact CE1-CE1 3.88Å; F321-F685 HydrophobicContact CE1-CE1 3.88Å; F321-F685 HydrophobicContact CE1-CZ 4.4Å; F321-F685 HydrophobicContact CZ-CE1 4.01Å; F626-F685 HydrophobicContact CD1-CD2 4.32Å; F626-F685 AromaticContact CD1-CE2 3.77Å; F626-F685 HydrophobicContact CD1-CE2 3.77Å; F626-F685 AromaticContact CD2-CE2 3.82Å; F626-F685 HydrophobicContact CD2-CE2 3.82Å; F626-F685 HydrophobicContact CD2-CZ 4.47Å; F626-F685 AromaticContact CE1-CD2 3.74Å; F626-F685 HydrophobicContact CE1-CD2 3.74Å; F626-F685 AromaticContact CE1-CE2 3.56Å; F626-F685 HydrophobicContact CE1-CE2 3.56Å; F626-F685 HydrophobicContact CE2-CD2 4.27Å; F626-F685 AromaticContact CE2-CE2 3.6Å; F626-F685 HydrophobicContact CE2-CE2 3.6Å; F626-F685 HydrophobicContact CE2-CZ 4.43Å; F626-F685 AromaticContact CG-CE2 3.91Å; F626-F685 HydrophobicContact CG-CE2 3.91Å; F626-F685 AromaticContact CZ-CD2 3.71Å; F626-F685 HydrophobicContact CZ-CD2 3.71Å; F626-F685 AromaticContact CZ-CE2 3.47Å; F626-F685 HydrophobicContact CZ-CE2 3.47Å; F626-F685 VanDerWaalsContact CZ-CE2 3.47Å; C680-F685 PolarHBondContact O-N 3.42Å; F685-K687 VanDerWaalsContact C-N 3.28Å; F685-K687 HydrophobicContact CB-CG 4.26Å; F685-K687 PolarHBondContact O-N 3.48Å; F685-L690 HydrophobicContact CB-CD1 4.18Å; F685-L690 HydrophobicContact CD2-CD1 3.63Å; F685-L690 HydrophobicContact CE2-CD1 4.4Å; F685-L690 HydrophobicContact CG-CD1 4.26Å
686	K	94.8	Very high	93.7	Very high	159 Å²	159	49.7 Å²	49.7	69%	0.691	25%	0.249	S	C	*	.			trans	53.2	48.1	-177.9	-56.7	-179.9	178.4	-178.1	0	111	A681 L682 V683	A681-K686 WeakPolarHBondContact O-CA 3.39Å; A681-K686 PolarHBondContact O-N 2.95Å; L682-K686 WeakPolarHBondContact O-CA 3.16Å; V683-K686 WeakPolarHBondContact O-CE 3.46Å; V683-K686 WeakPolarHBondContact O-CG 3.35Å
687	K	94.8	Very high	94.1	Very high	43 Å²	43	49.5 Å²	49.5	19%	0.187	25%	0.247	C	C	.	.			trans	-124.3	119.5	179.2	-61.1	-57.8	177.5	-122.5	0	110.3	N83 T86 A681 F685 F689 L690	N83-K687 PolarHBondContact OD1-NZ 2.72Å; T86-K687 HydrophobicContact CG2-CG 3.99Å; T86-K687 WeakPolarHBondContact OG1-CE 3.21Å; A681-K687 PolarHBondContact O-N 3.25Å; A681-K687 VanDerWaalsContact O-N 3.07Å; F685-K687 VanDerWaalsContact C-N 3.28Å; F685-K687 HydrophobicContact CB-CG 4.26Å; F685-K687 PolarHBondContact O-N 3.48Å; K687-F689 HydrophobicContact CB-CD1 4.09Å; K687-F689 HydrophobicContact CB-CE1 3.86Å; K687-F689 HydrophobicContact CD-CE1 4.18Å; K687-F689 HydrophobicContact CG-CE1 4.04Å; K687-L690 HydrophobicContact CB-CB 4.29Å; K687-L690 HydrophobicContact CB-CD1 3.98Å; K687-L690 HydrophobicContact CB-CG 4.06Å; K687-L690 HydrophobicContact CG-CD1 4.29Å
688	Q	95.7	Very high	94.2	Very high	147 Å²	147	49.9 Å²	49.9	69%	0.687	25%	0.25	S	C	*	.	H	α-helix	trans	-64.4	-49.3	178.8	-172.2	-178.1	-11	0	0	111.7	L690 Y691 D692	Q688-L690 PolarHBondContact O-N 3.37Å; Q688-L690 VanDerWaalsContact O-N 3.08Å; Q688-Y691 CarbonylContact O-C 3.59Å; Q688-Y691 WeakPolarHBondContact O-CA 3.46Å; Q688-Y691 WeakPolarHBondContact O-CB 3.47Å; Q688-Y691 PolarHBondContact O-N 2.91Å; Q688-D692 VanDerWaalsContact O-CG 3.29Å; Q688-D692 PolarHBondContact O-N 2.89Å
689	F	96.4	Very high	94.3	Very high	62 Å²	62	53.7 Å²	53.7	27%	0.272	27%	0.27	S	S	.	.	H	α-helix	trans	-58	-31.1	-176.5	77.5	-93.4	0	0	0	113.7	T86 R88 K687 D692 E693	T86-F689 WeakPolarHBondContact O-CZ 3.46Å; R88-F689 HydrophobicContact CG-CE2 4.48Å; K687-F689 HydrophobicContact CB-CD1 4.09Å; K687-F689 HydrophobicContact CB-CE1 3.86Å; K687-F689 HydrophobicContact CD-CE1 4.18Å; K687-F689 HydrophobicContact CG-CE1 4.04Å; F689-D692 PolarHBondContact O-N 2.94Å; F689-E693 WeakPolarHBondContact O-CB 3.41Å; F689-E693 VanDerWaalsContact O-CG 3.27Å; F689-E693 WeakPolarHBondContact O-CG 3.43Å; F689-E693 PolarHBondContact O-N 3.28Å
690	L	96.7	Very high	94.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.3	-41.7	174.5	-70.9	-179.7	0	0	0	111.3	T86 W625 F626 A681 F685 K687 Q688 E693 V694	T86-L690 HydrophobicContact CG2-CD1 3.71Å; W625-L690 HydrophobicContact CZ3-CD2 4.4Å; F626-L690 HydrophobicContact CE1-CD1 4.16Å; A681-L690 HydrophobicContact CB-CB 3.85Å; F685-L690 HydrophobicContact CB-CD1 4.18Å; F685-L690 HydrophobicContact CD2-CD1 3.63Å; F685-L690 HydrophobicContact CE2-CD1 4.4Å; F685-L690 HydrophobicContact CG-CD1 4.26Å; K687-L690 HydrophobicContact CB-CB 4.29Å; K687-L690 HydrophobicContact CB-CD1 3.98Å; K687-L690 HydrophobicContact CB-CG 4.06Å; K687-L690 HydrophobicContact CG-CD1 4.29Å; Q688-L690 PolarHBondContact O-N 3.37Å; Q688-L690 VanDerWaalsContact O-N 3.08Å; L690-E693 PolarHBondContact O-N 3.06Å; L690-V694 VanDerWaalsContact O-CG2 3.31Å; L690-V694 WeakPolarHBondContact O-CG2 3.4Å; L690-V694 PolarHBondContact O-N 3.45Å
691	Y	96.8	Very high	94.9	Very high	41 Å²	41	54.2 Å²	54.2	16%	0.161	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-43.7	173.7	179	-92.6	0	0	0	111.2	A678 L682 Q688 E693 V694 E695 R763	A678-Y691 HydrophobicContact CB-CD2 3.86Å; A678-Y691 HydrophobicContact CB-CE2 3.86Å; L682-Y691 HydrophobicContact CD1-CD2 3.63Å; L682-Y691 HydrophobicContact CD1-CE2 3.74Å; L682-Y691 HydrophobicContact CD1-CG 4.37Å; L682-Y691 HydrophobicContact CD2-CD2 3.94Å; L682-Y691 HydrophobicContact CD2-CG 3.87Å; L682-Y691 HydrophobicContact CG-CD2 3.69Å; L682-Y691 HydrophobicContact CG-CE2 4.32Å; L682-Y691 HydrophobicContact CG-CG 4.13Å; Q688-Y691 CarbonylContact O-C 3.59Å; Q688-Y691 WeakPolarHBondContact O-CA 3.46Å; Q688-Y691 WeakPolarHBondContact O-CB 3.47Å; Q688-Y691 PolarHBondContact O-N 2.91Å; Y691-E693 PolarHBondContact O-N 3.1Å; Y691-V694 PolarHBondContact O-N 3.17Å; Y691-E695 HydrophobicContact CE1-CB 4.26Å; Y691-E695 VanDerWaalsContact O-CB 3.29Å; Y691-E695 WeakPolarHBondContact O-CB 3.31Å; Y691-E695 PolarHBondContact O-N 3.18Å; Y691-R763 PolarHBondContact OH-NH1 2.95Å
692	D	97.6	Very high	95	Very high	68 Å²	68	55.1 Å²	55.1	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-57.5	-39.2	178.2	-58.5	-21.3	0	0	0	111	Q688 F689 A696	Q688-D692 VanDerWaalsContact O-CG 3.29Å; Q688-D692 PolarHBondContact O-N 2.89Å; F689-D692 PolarHBondContact O-N 2.94Å; D692-A696 VanDerWaalsContact O-CB 3.28Å; D692-A696 WeakPolarHBondContact O-CB 3.41Å; D692-A696 PolarHBondContact O-N 2.8Å
693	E	97.6	Very high	95.2	Very high	40 Å²	40	55.6 Å²	55.6	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-73.1	-40.8	176.6	-74.2	173.4	-167.9	0	0	113.4	R88 W625 Q640 F689 L690 Y691 E695 A696 E697	R88-E693 IonicContact CZ-OE1 3.48Å; R88-E693 VanDerWaalsContact CZ-OE1 3.25Å; R88-E693 IonicContact CZ-OE2 3.77Å; R88-E693 IonicContact NH1-OE1 3.14Å; R88-E693 PolarHBondContact NH1-OE1 3.29Å; R88-E693 IonicContact NH1-OE2 3.75Å; R88-E693 IonicContact NH2-OE1 2.95Å; R88-E693 PolarHBondContact NH2-OE1 3.3Å; R88-E693 VanDerWaalsContact NH2-OE1 3.17Å; R88-E693 IonicContact NH2-OE2 3.51Å; R88-E693 PolarHBondContact NH2-OE2 3.13Å; W625-E693 HydrophobicContact CH2-CB 3.79Å; W625-E693 HydrophobicContact CZ2-CB 4.08Å; Q640-E693 PolarHBondContact NE2-OE2 3.14Å; F689-E693 WeakPolarHBondContact O-CB 3.41Å; F689-E693 VanDerWaalsContact O-CG 3.27Å; F689-E693 WeakPolarHBondContact O-CG 3.43Å; F689-E693 PolarHBondContact O-N 3.28Å; L690-E693 PolarHBondContact O-N 3.06Å; Y691-E693 PolarHBondContact O-N 3.1Å; E693-E695 VanDerWaalsContact C-N 3.29Å; E693-E695 PolarHBondContact O-N 3.4Å; E693-A696 PolarHBondContact O-N 3.33Å; E693-E697 WeakPolarHBondContact O-CB 3.48Å; E693-E697 PolarHBondContact O-N 2.96Å
694	V	97	Very high	95.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-45.2	171.9	170.5	0	0	0	0	110	W625 Y674 A678 L690 Y691 E697 V698 L761	W625-V694 HydrophobicContact CD2-CG2 3.69Å; W625-V694 HydrophobicContact CE3-CG2 3.6Å; W625-V694 HydrophobicContact CH2-CG2 3.53Å; W625-V694 HydrophobicContact CZ2-CB 4.31Å; W625-V694 HydrophobicContact CZ2-CG2 3.6Å; W625-V694 HydrophobicContact CZ3-CG2 3.52Å; Y674-V694 HydrophobicContact CD1-CG1 4.19Å; A678-V694 HydrophobicContact CB-CG1 4.03Å; L690-V694 VanDerWaalsContact O-CG2 3.31Å; L690-V694 WeakPolarHBondContact O-CG2 3.4Å; L690-V694 PolarHBondContact O-N 3.45Å; Y691-V694 PolarHBondContact O-N 3.17Å; V694-E697 PolarHBondContact O-N 3.32Å; V694-V698 HydrophobicContact CG1-CG2 4.49Å; V694-V698 WeakPolarHBondContact O-CB 3.45Å; V694-V698 WeakPolarHBondContact O-CG2 3.31Å; V694-V698 PolarHBondContact O-N 2.88Å; V694-L761 HydrophobicContact CG1-CD1 4.46Å; V694-L761 HydrophobicContact CG1-CD2 4.13Å
695	E	96.4	Very high	95.9	Very high	50 Å²	50	50.2 Å²	50.2	23%	0.234	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-46	179.4	-178.7	176.7	-103.9	0	0	112.1	Y691 E693 E697 V698 N699 L761 R763	Y691-E695 HydrophobicContact CE1-CB 4.26Å; Y691-E695 VanDerWaalsContact O-CB 3.29Å; Y691-E695 WeakPolarHBondContact O-CB 3.31Å; Y691-E695 PolarHBondContact O-N 3.18Å; E693-E695 VanDerWaalsContact C-N 3.29Å; E693-E695 PolarHBondContact O-N 3.4Å; E695-E697 VanDerWaalsContact C-N 3.31Å; E695-E697 PolarHBondContact O-N 2.83Å; E695-V698 PolarHBondContact O-N 2.9Å; E695-N699 VanDerWaalsContact O-CG 3.27Å; E695-N699 PolarHBondContact O-N 3.13Å; E695-N699 PolarHBondContact O-ND2 2.84Å; E695-L761 HydrophobicContact CB-CD1 4.11Å; E695-L761 HydrophobicContact CG-CD1 4.33Å; E695-R763 IonicContact OE1-CZ 3.47Å; E695-R763 VanDerWaalsContact OE1-CZ 3.26Å; E695-R763 IonicContact OE1-NH1 2.62Å; E695-R763 PolarHBondContact OE1-NH1 2.87Å; E695-R763 IonicContact OE1-NH2 3.36Å; E695-R763 PolarHBondContact OE1-NH2 3.15Å
696	A	97.1	Very high	96.1	Very high	60 Å²	60	50.2 Å²	50.2	50%	0.496	25%	0.25	S	S	.	.	H	α-helix	trans	-60.9	-41.2	175.8	0	0	0	0	0	111.8	D692 E693 N699 L700	D692-A696 VanDerWaalsContact O-CB 3.28Å; D692-A696 WeakPolarHBondContact O-CB 3.41Å; D692-A696 PolarHBondContact O-N 2.8Å; E693-A696 PolarHBondContact O-N 3.33Å; A696-N699 PolarHBondContact O-N 3.49Å; A696-L700 PolarHBondContact O-N 2.88Å
697	E	97.6	Very high	96.1	Very high	14 Å²	14	44.5 Å²	44.5	7%	0.065	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-43.6	176	-170.5	175.5	132	0	0	111.8	W625 R627 I643 S646 Y674 E693 V694 E695 N699 L700 G701	W625-E697 PolarHBondContact NE1-OE1 2.71Å; W625-E697 PolarHBondContact NE1-OE2 3.47Å; R627-E697 IonicContact CZ-OE2 2.92Å; R627-E697 IonicContact NH1-OE2 3.65Å; R627-E697 IonicContact NH2-OE2 2.79Å; R627-E697 PolarHBondContact NH2-OE2 3.1Å; I643-E697 HydrophobicContact CG2-CG 3.75Å; S646-E697 WeakPolarHBondContact CB-OE1 3.35Å; S646-E697 PolarHBondContact OG-OE1 2.99Å; Y674-E697 HydrophobicContact CE1-CB 4.45Å; Y674-E697 HydrophobicContact CE1-CG 4.06Å; Y674-E697 WeakPolarHBondContact CE1-OE1 3.47Å; Y674-E697 PolarHBondContact OH-OE1 2.69Å; E693-E697 WeakPolarHBondContact O-CB 3.48Å; E693-E697 PolarHBondContact O-N 2.96Å; V694-E697 PolarHBondContact O-N 3.32Å; E695-E697 VanDerWaalsContact C-N 3.31Å; E695-E697 PolarHBondContact O-N 2.83Å; E697-N699 PolarHBondContact O-N 3.08Å; E697-L700 PolarHBondContact O-N 3.02Å; E697-G701 PolarHBondContact O-N 3.47Å
698	V	96.2	Very high	96.1	Very high	8 Å²	8	45 Å²	45	5%	0.048	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-43.5	175.1	163.7	0	0	0	0	111.4	Y674 V694 E695 L700 G701 F702 L760 L761	Y674-V698 VanDerWaalsContact CB-CG2 3.43Å; Y674-V698 HydrophobicContact CD1-CG2 3.56Å; Y674-V698 HydrophobicContact CD2-CG2 3.6Å; Y674-V698 HydrophobicContact CE1-CG2 4.13Å; Y674-V698 HydrophobicContact CE2-CG2 4.17Å; Y674-V698 HydrophobicContact CG-CG2 3.25Å; V694-V698 HydrophobicContact CG1-CG2 4.49Å; V694-V698 WeakPolarHBondContact O-CB 3.45Å; V694-V698 WeakPolarHBondContact O-CG2 3.31Å; V694-V698 PolarHBondContact O-N 2.88Å; E695-V698 PolarHBondContact O-N 2.9Å; V698-L700 VanDerWaalsContact C-N 3.34Å; V698-L700 PolarHBondContact O-N 3.04Å; V698-G701 PolarHBondContact O-N 3.38Å; V698-F702 WeakPolarHBondContact O-CA 3.43Å; V698-F702 WeakPolarHBondContact O-CB 3.3Å; V698-F702 PolarHBondContact O-N 3.38Å; V698-L760 HydrophobicContact CG1-CD2 3.54Å; V698-L760 HydrophobicContact CG1-CG 4.04Å; V698-L761 HydrophobicContact CB-CD1 3.66Å; V698-L761 HydrophobicContact CB-CG 4.44Å; V698-L761 HydrophobicContact CG1-CD1 3.79Å; V698-L761 HydrophobicContact CG1-CG 4.23Å; V698-L761 HydrophobicContact CG2-CD1 3.7Å; V698-L761 HydrophobicContact CG2-CG 4.15Å
699	N	95.8	Very high	96	Very high	86 Å²	86	38 Å²	38	46%	0.46	20%	0.2	S	C	.	.	H	α-helix	trans	-58.6	-47.6	179	-73.6	-26.5	0	0	0	111	E695 A696 E697 D703	E695-N699 VanDerWaalsContact O-CG 3.27Å; E695-N699 PolarHBondContact O-N 3.13Å; E695-N699 PolarHBondContact O-ND2 2.84Å; A696-N699 PolarHBondContact O-N 3.49Å; E697-N699 PolarHBondContact O-N 3.08Å; N699-D703 WeakPolarHBondContact O-CB 3.42Å; N699-D703 PolarHBondContact O-N 3.48Å; N699-D703 VanDerWaalsContact O-N 3.14Å
700	L	95.8	Very high	96	Very high	88 Å²	88	35.3 Å²	35.3	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-66.8	-48.8	177.2	178.7	60.9	0	0	0	112.4	I643 A696 E697 V698 D703 Q704	I643-L700 HydrophobicContact CD1-CD2 4.11Å; I643-L700 HydrophobicContact CD1-CG 4.21Å; I643-L700 HydrophobicContact CG2-CD2 3.93Å; A696-L700 PolarHBondContact O-N 2.88Å; E697-L700 PolarHBondContact O-N 3.02Å; V698-L700 VanDerWaalsContact C-N 3.34Å; V698-L700 PolarHBondContact O-N 3.04Å; L700-D703 PolarHBondContact O-N 3.37Å; L700-Q704 WeakPolarHBondContact O-CG 3.47Å; L700-Q704 PolarHBondContact O-N 3.49Å; L700-Q704 VanDerWaalsContact O-N 3.09Å
701	G	94.4	Very high	95.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-40.9	-178.1	0	0	0	0	0	112.1	W649 E697 V698 Q704 F705	W649-G701 WeakPolarHBondContact CH2-O 3.44Å; W649-G701 WeakPolarHBondContact CZ3-O 3.3Å; E697-G701 PolarHBondContact O-N 3.47Å; V698-G701 PolarHBondContact O-N 3.38Å; G701-Q704 PolarHBondContact O-N 3.43Å; G701-F705 WeakPolarHBondContact O-CB 3.41Å; G701-F705 PolarHBondContact O-N 2.91Å
702	F	95.5	Very high	95.7	Very high	19 Å²	19	40.7 Å²	40.7	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-69.6	-39.8	178.6	-167.2	-100.4	0	0	0	112	L671 V698 Q704 F705 V706 F758 L760 I765 L767 L770	L671-F702 HydrophobicContact CD1-CD2 4.3Å; L671-F702 HydrophobicContact CD1-CE2 4.48Å; V698-F702 WeakPolarHBondContact O-CA 3.43Å; V698-F702 WeakPolarHBondContact O-CB 3.3Å; V698-F702 PolarHBondContact O-N 3.38Å; F702-Q704 VanDerWaalsContact C-N 3.31Å; F702-Q704 PolarHBondContact O-N 3.33Å; F702-F705 HydrophobicContact CD2-CD1 4.23Å; F702-F705 HydrophobicContact CE2-CD1 4.05Å; F702-F705 HydrophobicContact CE2-CE1 4.4Å; F702-F705 WeakPolarHBondContact O-CB 3.26Å; F702-F705 PolarHBondContact O-N 3.28Å; F702-F705 VanDerWaalsContact O-N 3.17Å; F702-V706 HydrophobicContact CD1-CG2 3.94Å; F702-V706 HydrophobicContact CE1-CG2 3.54Å; F702-V706 HydrophobicContact CE2-CG2 4.43Å; F702-V706 HydrophobicContact CZ-CG2 3.81Å; F702-V706 WeakPolarHBondContact O-CG2 3.29Å; F702-V706 PolarHBondContact O-N 3.46Å; F702-F758 HydrophobicContact CE2-CD1 4.09Å; F702-F758 AromaticContact CE2-CE1 3.94Å; F702-F758 HydrophobicContact CE2-CE1 3.94Å; F702-L760 HydrophobicContact CD2-CD2 3.86Å; F702-L760 HydrophobicContact CE2-CD2 4.38Å; F702-L760 HydrophobicContact CG-CD2 4.4Å; F702-I765 HydrophobicContact CE1-CD1 4.05Å; F702-I765 HydrophobicContact CE1-CG2 3.86Å; F702-I765 HydrophobicContact CE2-CD1 4.28Å; F702-I765 HydrophobicContact CZ-CD1 3.93Å; F702-I765 HydrophobicContact CZ-CG2 3.71Å; F702-L767 HydrophobicContact CZ-CD1 4.41Å; F702-L770 HydrophobicContact CE1-CD1 3.77Å; F702-L770 HydrophobicContact CZ-CD1 4.33Å
703	D	95	Very high	95.5	Very high	98 Å²	98	37.4 Å²	37.4	52%	0.524	20%	0.196	S	C	.	.	H	α-helix	trans	-60.1	-42.6	172.8	-88.4	-16.8	0	0	0	112	N699 L700 C707	N699-D703 WeakPolarHBondContact O-CB 3.42Å; N699-D703 PolarHBondContact O-N 3.48Å; N699-D703 VanDerWaalsContact O-N 3.14Å; L700-D703 PolarHBondContact O-N 3.37Å; D703-C707 VanDerWaalsContact O-CB 3.24Å; D703-C707 WeakPolarHBondContact O-CB 3.4Å; D703-C707 PolarHBondContact O-N 3.31Å
704	Q	95	Very high	95.5	Very high	68 Å²	68	35.7 Å²	35.7	32%	0.318	19%	0.188	S	C	.	.	H	α-helix	trans	-65.6	-41.1	173.8	-70.9	-169.3	26.3	0	0	111.9	W649 L700 G701 F702 C707 K708	W649-Q704 HydrophobicContact CH2-CB 3.57Å; W649-Q704 HydrophobicContact CZ2-CB 3.78Å; W649-Q704 VanDerWaalsContact CZ2-OE1 3.28Å; L700-Q704 WeakPolarHBondContact O-CG 3.47Å; L700-Q704 PolarHBondContact O-N 3.49Å; L700-Q704 VanDerWaalsContact O-N 3.09Å; G701-Q704 PolarHBondContact O-N 3.43Å; F702-Q704 VanDerWaalsContact C-N 3.31Å; F702-Q704 PolarHBondContact O-N 3.33Å; Q704-C707 PolarHBondContact O-N 2.9Å; Q704-K708 WeakPolarHBondContact O-CB 3.45Å; Q704-K708 WeakPolarHBondContact O-CG 3.43Å; Q704-K708 PolarHBondContact O-N 2.93Å
705	F	95.6	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.5	-53.3	176.4	170.9	-95.7	0	0	0	111	W649 T652 L656 A667 L668 L671 G701 F702 C707 K708 L709 L767	W649-F705 HydrophobicContact CH2-CB 4.5Å; W649-F705 HydrophobicContact CZ3-CB 4.25Å; T652-F705 HydrophobicContact CG2-CD2 3.87Å; T652-F705 HydrophobicContact CG2-CE2 4.44Å; L656-F705 HydrophobicContact CD1-CD2 3.89Å; L656-F705 HydrophobicContact CD2-CD2 4.01Å; L656-F705 HydrophobicContact CD2-CE2 3.98Å; L656-F705 HydrophobicContact CG-CD2 4.27Å; A667-F705 HydrophobicContact CB-CE2 3.89Å; A667-F705 HydrophobicContact CB-CZ 4.47Å; L668-F705 HydrophobicContact CD2-CE1 4.23Å; L668-F705 HydrophobicContact CD2-CZ 3.88Å; L671-F705 HydrophobicContact CD1-CD1 4.07Å; L671-F705 HydrophobicContact CD1-CD2 3.88Å; L671-F705 HydrophobicContact CD1-CE1 4.13Å; L671-F705 HydrophobicContact CD1-CE2 3.97Å; L671-F705 HydrophobicContact CD1-CG 3.95Å; L671-F705 HydrophobicContact CD1-CZ 4.08Å; G701-F705 WeakPolarHBondContact O-CB 3.41Å; G701-F705 PolarHBondContact O-N 2.91Å; F702-F705 HydrophobicContact CD2-CD1 4.23Å; F702-F705 HydrophobicContact CE2-CD1 4.05Å; F702-F705 HydrophobicContact CE2-CE1 4.4Å; F702-F705 WeakPolarHBondContact O-CB 3.26Å; F702-F705 PolarHBondContact O-N 3.28Å; F702-F705 VanDerWaalsContact O-N 3.17Å; F705-C707 VanDerWaalsContact C-N 3.31Å; F705-C707 PolarHBondContact O-N 3.17Å; F705-K708 PolarHBondContact O-N 3.4Å; F705-L709 HydrophobicContact CE1-CD2 3.81Å; F705-L709 HydrophobicContact CE2-CD2 4.45Å; F705-L709 HydrophobicContact CZ-CD2 3.69Å; F705-L709 WeakPolarHBondContact O-CB 3.49Å; F705-L709 PolarHBondContact O-N 2.94Å; F705-L767 HydrophobicContact CE1-CD1 4.15Å; F705-L767 HydrophobicContact CE1-CD2 4.24Å
706	V	96.1	Very high	95.2	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-38.7	179.7	-179.5	0	0	0	0	110.7	F702 S710 L767 L770	F702-V706 HydrophobicContact CD1-CG2 3.94Å; F702-V706 HydrophobicContact CE1-CG2 3.54Å; F702-V706 HydrophobicContact CE2-CG2 4.43Å; F702-V706 HydrophobicContact CZ-CG2 3.81Å; F702-V706 WeakPolarHBondContact O-CG2 3.29Å; F702-V706 PolarHBondContact O-N 3.46Å; V706-S710 VanDerWaalsContact O-CB 3.25Å; V706-S710 WeakPolarHBondContact O-CB 3.25Å; V706-S710 PolarHBondContact O-N 3.38Å; V706-S710 PolarHBondContact O-OG 3.29Å; V706-L767 HydrophobicContact CG2-CD1 4.04Å; V706-L770 HydrophobicContact CG1-CB 3.98Å; V706-L770 HydrophobicContact CG2-CD1 4.28Å
707	C	94.8	Very high	95.1	Very high	40 Å²	40	32.4 Å²	32.4	27%	0.27	17%	0.166	S	C	.	.	H	α-helix	trans	-62.1	-53.9	176.3	-169.3	0	0	0	0	112.5	D703 Q704 F705 S710 H711 R774	D703-C707 VanDerWaalsContact O-CB 3.24Å; D703-C707 WeakPolarHBondContact O-CB 3.4Å; D703-C707 PolarHBondContact O-N 3.31Å; Q704-C707 PolarHBondContact O-N 2.9Å; F705-C707 VanDerWaalsContact C-N 3.31Å; F705-C707 PolarHBondContact O-N 3.17Å; C707-S710 PolarHBondContact O-OG 3.43Å; C707-H711 PolarHBondContact O-N 3.21Å; C707-H711 VanDerWaalsContact O-N 3.15Å; C707-H711 PolarHBondContact O-ND1 3.44Å; C707-R774 VanDerWaalsContact CA-NH1 3.32Å
708	K	94.7	Very high	95.1	Very high	54 Å²	54	31.8 Å²	31.8	24%	0.235	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-43.8	180	-73	-170.5	175.4	-157.9	0	111.3	D653 L656 E657 Q704 F705 H711 K712	D653-K708 IonicContact OD1-NZ 2.76Å; D653-K708 PolarHBondContact OD1-NZ 3.14Å; D653-K708 IonicContact OD2-NZ 3.78Å; L656-K708 HydrophobicContact CD1-CB 4.03Å; L656-K708 HydrophobicContact CD1-CD 4.09Å; E657-K708 IonicContact OE1-NZ 3.64Å; E657-K708 PolarHBondContact OE1-NZ 2.92Å; Q704-K708 WeakPolarHBondContact O-CB 3.45Å; Q704-K708 WeakPolarHBondContact O-CG 3.43Å; Q704-K708 PolarHBondContact O-N 2.93Å; F705-K708 PolarHBondContact O-N 3.4Å; K708-H711 PolarHBondContact O-N 2.91Å; K708-K712 WeakPolarHBondContact O-CG 3.42Å; K708-K712 PolarHBondContact O-N 2.92Å
709	L	94.5	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-48.4	-179.8	-178.1	60.6	0	0	0	111.6	L656 I664 F705 H711 K712 I713 Y749 L752 L767 L771	L656-L709 HydrophobicContact CD2-CB 4.37Å; I664-L709 HydrophobicContact CD1-CD1 4.42Å; F705-L709 HydrophobicContact CE1-CD2 3.81Å; F705-L709 HydrophobicContact CE2-CD2 4.45Å; F705-L709 HydrophobicContact CZ-CD2 3.69Å; F705-L709 WeakPolarHBondContact O-CB 3.49Å; F705-L709 PolarHBondContact O-N 2.94Å; L709-H711 PolarHBondContact O-N 3.39Å; L709-K712 PolarHBondContact O-N 2.94Å; L709-I713 HydrophobicContact CD1-CD1 3.86Å; L709-I713 HydrophobicContact CD1-CG1 4.12Å; L709-I713 HydrophobicContact CD2-CD1 4.44Å; L709-I713 HydrophobicContact CG-CD1 3.76Å; L709-I713 HydrophobicContact CG-CG1 4.4Å; L709-I713 WeakPolarHBondContact O-CB 3.48Å; L709-I713 VanDerWaalsContact O-CG1 3.3Å; L709-I713 WeakPolarHBondContact O-CG1 3.36Å; L709-I713 PolarHBondContact O-N 2.98Å; L709-Y749 HydrophobicContact CD1-CD1 3.94Å; L709-Y749 HydrophobicContact CD1-CE1 3.93Å; L709-L752 HydrophobicContact CD1-CD1 3.94Å; L709-L752 HydrophobicContact CD2-CD1 4.09Å; L709-L767 HydrophobicContact CD2-CD2 4.39Å; L709-L771 HydrophobicContact CB-CD2 4.49Å; L709-L771 HydrophobicContact CD2-CD1 4.36Å; L709-L771 HydrophobicContact CD2-CD2 4.13Å; L709-L771 HydrophobicContact CG-CD2 4.1Å
710	S	95.6	Very high	95	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.028	16%	0.155	C	C	.	.	H	α-helix	trans	-60.9	-42.6	178.6	55.6	0	0	0	0	112.5	V706 C707 I713 F714 R774	V706-S710 VanDerWaalsContact O-CB 3.25Å; V706-S710 WeakPolarHBondContact O-CB 3.25Å; V706-S710 PolarHBondContact O-N 3.38Å; V706-S710 PolarHBondContact O-OG 3.29Å; C707-S710 PolarHBondContact O-OG 3.43Å; S710-I713 PolarHBondContact O-N 2.89Å; S710-F714 WeakPolarHBondContact O-CB 3.29Å; S710-F714 PolarHBondContact O-N 3.37Å; S710-R774 VanDerWaalsContact OG-CD 3.3Å; S710-R774 WeakPolarHBondContact OG-CD 3.38Å
711	H	94.2	Very high	95	Very high	95 Å²	95	26.5 Å²	26.5	44%	0.44	13%	0.133	S	C	.	.	H	α-helix	trans	-62.2	-42.6	174.2	-73.9	155.4	0	0	0	112.7	C707 K708 L709 A715	C707-H711 PolarHBondContact O-N 3.21Å; C707-H711 VanDerWaalsContact O-N 3.15Å; C707-H711 PolarHBondContact O-ND1 3.44Å; K708-H711 PolarHBondContact O-N 2.91Å; L709-H711 PolarHBondContact O-N 3.39Å; H711-A715 VanDerWaalsContact O-CB 3.25Å; H711-A715 WeakPolarHBondContact O-CB 3.34Å; H711-A715 PolarHBondContact O-N 2.7Å
712	K	92.7	Very high	95.1	Very high	59 Å²	59	26.5 Å²	26.5	26%	0.257	13%	0.133	S	C	.	.	H	α-helix	trans	-67.3	-41.5	178.1	-73.2	-165.5	-174.5	-147.7	0	112.1	L656 E657 K708 L709 H716	L656-K712 WeakPolarHBondContact O-CD 3.3Å; L656-K712 WeakPolarHBondContact O-CE 3.43Å; L656-K712 PolarHBondContact O-NZ 3.22Å; E657-K712 IonicContact OE2-NZ 2.82Å; E657-K712 PolarHBondContact OE2-NZ 3.29Å; K708-K712 WeakPolarHBondContact O-CG 3.42Å; K708-K712 PolarHBondContact O-N 2.92Å; L709-K712 PolarHBondContact O-N 2.94Å; K712-H716 WeakPolarHBondContact O-CB 3.38Å; K712-H716 PolarHBondContact O-N 3.22Å
713	I	94.6	Very high	95	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.3	-53.6	174.3	-70.7	171.3	0	0	0	109.8	L709 S710 A715 H716 Y717 Y749 M753 L771 I775 L815	L709-I713 HydrophobicContact CD1-CD1 3.86Å; L709-I713 HydrophobicContact CD1-CG1 4.12Å; L709-I713 HydrophobicContact CD2-CD1 4.44Å; L709-I713 HydrophobicContact CG-CD1 3.76Å; L709-I713 HydrophobicContact CG-CG1 4.4Å; L709-I713 WeakPolarHBondContact O-CB 3.48Å; L709-I713 VanDerWaalsContact O-CG1 3.3Å; L709-I713 WeakPolarHBondContact O-CG1 3.36Å; L709-I713 PolarHBondContact O-N 2.98Å; S710-I713 PolarHBondContact O-N 2.89Å; I713-A715 PolarHBondContact O-N 3.25Å; I713-H716 PolarHBondContact O-N 2.96Å; I713-Y717 HydrophobicContact CG2-CD2 3.87Å; I713-Y717 HydrophobicContact CG2-CE2 4.09Å; I713-Y717 WeakPolarHBondContact O-CD2 3.31Å; I713-Y717 PolarHBondContact O-N 3.5Å; I713-Y749 HydrophobicContact CD1-CD1 4.22Å; I713-Y749 HydrophobicContact CD1-CG 4.43Å; I713-Y749 HydrophobicContact CG1-CD1 3.63Å; I713-Y749 HydrophobicContact CG1-CD2 4.2Å; I713-Y749 HydrophobicContact CG1-CE1 4.13Å; I713-Y749 HydrophobicContact CG1-CG 3.7Å; I713-M753 HydrophobicContact CD1-CG 3.84Å; I713-M753 HydrophobicContact CD1-SD 4.22Å; I713-M753 HydrophobicContact CG2-SD 3.71Å; I713-L771 HydrophobicContact CD1-CD1 3.95Å; I713-L771 HydrophobicContact CD1-CD2 4.12Å; I713-I775 HydrophobicContact CB-CD1 4.42Å; I713-I775 HydrophobicContact CG2-CD1 3.76Å; I713-L815 HydrophobicContact CG2-CD2 3.74Å
714	F	96.2	Very high	95	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.013	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-49.7	179.6	174.8	-102.3	0	0	0	111.9	S710 H716 Y717 K718 A778 L779 S891 Y892	S710-F714 WeakPolarHBondContact O-CB 3.29Å; S710-F714 PolarHBondContact O-N 3.37Å; F714-H716 VanDerWaalsContact C-N 3.32Å; F714-H716 PolarHBondContact O-N 2.87Å; F714-Y717 PolarHBondContact O-N 2.91Å; F714-K718 HydrophobicContact CZ-CD 4.23Å; F714-K718 VanDerWaalsContact O-CB 3.29Å; F714-K718 WeakPolarHBondContact O-CB 3.3Å; F714-K718 PolarHBondContact O-N 3.46Å; F714-A778 HydrophobicContact CD1-CB 4.1Å; F714-A778 HydrophobicContact CD2-CB 3.84Å; F714-A778 HydrophobicContact CE1-CB 4.29Å; F714-A778 HydrophobicContact CE2-CB 4.03Å; F714-A778 HydrophobicContact CG-CB 3.88Å; F714-A778 HydrophobicContact CZ-CB 4.26Å; F714-L779 HydrophobicContact CD2-CG 4.49Å; F714-L779 HydrophobicContact CE2-CD2 3.9Å; F714-L779 HydrophobicContact CE2-CG 4.05Å; F714-S891 WeakPolarHBondContact CE1-O 3.28Å; F714-Y892 AromaticContact CE1-CD1 3.76Å; F714-Y892 HydrophobicContact CE1-CD1 3.76Å; F714-Y892 AromaticContact CE1-CE1 3.93Å; F714-Y892 HydrophobicContact CE1-CE1 3.93Å; F714-Y892 HydrophobicContact CZ-CD1 4.15Å; F714-Y892 HydrophobicContact CZ-CE1 4.48Å
715	A	94.6	Very high	95	Very high	21 Å²	21	25.7 Å²	25.7	17%	0.174	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-39.7	178.7	0	0	0	0	0	112.3	H711 I713 K718 Q719	H711-A715 VanDerWaalsContact O-CB 3.25Å; H711-A715 WeakPolarHBondContact O-CB 3.34Å; H711-A715 PolarHBondContact O-N 2.7Å; I713-A715 PolarHBondContact O-N 3.25Å; A715-K718 PolarHBondContact O-N 3.22Å; A715-Q719 VanDerWaalsContact O-CG 3.25Å; A715-Q719 WeakPolarHBondContact O-CG 3.47Å; A715-Q719 PolarHBondContact O-N 2.89Å
716	H	93.5	Very high	94.9	Very high	18 Å²	18	26.1 Å²	26.1	8%	0.083	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-52.3	177.6	178.1	65.2	0	0	0	112	K712 I713 F714 K718 Q719 L720 F745 T747 Y749	K712-H716 WeakPolarHBondContact O-CB 3.38Å; K712-H716 PolarHBondContact O-N 3.22Å; I713-H716 PolarHBondContact O-N 2.96Å; F714-H716 VanDerWaalsContact C-N 3.32Å; F714-H716 PolarHBondContact O-N 2.87Å; H716-K718 VanDerWaalsContact C-N 3.28Å; H716-K718 PolarHBondContact O-N 3.4Å; H716-Q719 PolarHBondContact O-N 3.44Å; H716-L720 WeakPolarHBondContact O-CB 3.39Å; H716-L720 PolarHBondContact O-N 2.87Å; H716-F745 PolarHBondContact CE1-O 3.42Å; H716-T747 PolarHBondContact CD2-OG1 3.19Å; H716-T747 WeakPolarHBondContact CE1-CG2 3.42Å; H716-T747 PolarHBondContact CE1-OG1 2.84Å; H716-T747 PolarHBondContact NE2-N 2.92Å; H716-T747 PolarHBondContact NE2-OG1 3.33Å; H716-Y749 HydrophobicContact CB-CD2 4.48Å; H716-Y749 HydrophobicContact CB-CE2 3.96Å; H716-Y749 AromaticContact CD2-CD2 4Å; H716-Y749 AromaticContact CG-CE2 3.93Å
717	Y	95.5	Very high	94.7	Very high	3 Å²	3	30 Å²	30	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-67.9	-29.6	-179.4	-81	-84.1	0	0	0	112.5	I713 F714 L720 A721 M753 L814 L815 H818	I713-Y717 HydrophobicContact CG2-CD2 3.87Å; I713-Y717 HydrophobicContact CG2-CE2 4.09Å; I713-Y717 WeakPolarHBondContact O-CD2 3.31Å; I713-Y717 PolarHBondContact O-N 3.5Å; F714-Y717 PolarHBondContact O-N 2.91Å; Y717-L720 HydrophobicContact CD1-CD2 4.13Å; Y717-L720 HydrophobicContact CE1-CD2 4.28Å; Y717-L720 PolarHBondContact O-N 3.48Å; Y717-A721 WeakPolarHBondContact O-CB 3.11Å; Y717-A721 PolarHBondContact O-N 3.39Å; Y717-M753 HydrophobicContact CE2-CE 3.67Å; Y717-M753 HydrophobicContact CE2-SD 4.41Å; Y717-M753 WeakPolarHBondContact OH-CE 3.47Å; Y717-L814 HydrophobicContact CD1-CB 3.68Å; Y717-L814 HydrophobicContact CE1-CB 4.09Å; Y717-L815 HydrophobicContact CD1-CD2 4.29Å; Y717-L815 HydrophobicContact CD1-CG 4.38Å; Y717-L815 HydrophobicContact CD2-CD2 3.43Å; Y717-L815 VanDerWaalsContact CD2-CD2 3.43Å; Y717-L815 HydrophobicContact CD2-CG 4.28Å; Y717-L815 HydrophobicContact CE2-CD2 4.01Å; Y717-L815 HydrophobicContact CG-CD2 3.59Å; Y717-L815 HydrophobicContact CG-CG 3.93Å; Y717-H818 PolarHBondContact OH-CD2 3.15Å
718	K	96	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-47.2	169.9	-163.7	81.5	145.1	140.5	0	112	F714 A715 H716 L720 A721 S722 S782 L807 N808 C811 S891 F893	F714-K718 HydrophobicContact CZ-CD 4.23Å; F714-K718 VanDerWaalsContact O-CB 3.29Å; F714-K718 WeakPolarHBondContact O-CB 3.3Å; F714-K718 PolarHBondContact O-N 3.46Å; A715-K718 PolarHBondContact O-N 3.22Å; H716-K718 VanDerWaalsContact C-N 3.28Å; H716-K718 PolarHBondContact O-N 3.4Å; K718-L720 VanDerWaalsContact C-N 3.34Å; K718-A721 PolarHBondContact O-N 2.82Å; K718-S722 WeakPolarHBondContact O-CB 3.16Å; K718-S722 PolarHBondContact O-N 2.98Å; K718-S722 PolarHBondContact O-OG 2.97Å; K718-S782 WeakPolarHBondContact CE-OG 3.19Å; K718-S782 PolarHBondContact NZ-OG 3.27Å; K718-L807 HydrophobicContact CD-CD2 3.5Å; K718-L807 HydrophobicContact CG-CD2 4.03Å; K718-L807 VanDerWaalsContact NZ-CD2 3.3Å; K718-N808 PolarHBondContact NZ-ND2 3.13Å; K718-N808 VanDerWaalsContact NZ-ND2 3.19Å; K718-N808 PolarHBondContact NZ-OD1 2.83Å; K718-C811 HydrophobicContact CD-CB 4.4Å; K718-S891 VanDerWaalsContact CE-O 3.27Å; K718-S891 WeakPolarHBondContact CE-O 3.37Å; K718-S891 WeakPolarHBondContact CG-O 3.49Å; K718-F893 WeakPolarHBondContact CE-O 3.25Å; K718-F893 PolarHBondContact NZ-O 2.92Å
719	Q	95.3	Very high	94.5	Very high	54 Å²	54	43 Å²	43	25%	0.252	20%	0.201	S	C	.	.	H	α-helix	trans	-67.6	-35.7	177.5	-69.7	171.7	15.7	0	0	112	A715 H716 S722 S723 V744 G895 F899	A715-Q719 VanDerWaalsContact O-CG 3.25Å; A715-Q719 WeakPolarHBondContact O-CG 3.47Å; A715-Q719 PolarHBondContact O-N 2.89Å; H716-Q719 PolarHBondContact O-N 3.44Å; Q719-S722 WeakPolarHBondContact O-CB 3.05Å; Q719-S722 PolarHBondContact O-N 3.18Å; Q719-S723 WeakPolarHBondContact O-CB 3.36Å; Q719-S723 PolarHBondContact O-N 3.2Å; Q719-V744 HydrophobicContact CB-CG1 4.41Å; Q719-V744 HydrophobicContact CB-CG2 4.07Å; Q719-G895 WeakPolarHBondContact CG-O 3.14Å; Q719-G895 PolarHBondContact NE2-O 2.92Å; Q719-F899 HydrophobicContact CB-CD2 4.45Å; Q719-F899 HydrophobicContact CB-CE2 4.11Å; Q719-F899 HydrophobicContact CG-CD2 4.35Å; Q719-F899 HydrophobicContact CG-CE2 4.39Å
720	L	95	Very high	94.3	Very high	17 Å²	17	45 Å²	45	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-49.3	173.7	-178.9	60.4	0	0	0	110.9	H716 Y717 K718 S722 S723 I724 V744 L814	H716-L720 WeakPolarHBondContact O-CB 3.39Å; H716-L720 PolarHBondContact O-N 2.87Å; Y717-L720 HydrophobicContact CD1-CD2 4.13Å; Y717-L720 HydrophobicContact CE1-CD2 4.28Å; Y717-L720 PolarHBondContact O-N 3.48Å; K718-L720 VanDerWaalsContact C-N 3.34Å; L720-S722 VanDerWaalsContact C-N 3.28Å; L720-S722 PolarHBondContact O-N 3.23Å; L720-S723 PolarHBondContact O-N 3.21Å; L720-S723 VanDerWaalsContact O-N 3.16Å; L720-I724 HydrophobicContact CD1-CD1 4.25Å; L720-I724 HydrophobicContact CG-CD1 4.06Å; L720-I724 VanDerWaalsContact O-CG1 3.3Å; L720-I724 WeakPolarHBondContact O-CG1 3.32Å; L720-I724 PolarHBondContact O-N 3.39Å; L720-V744 HydrophobicContact CB-CG1 4.37Å; L720-V744 WeakPolarHBondContact CD1-O 3.48Å; L720-L814 HydrophobicContact CD2-CD1 4.09Å; L720-L814 HydrophobicContact CG-CD1 4.14Å
721	A	96.3	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-42.6	174.7	0	0	0	0	0	111.7	Y717 K718 S723 I724 L725 L807 L810 C811 L814	Y717-A721 WeakPolarHBondContact O-CB 3.11Å; Y717-A721 PolarHBondContact O-N 3.39Å; K718-A721 PolarHBondContact O-N 2.82Å; A721-S723 PolarHBondContact O-N 3.18Å; A721-I724 PolarHBondContact O-N 3.5Å; A721-L725 WeakPolarHBondContact O-CG 3.39Å; A721-L725 PolarHBondContact O-N 2.92Å; A721-L807 HydrophobicContact CB-CG 4.43Å; A721-L810 HydrophobicContact CB-CB 4.16Å; A721-L810 HydrophobicContact CB-CD2 3.97Å; A721-L810 HydrophobicContact CB-CG 3.96Å; A721-C811 HydrophobicContact CB-CB 4.15Å; A721-L814 HydrophobicContact CB-CD1 4.33Å
722	S	95.7	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-44.9	175.8	-54	0	0	0	0	112	K718 Q719 L720 I724 L725 L726 L807 W894	K718-S722 WeakPolarHBondContact O-CB 3.16Å; K718-S722 PolarHBondContact O-N 2.98Å; K718-S722 PolarHBondContact O-OG 2.97Å; Q719-S722 WeakPolarHBondContact O-CB 3.05Å; Q719-S722 PolarHBondContact O-N 3.18Å; L720-S722 VanDerWaalsContact C-N 3.28Å; L720-S722 PolarHBondContact O-N 3.23Å; S722-I724 VanDerWaalsContact C-N 3.29Å; S722-I724 PolarHBondContact O-N 3.11Å; S722-L725 PolarHBondContact O-N 2.93Å; S722-L726 WeakPolarHBondContact O-CB 3.17Å; S722-L726 PolarHBondContact O-N 3.34Å; S722-L807 WeakPolarHBondContact OG-CD1 3.5Å; S722-W894 WeakPolarHBondContact CB-O 3.47Å; S722-W894 PolarHBondContact OG-O 3.19Å
723	S	94.3	Very high	93.9	Very high	13 Å²	13	46 Å²	46	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-29	178	-171.3	0	0	0	0	112.8	Q719 L720 A721	Q719-S723 WeakPolarHBondContact O-CB 3.36Å; Q719-S723 PolarHBondContact O-N 3.2Å; L720-S723 PolarHBondContact O-N 3.21Å; L720-S723 VanDerWaalsContact O-N 3.16Å; A721-S723 PolarHBondContact O-N 3.18Å
724	I	94.5	Very high	93.7	Very high	92 Å²	92	46.6 Å²	46.6	47%	0.472	23%	0.231	S	C	.	.	H	α-helix	trans	-75.5	-42.5	176.6	-68.8	164.2	0	0	0	110.8	L720 A721 S722 L810 L814	L720-I724 HydrophobicContact CD1-CD1 4.25Å; L720-I724 HydrophobicContact CG-CD1 4.06Å; L720-I724 VanDerWaalsContact O-CG1 3.3Å; L720-I724 WeakPolarHBondContact O-CG1 3.32Å; L720-I724 PolarHBondContact O-N 3.39Å; A721-I724 PolarHBondContact O-N 3.5Å; S722-I724 VanDerWaalsContact C-N 3.29Å; S722-I724 PolarHBondContact O-N 3.11Å; I724-L810 HydrophobicContact CB-CD2 3.98Å; I724-L810 HydrophobicContact CD1-CD2 4.36Å; I724-L810 HydrophobicContact CG2-CD2 3.82Å; I724-L814 HydrophobicContact CD1-CD1 4.08Å
725	L	94.4	Very high	93.4	Very high	64 Å²	64	49.4 Å²	49.4	34%	0.335	25%	0.251	S	S	.	.	H	α-helix	trans	-82.9	-18.9	-176.5	-67.6	176	0	0	0	114	A721 S722 D727 M806 L807 L810	A721-L725 WeakPolarHBondContact O-CG 3.39Å; A721-L725 PolarHBondContact O-N 2.92Å; S722-L725 PolarHBondContact O-N 2.93Å; L725-D727 PolarHBondContact O-N 2.63Å; L725-M806 HydrophobicContact CD1-CG 4.48Å; L725-M806 HydrophobicContact CD2-SD 4.43Å; L725-L807 HydrophobicContact CD1-CB 3.92Å; L725-L807 HydrophobicContact CD1-CG 4.41Å; L725-L810 HydrophobicContact CD1-CB 4.43Å; L725-L810 HydrophobicContact CD1-CD2 4.03Å; L725-L810 HydrophobicContact CD2-CD2 4.05Å; L725-L810 HydrophobicContact CG-CD2 3.71Å
726	L	93.9	Very high	93.2	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	28%	0.275	C	S	.	.	S	Bend	trans	-62.6	132.5	179.4	-174.5	66.9	0	0	0	111	S722 K728 F730 K731 I741 F899 A902 F903 L906	S722-L726 WeakPolarHBondContact O-CB 3.17Å; S722-L726 PolarHBondContact O-N 3.34Å; L726-K728 PolarHBondContact O-N 3.08Å; L726-F730 HydrophobicContact CD1-CD1 3.96Å; L726-F730 HydrophobicContact CD1-CE1 4.26Å; L726-F730 HydrophobicContact CG-CD1 4.47Å; L726-K731 HydrophobicContact CD2-CB 4.33Å; L726-K731 HydrophobicContact CD2-CD 4.37Å; L726-I741 HydrophobicContact CD2-CD1 4Å; L726-I741 HydrophobicContact CD2-CG2 3.92Å; L726-F899 HydrophobicContact CD2-CD1 4.45Å; L726-F899 HydrophobicContact CD2-CE1 4.17Å; L726-A902 HydrophobicContact CD1-CB 4.19Å; L726-F903 HydrophobicContact CB-CZ 4.11Å; L726-F903 HydrophobicContact CD1-CE1 4.3Å; L726-F903 HydrophobicContact CD1-CE2 4.25Å; L726-F903 HydrophobicContact CD1-CZ 4.07Å; L726-L906 HydrophobicContact CD1-CD1 3.71Å
727	D	92.1	Very high	93.1	Very high	85 Å²	85	59.1 Å²	59.1	46%	0.455	30%	0.303	S	S	.	.			trans	-59.8	125.1	179.5	-179.6	-96.9	0	0	0	111.5	L725 R729 F730 K731	L725-D727 PolarHBondContact O-N 2.63Å; D727-R729 VanDerWaalsContact C-N 3.29Å; D727-R729 PolarHBondContact O-N 3.36Å; D727-R729 WeakPolarHBondContact OD1-CA 3.47Å; D727-R729 VanDerWaalsContact OD1-CB 3.3Å; D727-R729 WeakPolarHBondContact OD1-CB 3.45Å; D727-R729 PolarHBondContact OD1-N 3.08Å; D727-F730 HydrophobicContact CB-CB 3.98Å; D727-F730 PolarHBondContact O-N 3.32Å; D727-F730 PolarHBondContact OD1-N 3.33Å; D727-K731 PolarHBondContact O-N 3.02Å
728	K	92.2	Very high	92.7	Very high	180 Å²	180	62.2 Å²	62.2	78%	0.783	34%	0.337	S	S	*	.	H	α-helix	trans	-67.3	-32.5	-174	-65.5	-177.3	-179.1	-179.7	0	111.9	L726 A732	L726-K728 PolarHBondContact O-N 3.08Å; K728-A732 PolarHBondContact O-N 2.96Å; K728-A732 VanDerWaalsContact O-N 3.1Å
729	R	92.9	Very high	92.2	Very high	187 Å²	187	67.8 Å²	67.8	71%	0.706	36%	0.364	S	S	*	.	H	α-helix	trans	-72.5	-46.8	178.9	-179.5	-179.9	179.2	171.5	2.1	110.3	D727 K731 A732 D733	D727-R729 VanDerWaalsContact C-N 3.29Å; D727-R729 PolarHBondContact O-N 3.36Å; D727-R729 WeakPolarHBondContact OD1-CA 3.47Å; D727-R729 VanDerWaalsContact OD1-CB 3.3Å; D727-R729 WeakPolarHBondContact OD1-CB 3.45Å; D727-R729 PolarHBondContact OD1-N 3.08Å; R729-K731 VanDerWaalsContact C-N 3.27Å; R729-K731 PolarHBondContact O-N 2.94Å; R729-A732 WeakPolarHBondContact O-CB 3.49Å; R729-A732 PolarHBondContact O-N 3.45Å; R729-D733 PolarHBondContact O-N 3.5Å
730	F	91.7	Very high	91.6	Very high	43 Å²	43	70.5 Å²	70.5	19%	0.189	39%	0.388	C	S	.	.	H	α-helix	trans	-53.6	-46	172.4	174.8	-99.1	0	0	0	111.6	L726 D727 A732 D733 C734 I741 A902 L906	L726-F730 HydrophobicContact CD1-CD1 3.96Å; L726-F730 HydrophobicContact CD1-CE1 4.26Å; L726-F730 HydrophobicContact CG-CD1 4.47Å; D727-F730 HydrophobicContact CB-CB 3.98Å; D727-F730 PolarHBondContact O-N 3.32Å; D727-F730 PolarHBondContact OD1-N 3.33Å; F730-A732 VanDerWaalsContact C-N 3.32Å; F730-A732 PolarHBondContact O-N 3.19Å; F730-D733 PolarHBondContact O-N 3.37Å; F730-C734 VanDerWaalsContact CZ-SG 3.5Å; F730-C734 PolarHBondContact O-N 3.34Å; F730-C734 PolarHBondContact O-SG 3Å; F730-C734 VanDerWaalsContact O-SG 3.4Å; F730-I741 HydrophobicContact CD1-CD1 4.39Å; F730-I741 HydrophobicContact CE1-CD1 3.8Å; F730-A902 HydrophobicContact CE1-CB 3.91Å; F730-A902 HydrophobicContact CZ-CB 4.49Å; F730-L906 HydrophobicContact CB-CD2 4.2Å; F730-L906 HydrophobicContact CD1-CD1 4.12Å; F730-L906 HydrophobicContact CD1-CD2 4.38Å; F730-L906 HydrophobicContact CD1-CG 4.34Å; F730-L906 HydrophobicContact CD2-CD2 3.72Å; F730-L906 HydrophobicContact CD2-CG 4.27Å; F730-L906 HydrophobicContact CE1-CD1 4.37Å; F730-L906 HydrophobicContact CE1-CG 4.39Å; F730-L906 HydrophobicContact CE2-CD2 4.17Å; F730-L906 HydrophobicContact CE2-CG 4.31Å; F730-L906 HydrophobicContact CG-CD1 4.37Å; F730-L906 HydrophobicContact CG-CD2 3.83Å; F730-L906 HydrophobicContact CG-CG 4.28Å; F730-L906 HydrophobicContact CZ-CG 4.37Å
731	K	90.1	Very high	91.2	Very high	41 Å²	41	70.4 Å²	70.4	18%	0.178	39%	0.387	C	S	.	.	H	α-helix	trans	-60.3	-40.9	176.2	-173	173.2	-175.9	161	0	112.7	L726 D727 R729 S735 I741 P742	L726-K731 HydrophobicContact CD2-CB 4.33Å; L726-K731 HydrophobicContact CD2-CD 4.37Å; D727-K731 PolarHBondContact O-N 3.02Å; R729-K731 VanDerWaalsContact C-N 3.27Å; R729-K731 PolarHBondContact O-N 2.94Å; K731-S735 WeakPolarHBondContact O-CB 3.37Å; K731-S735 PolarHBondContact O-N 3.41Å; K731-S735 PolarHBondContact O-OG 3.35Å; K731-I741 WeakPolarHBondContact CE-O 3.34Å; K731-I741 PolarHBondContact NZ-O 3.49Å; K731-I741 VanDerWaalsContact NZ-O 3.1Å; K731-P742 PolarHBondContact NZ-O 3.16Å
732	A	91	Very high	90.5	Very high	57 Å²	57	73 Å²	73	47%	0.471	40%	0.404	S	S	.	.	H	α-helix	trans	-66.7	-42	177.4	0	0	0	0	0	111.4	K728 R729 F730 S735 S736	K728-A732 PolarHBondContact O-N 2.96Å; K728-A732 VanDerWaalsContact O-N 3.1Å; R729-A732 WeakPolarHBondContact O-CB 3.49Å; R729-A732 PolarHBondContact O-N 3.45Å; F730-A732 VanDerWaalsContact C-N 3.32Å; F730-A732 PolarHBondContact O-N 3.19Å; A732-S735 WeakPolarHBondContact O-CB 3.24Å; A732-S735 PolarHBondContact O-N 3.18Å; A732-S736 PolarHBondContact O-N 3.22Å
733	D	91.9	Very high	89.9	Confident	79 Å²	79	78.5 Å²	78.5	42%	0.422	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-45.6	178.1	-67.3	-18.3	0	0	0	110.9	R729 F730 S735 S736 Q737	R729-D733 PolarHBondContact O-N 3.5Å; F730-D733 PolarHBondContact O-N 3.37Å; D733-S735 VanDerWaalsContact C-N 3.32Å; D733-S735 PolarHBondContact O-N 3.12Å; D733-S736 WeakPolarHBondContact O-CB 3.35Å; D733-S736 PolarHBondContact O-N 3.5Å; D733-S736 PolarHBondContact O-OG 3.14Å; D733-Q737 PolarHBondContact O-N 3.11Å
734	C	90	Very high	89.5	Confident	13 Å²	13	78.7 Å²	78.7	9%	0.088	43%	0.429	C	S	.	.	H	α-helix	trans	-57.3	-44.7	171.8	-71.4	0	0	0	0	112	F730 S736 Q737 G738 M739 I741	F730-C734 VanDerWaalsContact CZ-SG 3.5Å; F730-C734 PolarHBondContact O-N 3.34Å; F730-C734 PolarHBondContact O-SG 3Å; F730-C734 VanDerWaalsContact O-SG 3.4Å; C734-S736 VanDerWaalsContact C-N 3.28Å; C734-S736 PolarHBondContact O-N 3.12Å; C734-Q737 CarbonylContact O-C 3.56Å; C734-Q737 WeakPolarHBondContact O-CA 3.42Å; C734-Q737 PolarHBondContact O-N 3.44Å; C734-G738 PolarHBondContact O-N 2.97Å; C734-M739 CarbonylContact C-O 3.59Å; C734-M739 HydrophobicContact CB-CB 4.08Å; C734-M739 WeakPolarHBondContact CB-O 3.46Å; C734-M739 WeakPolarHBondContact O-CA 3.24Å; C734-M739 PolarHBondContact O-N 3.26Å; C734-I741 HydrophobicContact CB-CD1 4.34Å
735	S	89.6	Confident	88.8	Confident	62 Å²	62	81.7 Å²	81.7	43%	0.434	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-37.6	178.9	-56.7	0	0	0	0	111.6	K731 A732 D733 Q737 G738 M739	K731-S735 WeakPolarHBondContact O-CB 3.37Å; K731-S735 PolarHBondContact O-N 3.41Å; K731-S735 PolarHBondContact O-OG 3.35Å; A732-S735 WeakPolarHBondContact O-CB 3.24Å; A732-S735 PolarHBondContact O-N 3.18Å; D733-S735 VanDerWaalsContact C-N 3.32Å; D733-S735 PolarHBondContact O-N 3.12Å; S735-Q737 PolarHBondContact O-N 3.17Å; S735-G738 PolarHBondContact O-N 3.33Å; S735-G738 VanDerWaalsContact O-N 3.08Å; S735-M739 PolarHBondContact N-O 2.93Å
736	S	91.7	Very high	87.8	Confident	95 Å²	95	83.3 Å²	83.3	66%	0.664	45%	0.448	S	S	*	.	H	α-helix	trans	-64.5	-26.9	175.6	79.4	0	0	0	0	112.9	A732 D733 C734 G738	A732-S736 PolarHBondContact O-N 3.22Å; D733-S736 WeakPolarHBondContact O-CB 3.35Å; D733-S736 PolarHBondContact O-N 3.5Å; D733-S736 PolarHBondContact O-OG 3.14Å; C734-S736 VanDerWaalsContact C-N 3.28Å; C734-S736 PolarHBondContact O-N 3.12Å; S736-G738 VanDerWaalsContact C-N 3.34Å
737	Q	90.1	Very high	87.1	Confident	148 Å²	148	84.3 Å²	84.3	69%	0.692	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	8	176	-64.2	-177.9	1.2	0	0	113.1	D733 C734 S735 M739	D733-Q737 PolarHBondContact O-N 3.11Å; C734-Q737 CarbonylContact O-C 3.56Å; C734-Q737 WeakPolarHBondContact O-CA 3.42Å; C734-Q737 PolarHBondContact O-N 3.44Å; S735-Q737 PolarHBondContact O-N 3.17Å; Q737-M739 VanDerWaalsContact C-N 3.3Å; Q737-M739 PolarHBondContact O-N 3.39Å
738	G	87.7	Confident	86.7	Confident	69 Å²	69	86.7 Å²	86.7	71%	0.711	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	6.9	-179.1	0	0	0	0	0	114.7	C734 S735 S736	C734-G738 PolarHBondContact O-N 2.97Å; S735-G738 PolarHBondContact O-N 3.33Å; S735-G738 VanDerWaalsContact O-N 3.08Å; S736-G738 VanDerWaalsContact C-N 3.34Å
739	M	86.7	Confident	86.7	Confident	116 Å²	116	79.6 Å²	79.6	57%	0.571	43%	0.425	S	S	*	.			trans	-93.8	96.8	174.6	-63.8	-176.3	70.9	0	0	110.1	C734 S735 Q737 I741	C734-M739 CarbonylContact C-O 3.59Å; C734-M739 HydrophobicContact CB-CB 4.08Å; C734-M739 WeakPolarHBondContact CB-O 3.46Å; C734-M739 WeakPolarHBondContact O-CA 3.24Å; C734-M739 PolarHBondContact O-N 3.26Å; S735-M739 PolarHBondContact N-O 2.93Å; Q737-M739 VanDerWaalsContact C-N 3.3Å; Q737-M739 PolarHBondContact O-N 3.39Å; M739-I741 PolarHBondContact O-N 3.31Å
740	C	82.6	Confident	86.5	Confident	111 Å²	111	71.8 Å²	71.8	75%	0.75	40%	0.401	S	S	*	.			trans	-86.2	110.1	-179.8	-171.2	0	0	0	0	111.5
741	I	86	Confident	86.4	Confident	15 Å²	15	70.7 Å²	70.7	8%	0.077	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-87	120.3	170.7	-57.3	170.6	0	0	0	108.3	L726 F730 K731 C734 M739 F743 F899 A902	L726-I741 HydrophobicContact CD2-CD1 4Å; L726-I741 HydrophobicContact CD2-CG2 3.92Å; F730-I741 HydrophobicContact CD1-CD1 4.39Å; F730-I741 HydrophobicContact CE1-CD1 3.8Å; K731-I741 WeakPolarHBondContact CE-O 3.34Å; K731-I741 PolarHBondContact NZ-O 3.49Å; K731-I741 VanDerWaalsContact NZ-O 3.1Å; C734-I741 HydrophobicContact CB-CD1 4.34Å; M739-I741 PolarHBondContact O-N 3.31Å; I741-F743 PolarHBondContact O-N 3.07Å; I741-F899 HydrophobicContact CG2-CD1 4.17Å; I741-F899 HydrophobicContact CG2-CE1 3.81Å; I741-F899 HydrophobicContact CG2-CZ 4.38Å; I741-A902 HydrophobicContact CD1-CB 3.88Å
742	P	81.1	Confident	86.5	Confident	54 Å²	54	68.8 Å²	68.8	35%	0.351	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-59.2	140.5	-174	22.2	-31.9	0	0	0	111.8	K731	K731-P742 PolarHBondContact NZ-O 3.16Å
743	F	83.8	Confident	86.6	Confident	117 Å²	117	66 Å²	66	51%	0.513	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-88.2	131.4	166.6	-170	-87.3	0	0	0	108.7	I741 F745	I741-F743 PolarHBondContact O-N 3.07Å; F743-F745 AromaticContact CD1-CD1 3.76Å; F743-F745 HydrophobicContact CD1-CD1 3.76Å; F743-F745 AromaticContact CD1-CD2 3.97Å; F743-F745 HydrophobicContact CD1-CD2 3.97Å; F743-F745 AromaticContact CD1-CE1 3.47Å; F743-F745 HydrophobicContact CD1-CE1 3.47Å; F743-F745 VanDerWaalsContact CD1-CE1 3.47Å; F743-F745 AromaticContact CD1-CE2 3.7Å; F743-F745 HydrophobicContact CD1-CE2 3.7Å; F743-F745 HydrophobicContact CD1-CG 4Å; F743-F745 AromaticContact CD1-CZ 3.44Å; F743-F745 HydrophobicContact CD1-CZ 3.44Å; F743-F745 VanDerWaalsContact CD1-CZ 3.44Å; F743-F745 AromaticContact CE1-CD1 3.52Å; F743-F745 HydrophobicContact CE1-CD1 3.52Å; F743-F745 AromaticContact CE1-CE1 3.4Å; F743-F745 HydrophobicContact CE1-CE1 3.4Å; F743-F745 HydrophobicContact CE1-CE2 4.44Å; F743-F745 HydrophobicContact CE1-CG 4.11Å; F743-F745 AromaticContact CE1-CZ 3.9Å; F743-F745 HydrophobicContact CE1-CZ 3.9Å; F743-F745 HydrophobicContact CG-CZ 4.38Å
744	V	85.2	Confident	86.6	Confident	17 Å²	17	66.7 Å²	66.7	10%	0.103	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-103.3	118.4	-179.3	-178.3	0	0	0	0	108.9	Q719 L720 F899	Q719-V744 HydrophobicContact CB-CG1 4.41Å; Q719-V744 HydrophobicContact CB-CG2 4.07Å; L720-V744 HydrophobicContact CB-CG1 4.37Å; L720-V744 WeakPolarHBondContact CD1-O 3.48Å; V744-F899 HydrophobicContact CG2-CE2 4.14Å; V744-F899 HydrophobicContact CG2-CZ 4.33Å
745	F	81	Confident	86.7	Confident	154 Å²	154	66.1 Å²	66.1	68%	0.675	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-91.4	152.2	174.3	-62.8	-80.5	0	0	0	110.6	H716 F743 T747	H716-F745 PolarHBondContact CE1-O 3.42Å; F743-F745 AromaticContact CD1-CD1 3.76Å; F743-F745 HydrophobicContact CD1-CD1 3.76Å; F743-F745 AromaticContact CD1-CD2 3.97Å; F743-F745 HydrophobicContact CD1-CD2 3.97Å; F743-F745 AromaticContact CD1-CE1 3.47Å; F743-F745 HydrophobicContact CD1-CE1 3.47Å; F743-F745 VanDerWaalsContact CD1-CE1 3.47Å; F743-F745 AromaticContact CD1-CE2 3.7Å; F743-F745 HydrophobicContact CD1-CE2 3.7Å; F743-F745 HydrophobicContact CD1-CG 4Å; F743-F745 AromaticContact CD1-CZ 3.44Å; F743-F745 HydrophobicContact CD1-CZ 3.44Å; F743-F745 VanDerWaalsContact CD1-CZ 3.44Å; F743-F745 AromaticContact CE1-CD1 3.52Å; F743-F745 HydrophobicContact CE1-CD1 3.52Å; F743-F745 AromaticContact CE1-CE1 3.4Å; F743-F745 HydrophobicContact CE1-CE1 3.4Å; F743-F745 HydrophobicContact CE1-CE2 4.44Å; F743-F745 HydrophobicContact CE1-CG 4.11Å; F743-F745 AromaticContact CE1-CZ 3.9Å; F743-F745 HydrophobicContact CE1-CZ 3.9Å; F743-F745 HydrophobicContact CG-CZ 4.38Å; F745-T747 PolarHBondContact O-N 3.33Å
746	N	73.7	Confident	86.7	Confident	99 Å²	99	68.9 Å²	68.9	53%	0.529	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-61.4	136.3	174	-162.5	5.5	0	0	0	110.5
747	T	77.6	Confident	86.6	Confident	28 Å²	28	67.3 Å²	67.3	17%	0.172	35%	0.345	C	S	.	.			trans	-107	177.8	-176.8	52.6	0	0	0	0	111.4	P661 H716 F745 Y749	P661-T747 HydrophobicContact CB-CG2 3.99Å; P661-T747 HydrophobicContact CG-CG2 4.1Å; H716-T747 PolarHBondContact CD2-OG1 3.19Å; H716-T747 WeakPolarHBondContact CE1-CG2 3.42Å; H716-T747 PolarHBondContact CE1-OG1 2.84Å; H716-T747 PolarHBondContact NE2-N 2.92Å; H716-T747 PolarHBondContact NE2-OG1 3.33Å; F745-T747 PolarHBondContact O-N 3.33Å; T747-Y749 VanDerWaalsContact C-N 3.28Å; T747-Y749 PolarHBondContact O-N 2.78Å; T747-Y749 WeakPolarHBondContact OG1-CD2 3.47Å; T747-Y749 WeakPolarHBondContact OG1-CE2 3.41Å
748	R	84.9	Confident	86.5	Confident	136 Å²	136	60.3 Å²	60.3	51%	0.513	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	19.4	-171.4	-62.9	-67	-66.2	-159.1	-10.7	114.6	I664 E665 A750 T751	I664-R748 HydrophobicContact CG2-CB 4.02Å; E665-R748 HydrophobicContact CG-CB 4.02Å; E665-R748 IonicContact OE1-CZ 3.78Å; E665-R748 VanDerWaalsContact OE1-CZ 3.25Å; E665-R748 IonicContact OE1-NE 3.99Å; E665-R748 PolarHBondContact OE1-NE 3.09Å; E665-R748 IonicContact OE1-NH2 2.73Å; E665-R748 PolarHBondContact OE1-NH2 3.45Å; E665-R748 IonicContact OE2-CZ 3.51Å; E665-R748 IonicContact OE2-NE 3.96Å; E665-R748 IonicContact OE2-NH2 3.11Å; E665-R748 PolarHBondContact OE2-NH2 3.42Å; E665-R748 VanDerWaalsContact OE2-NH2 3.14Å; R748-A750 PolarHBondContact O-N 3.1Å; R748-T751 PolarHBondContact O-OG1 2.86Å; R748-T751 VanDerWaalsContact O-OG1 3.07Å
749	Y	91.2	Very high	86.6	Confident	30 Å²	30	58 Å²	58	12%	0.118	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-20.1	178.2	-65.4	-64.6	0	0	0	113.9	I664 L709 I713 H716 T747 T751 L752 M753	I664-Y749 HydrophobicContact CD1-CE1 3.89Å; I664-Y749 HydrophobicContact CG1-CD1 3.89Å; I664-Y749 HydrophobicContact CG1-CE1 3.63Å; I664-Y749 HydrophobicContact CG2-CD1 4.49Å; L709-Y749 HydrophobicContact CD1-CD1 3.94Å; L709-Y749 HydrophobicContact CD1-CE1 3.93Å; I713-Y749 HydrophobicContact CD1-CD1 4.22Å; I713-Y749 HydrophobicContact CD1-CG 4.43Å; I713-Y749 HydrophobicContact CG1-CD1 3.63Å; I713-Y749 HydrophobicContact CG1-CD2 4.2Å; I713-Y749 HydrophobicContact CG1-CE1 4.13Å; I713-Y749 HydrophobicContact CG1-CG 3.7Å; H716-Y749 HydrophobicContact CB-CD2 4.48Å; H716-Y749 HydrophobicContact CB-CE2 3.96Å; H716-Y749 AromaticContact CD2-CD2 4Å; H716-Y749 AromaticContact CG-CE2 3.93Å; T747-Y749 VanDerWaalsContact C-N 3.28Å; T747-Y749 PolarHBondContact O-N 2.78Å; T747-Y749 WeakPolarHBondContact OG1-CD2 3.47Å; T747-Y749 WeakPolarHBondContact OG1-CE2 3.41Å; Y749-T751 PolarHBondContact O-N 3.17Å; Y749-L752 PolarHBondContact O-N 3.05Å; Y749-L752 VanDerWaalsContact O-N 3.14Å; Y749-M753 PolarHBondContact O-N 3.22Å
750	A	89.9	Confident	86.8	Confident	23 Å²	23	52.6 Å²	52.6	19%	0.19	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-32.8	-178.1	0	0	0	0	0	113.2	R748 K754	R748-A750 PolarHBondContact O-N 3.1Å; A750-K754 WeakPolarHBondContact O-CB 3.3Å; A750-K754 WeakPolarHBondContact O-CD 3.47Å; A750-K754 WeakPolarHBondContact O-CG 3.02Å; A750-K754 PolarHBondContact O-N 3.36Å
751	T	89.7	Confident	87.2	Confident	21 Å²	21	48 Å²	48	13%	0.129	22%	0.224	C	C	.	.	H	α-helix	trans	-70.6	-41	178.4	48.1	0	0	0	0	112.3	P28 E665 R748 Y749 K754 Q755	P28-T751 HydrophobicContact CB-CG2 3.9Å; P28-T751 HydrophobicContact CG-CG2 4.11Å; E665-T751 WeakPolarHBondContact CG-OG1 3.33Å; E665-T751 WeakPolarHBondContact OE1-CG2 3.36Å; E665-T751 PolarHBondContact OE1-OG1 3.15Å; R748-T751 PolarHBondContact O-OG1 2.86Å; R748-T751 VanDerWaalsContact O-OG1 3.07Å; Y749-T751 PolarHBondContact O-N 3.17Å; T751-K754 PolarHBondContact O-N 3.5Å; T751-Q755 PolarHBondContact O-NE2 3.44Å
752	L	91.5	Very high	87.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-43.8	173.5	-72.7	172.4	0	0	0	112.4	I30 I664 L668 L709 Y749 K754 Q755 L767	I30-L752 HydrophobicContact CD1-CD2 3.63Å; I30-L752 HydrophobicContact CD1-CG 4.05Å; I664-L752 HydrophobicContact CG1-CD1 3.59Å; L668-L752 HydrophobicContact CD1-CD2 3.81Å; L668-L752 HydrophobicContact CD2-CD2 4.1Å; L668-L752 HydrophobicContact CG-CD2 3.7Å; L709-L752 HydrophobicContact CD1-CD1 3.94Å; L709-L752 HydrophobicContact CD2-CD1 4.09Å; Y749-L752 PolarHBondContact O-N 3.05Å; Y749-L752 VanDerWaalsContact O-N 3.14Å; L752-K754 PolarHBondContact O-N 3.5Å; L752-Q755 WeakPolarHBondContact O-CB 3.2Å; L752-Q755 WeakPolarHBondContact O-CG 3.48Å; L752-Q755 PolarHBondContact O-N 2.88Å; L752-Q755 VanDerWaalsContact O-N 3.13Å; L752-L767 HydrophobicContact CD2-CD2 4.41Å
753	M	92.9	Very high	87.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.1	-22.5	177.9	-71.6	-170.9	-68.6	0	0	112.4	I713 Y717 Y749 N768 L771 L815 H818 L819	I713-M753 HydrophobicContact CD1-CG 3.84Å; I713-M753 HydrophobicContact CD1-SD 4.22Å; I713-M753 HydrophobicContact CG2-SD 3.71Å; Y717-M753 HydrophobicContact CE2-CE 3.67Å; Y717-M753 HydrophobicContact CE2-SD 4.41Å; Y717-M753 WeakPolarHBondContact OH-CE 3.47Å; Y749-M753 PolarHBondContact O-N 3.22Å; M753-N768 VanDerWaalsContact O-CB 3.26Å; M753-N768 WeakPolarHBondContact O-CB 3.45Å; M753-N768 PolarHBondContact O-ND2 2.8Å; M753-L771 HydrophobicContact CG-CD1 4.02Å; M753-L815 HydrophobicContact SD-CD2 4.45Å; M753-H818 HydrophobicContact CB-CB 4.07Å; M753-H818 HydrophobicContact CE-CB 3.75Å; M753-H818 VanDerWaalsContact CE-CD2 3.43Å; M753-H818 WeakPolarHBondContact CE-CD2 3.48Å; M753-H818 HydrophobicContact SD-CB 4.18Å; M753-L819 HydrophobicContact CB-CD2 4.03Å; M753-L819 HydrophobicContact CG-CD2 4.19Å; M753-L819 HydrophobicContact SD-CD1 3.97Å; M753-L819 HydrophobicContact SD-CD2 4.3Å; M753-L819 HydrophobicContact SD-CG 4.02Å
754	K	91.5	Very high	87.9	Confident	93 Å²	93	49.6 Å²	49.6	40%	0.404	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.1	178.1	-74.2	174.6	-179	-172.9	0	114.5	P28 A750 T751 L752 R756	P28-K754 HydrophobicContact CG-CB 4.04Å; P28-K754 HydrophobicContact CG-CD 3.98Å; A750-K754 WeakPolarHBondContact O-CB 3.3Å; A750-K754 WeakPolarHBondContact O-CD 3.47Å; A750-K754 WeakPolarHBondContact O-CG 3.02Å; A750-K754 PolarHBondContact O-N 3.36Å; T751-K754 PolarHBondContact O-N 3.5Å; L752-K754 PolarHBondContact O-N 3.5Å; K754-R756 PolarHBondContact O-N 3.09Å
755	Q	92.1	Very high	88.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.			trans	-74.2	119.1	179.7	-57.8	-58.2	-62.7	0	0	110.8	P28 I30 L668 T751 L752 L767 N768	P28-Q755 PolarHBondContact O-NE2 3.29Å; I30-Q755 HydrophobicContact CD1-CG 4.09Å; I30-Q755 HydrophobicContact CG1-CG 4.34Å; L668-Q755 HydrophobicContact CD1-CG 3.89Å; T751-Q755 PolarHBondContact O-NE2 3.44Å; L752-Q755 WeakPolarHBondContact O-CB 3.2Å; L752-Q755 WeakPolarHBondContact O-CG 3.48Å; L752-Q755 PolarHBondContact O-N 2.88Å; L752-Q755 VanDerWaalsContact O-N 3.13Å; Q755-L767 HydrophobicContact CB-CB 4.1Å; Q755-L767 HydrophobicContact CB-CD2 4.32Å; Q755-L767 PolarHBondContact O-N 3.26Å; Q755-N768 PolarHBondContact O-N 2.96Å
756	R	90.3	Very high	88.8	Confident	121 Å²	121	45 Å²	45	46%	0.457	23%	0.228	S	C	.	.	S	Bend	trans	-109.6	-19.6	-177.4	-56.6	-54.7	-65	-84.5	-4.8	113.6	K754 D766 N768	K754-R756 PolarHBondContact O-N 3.09Å; R756-D766 IonicContact CZ-OD2 3.61Å; R756-D766 IonicContact NE-OD1 3.6Å; R756-D766 PolarHBondContact NE-OD1 3.22Å; R756-D766 IonicContact NE-OD2 3.77Å; R756-D766 PolarHBondContact NE-OD2 2.93Å; R756-D766 IonicContact NH2-OD2 3.6Å; R756-D766 PolarHBondContact NH2-OD2 3.21Å; R756-D766 WeakPolarHBondContact O-CA 3.44Å; R756-D766 VanDerWaalsContact O-CB 3.31Å; R756-D766 WeakPolarHBondContact O-CB 3.22Å; R756-N768 VanDerWaalsContact CD-CB 3.47Å
757	H	88.5	Confident	89.8	Confident	61 Å²	61	40.3 Å²	40.3	28%	0.282	20%	0.203	S	C	.	.	S	Bend	trans	-148	45.5	-174.8	50.7	63.7	0	0	0	113.3	D25 Q27 Q759 S764 I765	D25-H757 IonicContact OD1-NE2 3.01Å; D25-H757 IonicContact OD2-CD2 3.51Å; D25-H757 IonicContact OD2-CE1 3.59Å; D25-H757 PolarHBondContact OD2-CE1 3.04Å; D25-H757 IonicContact OD2-NE2 2.62Å; D25-H757 PolarHBondContact OD2-NE2 3.39Å; Q27-H757 PolarHBondContact NE2-CE1 2.85Å; Q27-H757 PolarHBondContact NE2-ND1 3.41Å; Q27-H757 PolarHBondContact OE1-CD2 2.84Å; Q27-H757 PolarHBondContact OE1-CE1 3.27Å; Q27-H757 PolarHBondContact OE1-ND1 2.99Å; Q27-H757 PolarHBondContact OE1-NE2 2.9Å; H757-Q759 PolarHBondContact O-N 3.42Å; H757-Q759 PolarHBondContact O-NE2 3.01Å; H757-S764 WeakPolarHBondContact CA-OG 3.31Å; H757-S764 WeakPolarHBondContact CB-OG 3.31Å; H757-I765 CarbonylContact C-O 3.19Å
758	F	89.4	Confident	90.7	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	126.8	177.9	169.5	-124.5	0	0	0	111.6	E31 L668 L671 F702 L760 I765	E31-F758 HydrophobicContact CB-CD2 3.98Å; E31-F758 HydrophobicContact CB-CE2 4.24Å; E31-F758 VanDerWaalsContact OE2-CA 3.28Å; E31-F758 WeakPolarHBondContact OE2-CA 3.48Å; E31-F758 WeakPolarHBondContact OE2-CD2 3.09Å; L668-F758 HydrophobicContact CB-CD2 4.46Å; L668-F758 HydrophobicContact CB-CE2 4.01Å; L668-F758 HydrophobicContact CB-CZ 4.43Å; L668-F758 HydrophobicContact CD1-CD2 4.13Å; L668-F758 HydrophobicContact CD1-CE2 4.48Å; L668-F758 HydrophobicContact CD2-CD1 4.39Å; L668-F758 HydrophobicContact CD2-CD2 4.41Å; L668-F758 HydrophobicContact CD2-CE1 4.18Å; L668-F758 HydrophobicContact CD2-CE2 4.25Å; L668-F758 HydrophobicContact CD2-CG 4.5Å; L668-F758 HydrophobicContact CD2-CZ 4.14Å; L668-F758 HydrophobicContact CG-CE2 4.46Å; L671-F758 HydrophobicContact CB-CZ 4.09Å; L671-F758 HydrophobicContact CD1-CE1 4.43Å; F702-F758 HydrophobicContact CE2-CD1 4.09Å; F702-F758 AromaticContact CE2-CE1 3.94Å; F702-F758 HydrophobicContact CE2-CE1 3.94Å; F758-L760 HydrophobicContact CD1-CB 4.31Å; F758-L760 HydrophobicContact CE1-CB 3.78Å; F758-L760 HydrophobicContact CE1-CD1 4.46Å; F758-L760 HydrophobicContact CE1-CD2 3.95Å; F758-L760 HydrophobicContact CE1-CG 4.28Å; F758-L760 HydrophobicContact CZ-CB 4.11Å; F758-L760 HydrophobicContact CZ-CD1 4.23Å; F758-L760 HydrophobicContact CZ-CD2 4.49Å; F758-I765 HydrophobicContact CD1-CD1 4.45Å; F758-I765 PolarHBondContact N-O 2.95Å; F758-I765 PolarHBondContact O-N 3.21Å
759	Q	88.6	Confident	91.2	Very high	21 Å²	21	37.6 Å²	37.6	10%	0.098	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116	-177.2	-59.7	-59.5	-42.6	0	0	112.6	E31 P34 L36 N675 H757 R763 S764	E31-Q759 PolarHBondContact OE2-N 2.98Å; P34-Q759 HydrophobicContact CB-CB 4.12Å; P34-Q759 HydrophobicContact CB-CG 3.43Å; P34-Q759 VanDerWaalsContact CB-CG 3.43Å; L36-Q759 VanDerWaalsContact CD2-OE1 3.31Å; N675-Q759 PolarHBondContact ND2-O 3.33Å; N675-Q759 VanDerWaalsContact ND2-O 3.16Å; H757-Q759 PolarHBondContact O-N 3.42Å; H757-Q759 PolarHBondContact O-NE2 3.01Å; Q759-R763 WeakPolarHBondContact CA-O 3.32Å; Q759-R763 PolarHBondContact OE1-O 3.18Å; Q759-S764 PolarHBondContact NE2-OG 3.48Å
760	L	91.4	Very high	91.5	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	124.7	177	-170.4	65.1	0	0	0	111.1	V698 F702 F758 G762 R763 I765	V698-L760 HydrophobicContact CG1-CD2 3.54Å; V698-L760 HydrophobicContact CG1-CG 4.04Å; F702-L760 HydrophobicContact CD2-CD2 3.86Å; F702-L760 HydrophobicContact CE2-CD2 4.38Å; F702-L760 HydrophobicContact CG-CD2 4.4Å; F758-L760 HydrophobicContact CD1-CB 4.31Å; F758-L760 HydrophobicContact CE1-CB 3.78Å; F758-L760 HydrophobicContact CE1-CD1 4.46Å; F758-L760 HydrophobicContact CE1-CD2 3.95Å; F758-L760 HydrophobicContact CE1-CG 4.28Å; F758-L760 HydrophobicContact CZ-CB 4.11Å; F758-L760 HydrophobicContact CZ-CD1 4.23Å; F758-L760 HydrophobicContact CZ-CD2 4.49Å; L760-G762 PolarHBondContact O-N 3.22Å; L760-R763 PolarHBondContact N-O 3.48Å; L760-R763 WeakPolarHBondContact O-CB 3.43Å; L760-R763 WeakPolarHBondContact O-CD 3.19Å; L760-R763 PolarHBondContact O-N 2.88Å; L760-I765 HydrophobicContact CB-CD1 3.91Å; L760-I765 HydrophobicContact CD2-CD1 4.31Å
761	L	90.5	Very high	91.8	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.073	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.3	-177.3	-57.7	-170.9	0	0	0	113.9	N675 A678 V694 E695 V698 R763	N675-L761 PolarHBondContact OD1-N 2.68Å; A678-L761 HydrophobicContact CB-CD2 3.39Å; V694-L761 HydrophobicContact CG1-CD1 4.46Å; V694-L761 HydrophobicContact CG1-CD2 4.13Å; E695-L761 HydrophobicContact CB-CD1 4.11Å; E695-L761 HydrophobicContact CG-CD1 4.33Å; V698-L761 HydrophobicContact CB-CD1 3.66Å; V698-L761 HydrophobicContact CB-CG 4.44Å; V698-L761 HydrophobicContact CG1-CD1 3.79Å; V698-L761 HydrophobicContact CG1-CG 4.23Å; V698-L761 HydrophobicContact CG2-CD1 3.7Å; V698-L761 HydrophobicContact CG2-CG 4.15Å; L761-R763 VanDerWaalsContact C-N 3.27Å; L761-R763 VanDerWaalsContact CB-NH1 3.34Å; L761-R763 VanDerWaalsContact O-CD 3.25Å; L761-R763 WeakPolarHBondContact O-CD 3.48Å; L761-R763 PolarHBondContact O-N 3.07Å; L761-R763 PolarHBondContact O-NH1 3.04Å
762	G	86.8	Confident	92.2	Very high	53 Å²	53	36.8 Å²	36.8	55%	0.546	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	-1	-177.6	0	0	0	0	0	115.2	L760	L760-G762 PolarHBondContact O-N 3.22Å
763	R	90.1	Very high	92.4	Very high	96 Å²	96	41.4 Å²	41.4	36%	0.362	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.1	172.5	-65.2	77.3	158.8	169.9	-1.3	110.1	Y691 E695 Q759 L760 L761 I765	Y691-R763 PolarHBondContact OH-NH1 2.95Å; E695-R763 IonicContact OE1-CZ 3.47Å; E695-R763 VanDerWaalsContact OE1-CZ 3.26Å; E695-R763 IonicContact OE1-NH1 2.62Å; E695-R763 PolarHBondContact OE1-NH1 2.87Å; E695-R763 IonicContact OE1-NH2 3.36Å; E695-R763 PolarHBondContact OE1-NH2 3.15Å; Q759-R763 WeakPolarHBondContact CA-O 3.32Å; Q759-R763 PolarHBondContact OE1-O 3.18Å; L760-R763 PolarHBondContact N-O 3.48Å; L760-R763 WeakPolarHBondContact O-CB 3.43Å; L760-R763 WeakPolarHBondContact O-CD 3.19Å; L760-R763 PolarHBondContact O-N 2.88Å; L761-R763 VanDerWaalsContact C-N 3.27Å; L761-R763 VanDerWaalsContact CB-NH1 3.34Å; L761-R763 VanDerWaalsContact O-CD 3.25Å; L761-R763 WeakPolarHBondContact O-CD 3.48Å; L761-R763 PolarHBondContact O-N 3.07Å; L761-R763 PolarHBondContact O-NH1 3.04Å; R763-I765 HydrophobicContact CB-CG1 4.07Å
764	S	90.2	Very high	92.6	Very high	71 Å²	71	45.7 Å²	45.7	50%	0.497	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	113.4	163.7	-172.6	0	0	0	0	109.3	H757 Q759	H757-S764 WeakPolarHBondContact CA-OG 3.31Å; H757-S764 WeakPolarHBondContact CB-OG 3.31Å; Q759-S764 PolarHBondContact NE2-OG 3.48Å
765	I	91.4	Very high	92.9	Very high	30 Å²	30	41.2 Å²	41.2	15%	0.154	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.8	-172.4	-54.2	176.8	0	0	0	110.6	F702 H757 F758 L760 R763 L767 L770	F702-I765 HydrophobicContact CE1-CD1 4.05Å; F702-I765 HydrophobicContact CE1-CG2 3.86Å; F702-I765 HydrophobicContact CE2-CD1 4.28Å; F702-I765 HydrophobicContact CZ-CD1 3.93Å; F702-I765 HydrophobicContact CZ-CG2 3.71Å; H757-I765 CarbonylContact C-O 3.19Å; F758-I765 HydrophobicContact CD1-CD1 4.45Å; F758-I765 PolarHBondContact N-O 2.95Å; F758-I765 PolarHBondContact O-N 3.21Å; L760-I765 HydrophobicContact CB-CD1 3.91Å; L760-I765 HydrophobicContact CD2-CD1 4.31Å; R763-I765 HydrophobicContact CB-CG1 4.07Å; I765-L767 PolarHBondContact O-N 3.07Å; I765-L767 VanDerWaalsContact O-N 3.16Å; I765-L770 HydrophobicContact CG2-CD1 3.72Å
766	D	93.5	Very high	93.1	Very high	46 Å²	46	42.5 Å²	42.5	25%	0.246	21%	0.213	C	C	.	.			trans	-82.4	87.1	170.8	-166.8	-22.4	0	0	0	110.5	R756 N768 H769 L770	R756-D766 IonicContact CZ-OD2 3.61Å; R756-D766 IonicContact NE-OD1 3.6Å; R756-D766 PolarHBondContact NE-OD1 3.22Å; R756-D766 IonicContact NE-OD2 3.77Å; R756-D766 PolarHBondContact NE-OD2 2.93Å; R756-D766 IonicContact NH2-OD2 3.6Å; R756-D766 PolarHBondContact NH2-OD2 3.21Å; R756-D766 WeakPolarHBondContact O-CA 3.44Å; R756-D766 VanDerWaalsContact O-CB 3.31Å; R756-D766 WeakPolarHBondContact O-CB 3.22Å; D766-N768 VanDerWaalsContact C-N 3.31Å; D766-N768 PolarHBondContact O-N 3.37Å; D766-N768 VanDerWaalsContact OD1-CB 3.31Å; D766-N768 WeakPolarHBondContact OD1-CB 3.42Å; D766-N768 PolarHBondContact OD1-N 3.11Å; D766-H769 HydrophobicContact CB-CB 3.9Å; D766-H769 PolarHBondContact O-N 2.68Å; D766-H769 PolarHBondContact OD1-N 2.7Å; D766-L770 WeakPolarHBondContact O-CG 3.44Å; D766-L770 PolarHBondContact O-N 2.95Å; D766-L770 VanDerWaalsContact O-N 3.16Å
767	L	94.4	Very high	93.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-35.9	178.2	-177.8	62	0	0	0	111.8	F702 F705 V706 L709 L752 Q755 I765 H769 L770 L771	F702-L767 HydrophobicContact CZ-CD1 4.41Å; F705-L767 HydrophobicContact CE1-CD1 4.15Å; F705-L767 HydrophobicContact CE1-CD2 4.24Å; V706-L767 HydrophobicContact CG2-CD1 4.04Å; L709-L767 HydrophobicContact CD2-CD2 4.39Å; L752-L767 HydrophobicContact CD2-CD2 4.41Å; Q755-L767 HydrophobicContact CB-CB 4.1Å; Q755-L767 HydrophobicContact CB-CD2 4.32Å; Q755-L767 PolarHBondContact O-N 3.26Å; I765-L767 PolarHBondContact O-N 3.07Å; I765-L767 VanDerWaalsContact O-N 3.16Å; L767-H769 VanDerWaalsContact C-N 3.3Å; L767-H769 PolarHBondContact O-N 3.02Å; L767-L770 PolarHBondContact O-N 2.95Å; L767-L771 HydrophobicContact CD1-CD1 4.32Å; L767-L771 HydrophobicContact CD1-CG 4.09Å; L767-L771 HydrophobicContact CD2-CD1 4.5Å; L767-L771 HydrophobicContact CG-CD1 3.92Å; L767-L771 HydrophobicContact CG-CG 4.17Å; L767-L771 WeakPolarHBondContact O-CB 3.37Å; L767-L771 WeakPolarHBondContact O-CG 3.45Å; L767-L771 PolarHBondContact O-N 3.21Å
768	N	95.1	Very high	93.9	Very high	9 Å²	9	38.9 Å²	38.9	5%	0.048	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-45.7	174.1	-179.8	-75.2	0	0	0	110.8	M753 Q755 R756 D766 L771 T772 H818	M753-N768 VanDerWaalsContact O-CB 3.26Å; M753-N768 WeakPolarHBondContact O-CB 3.45Å; M753-N768 PolarHBondContact O-ND2 2.8Å; Q755-N768 PolarHBondContact O-N 2.96Å; R756-N768 VanDerWaalsContact CD-CB 3.47Å; D766-N768 VanDerWaalsContact C-N 3.31Å; D766-N768 PolarHBondContact O-N 3.37Å; D766-N768 VanDerWaalsContact OD1-CB 3.31Å; D766-N768 WeakPolarHBondContact OD1-CB 3.42Å; D766-N768 PolarHBondContact OD1-N 3.11Å; N768-L771 PolarHBondContact O-N 3.14Å; N768-T772 VanDerWaalsContact O-CB 3.3Å; N768-T772 WeakPolarHBondContact O-CB 3.35Å; N768-T772 PolarHBondContact O-N 2.92Å; N768-T772 PolarHBondContact O-OG1 3.35Å; N768-H818 PolarHBondContact ND2-O 2.98Å
769	H	95.8	Very high	94.3	Very high	98 Å²	98	38.9 Å²	38.9	45%	0.454	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-47.6	178.2	-173.9	69.3	0	0	0	112	D766 L767 L771 T772 Q773	D766-H769 HydrophobicContact CB-CB 3.9Å; D766-H769 PolarHBondContact O-N 2.68Å; D766-H769 PolarHBondContact OD1-N 2.7Å; L767-H769 VanDerWaalsContact C-N 3.3Å; L767-H769 PolarHBondContact O-N 3.02Å; H769-L771 VanDerWaalsContact C-N 3.35Å; H769-L771 PolarHBondContact O-N 2.85Å; H769-T772 WeakPolarHBondContact O-CB 3.39Å; H769-T772 PolarHBondContact O-N 3.38Å; H769-Q773 PolarHBondContact CD2-NE2 3.5Å; H769-Q773 PolarHBondContact NE2-NE2 3.41Å; H769-Q773 WeakPolarHBondContact O-CG 3.44Å; H769-Q773 PolarHBondContact O-N 3.08Å
770	L	96.8	Very high	94.7	Very high	49 Å²	49	39.9 Å²	39.9	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-40	179	-65.2	176.6	0	0	0	112.6	F702 V706 I765 D766 L767 R774	F702-L770 HydrophobicContact CE1-CD1 3.77Å; F702-L770 HydrophobicContact CZ-CD1 4.33Å; V706-L770 HydrophobicContact CG1-CB 3.98Å; V706-L770 HydrophobicContact CG2-CD1 4.28Å; I765-L770 HydrophobicContact CG2-CD1 3.72Å; D766-L770 WeakPolarHBondContact O-CG 3.44Å; D766-L770 PolarHBondContact O-N 2.95Å; D766-L770 VanDerWaalsContact O-N 3.16Å; L767-L770 PolarHBondContact O-N 2.95Å; L770-R774 PolarHBondContact O-N 2.93Å
771	L	96.9	Very high	95	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-43.6	174.3	-70	175.3	0	0	0	111.2	L709 I713 M753 L767 N768 H769 Q773 R774 I775 L819	L709-L771 HydrophobicContact CB-CD2 4.49Å; L709-L771 HydrophobicContact CD2-CD1 4.36Å; L709-L771 HydrophobicContact CD2-CD2 4.13Å; L709-L771 HydrophobicContact CG-CD2 4.1Å; I713-L771 HydrophobicContact CD1-CD1 3.95Å; I713-L771 HydrophobicContact CD1-CD2 4.12Å; M753-L771 HydrophobicContact CG-CD1 4.02Å; L767-L771 HydrophobicContact CD1-CD1 4.32Å; L767-L771 HydrophobicContact CD1-CG 4.09Å; L767-L771 HydrophobicContact CD2-CD1 4.5Å; L767-L771 HydrophobicContact CG-CD1 3.92Å; L767-L771 HydrophobicContact CG-CG 4.17Å; L767-L771 WeakPolarHBondContact O-CB 3.37Å; L767-L771 WeakPolarHBondContact O-CG 3.45Å; L767-L771 PolarHBondContact O-N 3.21Å; N768-L771 PolarHBondContact O-N 3.14Å; H769-L771 VanDerWaalsContact C-N 3.35Å; H769-L771 PolarHBondContact O-N 2.85Å; L771-Q773 PolarHBondContact O-N 3.02Å; L771-R774 PolarHBondContact O-N 3.42Å; L771-I775 HydrophobicContact CB-CD1 4.37Å; L771-I775 VanDerWaalsContact O-CB 3.29Å; L771-I775 WeakPolarHBondContact O-CB 3.45Å; L771-I775 VanDerWaalsContact O-CG1 3.25Å; L771-I775 WeakPolarHBondContact O-CG1 3.32Å; L771-I775 PolarHBondContact O-N 2.61Å; L771-L819 HydrophobicContact CB-CD2 4.34Å
772	T	97.4	Very high	95.3	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-47.5	177.9	-62.4	0	0	0	0	111.4	N768 H769 R774 I775 N776 G821 L822	N768-T772 VanDerWaalsContact O-CB 3.3Å; N768-T772 WeakPolarHBondContact O-CB 3.35Å; N768-T772 PolarHBondContact O-N 2.92Å; N768-T772 PolarHBondContact O-OG1 3.35Å; H769-T772 WeakPolarHBondContact O-CB 3.39Å; H769-T772 PolarHBondContact O-N 3.38Å; T772-R774 PolarHBondContact O-N 3.39Å; T772-I775 PolarHBondContact O-N 2.86Å; T772-N776 WeakPolarHBondContact O-CB 3.23Å; T772-N776 PolarHBondContact O-N 2.89Å; T772-G821 VanDerWaalsContact CG2-O 3.3Å; T772-G821 WeakPolarHBondContact CG2-O 3.47Å; T772-L822 HydrophobicContact CG2-CD2 4.04Å; T772-L822 HydrophobicContact CG2-CG 4.35Å
773	Q	96.6	Very high	95.9	Very high	98 Å²	98	41.4 Å²	41.4	46%	0.458	21%	0.206	S	C	.	.	H	α-helix	trans	-55.9	-50.9	178	-71.9	-179.5	-9.8	0	0	111.9	H769 L771 V777	H769-Q773 PolarHBondContact CD2-NE2 3.5Å; H769-Q773 PolarHBondContact NE2-NE2 3.41Å; H769-Q773 WeakPolarHBondContact O-CG 3.44Å; H769-Q773 PolarHBondContact O-N 3.08Å; L771-Q773 PolarHBondContact O-N 3.02Å; Q773-V777 WeakPolarHBondContact O-CG2 3.27Å; Q773-V777 PolarHBondContact O-N 3.02Å
774	R	97	Very high	96.2	Very high	89 Å²	89	39.3 Å²	39.3	34%	0.336	20%	0.202	S	C	.	.	H	α-helix	trans	-70	-36.6	-177.9	-67.6	-177.2	-176.8	-120.3	7.9	112.7	C707 S710 L770 L771 T772 V777 A778	C707-R774 VanDerWaalsContact CA-NH1 3.32Å; S710-R774 VanDerWaalsContact OG-CD 3.3Å; S710-R774 WeakPolarHBondContact OG-CD 3.38Å; L770-R774 PolarHBondContact O-N 2.93Å; L771-R774 PolarHBondContact O-N 3.42Å; T772-R774 PolarHBondContact O-N 3.39Å; R774-V777 PolarHBondContact O-N 3.13Å; R774-A778 PolarHBondContact O-N 3.49Å
775	I	97.6	Very high	96.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.3	-37.5	178.8	-71.8	168.4	0	0	0	111.1	I713 L771 T772 V777 A778 L779 L815 L819 L822	I713-I775 HydrophobicContact CB-CD1 4.42Å; I713-I775 HydrophobicContact CG2-CD1 3.76Å; L771-I775 HydrophobicContact CB-CD1 4.37Å; L771-I775 VanDerWaalsContact O-CB 3.29Å; L771-I775 WeakPolarHBondContact O-CB 3.45Å; L771-I775 VanDerWaalsContact O-CG1 3.25Å; L771-I775 WeakPolarHBondContact O-CG1 3.32Å; L771-I775 PolarHBondContact O-N 2.61Å; T772-I775 PolarHBondContact O-N 2.86Å; I775-V777 VanDerWaalsContact C-N 3.34Å; I775-V777 PolarHBondContact O-N 3.06Å; I775-A778 PolarHBondContact O-N 3.1Å; I775-L779 HydrophobicContact CG2-CD1 3.99Å; I775-L779 HydrophobicContact CG2-CG 4.42Å; I775-L779 WeakPolarHBondContact O-CB 3.46Å; I775-L779 WeakPolarHBondContact O-CG 3.31Å; I775-L779 PolarHBondContact O-N 3.19Å; I775-L815 HydrophobicContact CD1-CD2 4.42Å; I775-L815 HydrophobicContact CG2-CD1 3.77Å; I775-L819 HydrophobicContact CD1-CD1 3.38Å; I775-L819 HydrophobicContact CG2-CD1 4.48Å; I775-L822 HydrophobicContact CB-CD2 4.28Å; I775-L822 HydrophobicContact CG2-CD2 3.8Å
776	N	97	Very high	96.7	Very high	26 Å²	26	35.2 Å²	35.2	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-56.5	-48	170.7	-91.8	-16.4	0	0	0	111.2	T772 A778 L779 L780 L822 T823	T772-N776 WeakPolarHBondContact O-CB 3.23Å; T772-N776 PolarHBondContact O-N 2.89Å; N776-A778 VanDerWaalsContact C-N 3.33Å; N776-A778 PolarHBondContact O-N 2.98Å; N776-L779 PolarHBondContact O-N 2.85Å; N776-L780 WeakPolarHBondContact O-CB 3.34Å; N776-L780 PolarHBondContact O-N 3.33Å; N776-L822 WeakPolarHBondContact OD1-CD2 3.45Å; N776-T823 PolarHBondContact ND2-N 3.1Å; N776-T823 PolarHBondContact ND2-OG1 3.44Å; N776-T823 PolarHBondContact OD1-N 3.3Å; N776-T823 VanDerWaalsContact OD1-N 3.1Å
777	V	97.5	Very high	96.9	Very high	100 Å²	100	33 Å²	33	61%	0.606	16%	0.163	S	C	*	.	H	α-helix	trans	-61.1	-41.6	176.5	175.2	0	0	0	0	111.5	Q773 R774 I775 L780 K781	Q773-V777 WeakPolarHBondContact O-CG2 3.27Å; Q773-V777 PolarHBondContact O-N 3.02Å; R774-V777 PolarHBondContact O-N 3.13Å; I775-V777 VanDerWaalsContact C-N 3.34Å; I775-V777 PolarHBondContact O-N 3.06Å; V777-L780 PolarHBondContact O-N 3.37Å; V777-K781 VanDerWaalsContact O-CB 3.3Å; V777-K781 WeakPolarHBondContact O-CB 3.37Å; V777-K781 PolarHBondContact O-N 2.99Å
778	A	97.3	Very high	96.9	Very high	6 Å²	6	35 Å²	35	5%	0.05	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-39.3	178.4	0	0	0	0	0	113	F714 R774 I775 N776 S782 Y892	F714-A778 HydrophobicContact CD1-CB 4.1Å; F714-A778 HydrophobicContact CD2-CB 3.84Å; F714-A778 HydrophobicContact CE1-CB 4.29Å; F714-A778 HydrophobicContact CE2-CB 4.03Å; F714-A778 HydrophobicContact CG-CB 3.88Å; F714-A778 HydrophobicContact CZ-CB 4.26Å; R774-A778 PolarHBondContact O-N 3.49Å; I775-A778 PolarHBondContact O-N 3.1Å; N776-A778 VanDerWaalsContact C-N 3.33Å; N776-A778 PolarHBondContact O-N 2.98Å; A778-S782 WeakPolarHBondContact O-CB 3.35Å; A778-S782 PolarHBondContact O-N 3.25Å; A778-Y892 HydrophobicContact CB-CE1 4.21Å
779	L	97.8	Very high	96.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-66.2	-47	175.1	-77.5	165.7	0	0	0	111.4	F714 I775 N776 K781 S782 L783 H812 L822 L828	F714-L779 HydrophobicContact CD2-CG 4.49Å; F714-L779 HydrophobicContact CE2-CD2 3.9Å; F714-L779 HydrophobicContact CE2-CG 4.05Å; I775-L779 HydrophobicContact CG2-CD1 3.99Å; I775-L779 HydrophobicContact CG2-CG 4.42Å; I775-L779 WeakPolarHBondContact O-CB 3.46Å; I775-L779 WeakPolarHBondContact O-CG 3.31Å; I775-L779 PolarHBondContact O-N 3.19Å; N776-L779 PolarHBondContact O-N 2.85Å; L779-K781 VanDerWaalsContact C-N 3.33Å; L779-K781 PolarHBondContact O-N 3.06Å; L779-S782 WeakPolarHBondContact O-CB 3.36Å; L779-S782 PolarHBondContact O-N 2.95Å; L779-S782 VanDerWaalsContact O-N 3.11Å; L779-L783 WeakPolarHBondContact O-CG 3.25Å; L779-L783 PolarHBondContact O-N 3.07Å; L779-H812 HydrophobicContact CD1-CB 4.37Å; L779-H812 HydrophobicContact CD2-CB 4.43Å; L779-L822 HydrophobicContact CD1-CD2 4.42Å; L779-L828 HydrophobicContact CB-CD1 4.27Å; L779-L828 HydrophobicContact CD1-CD1 4.47Å
780	L	97.7	Very high	96.9	Very high	43 Å²	43	33.2 Å²	33.2	23%	0.225	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-47.6	176	-176.7	66.2	0	0	0	110.8	N776 V777 S782 L783 D784 L828 E831 A832	N776-L780 WeakPolarHBondContact O-CB 3.34Å; N776-L780 PolarHBondContact O-N 3.33Å; V777-L780 PolarHBondContact O-N 3.37Å; L780-S782 VanDerWaalsContact C-N 3.31Å; L780-S782 PolarHBondContact O-N 2.98Å; L780-L783 PolarHBondContact O-N 2.96Å; L780-D784 WeakPolarHBondContact O-CB 3.31Å; L780-D784 PolarHBondContact O-N 2.95Å; L780-L828 HydrophobicContact CB-CD2 4.35Å; L780-L828 HydrophobicContact CD1-CD2 4.48Å; L780-L828 WeakPolarHBondContact CD1-O 3.41Å; L780-E831 HydrophobicContact CD1-CB 3.97Å; L780-E831 HydrophobicContact CD1-CG 3.92Å; L780-E831 HydrophobicContact CD2-CG 4.49Å; L780-E831 WeakPolarHBondContact CD2-OE1 3.33Å; L780-A832 HydrophobicContact CD1-CB 4.04Å
781	K	97.4	Very high	96.8	Very high	100 Å²	100	33.6 Å²	33.6	44%	0.435	17%	0.165	S	C	.	.	H	α-helix	trans	-60.2	-38.3	175.2	-177.1	171.8	-179	173.8	0	112.6	V777 L779 L785 Y892	V777-K781 VanDerWaalsContact O-CB 3.3Å; V777-K781 WeakPolarHBondContact O-CB 3.37Å; V777-K781 PolarHBondContact O-N 2.99Å; L779-K781 VanDerWaalsContact C-N 3.33Å; L779-K781 PolarHBondContact O-N 3.06Å; K781-L785 HydrophobicContact CG-CD1 4Å; K781-L785 HydrophobicContact CG-CG 4.45Å; K781-L785 WeakPolarHBondContact O-CB 3.49Å; K781-L785 VanDerWaalsContact O-CG 3.23Å; K781-L785 WeakPolarHBondContact O-CG 3.47Å; K781-L785 PolarHBondContact O-N 3.4Å; K781-Y892 HydrophobicContact CB-CE1 4.33Å; K781-Y892 HydrophobicContact CD-CD1 4.46Å; K781-Y892 HydrophobicContact CD-CE1 3.95Å; K781-Y892 HydrophobicContact CD-CE2 4.49Å; K781-Y892 HydrophobicContact CG-CD1 4.29Å; K781-Y892 HydrophobicContact CG-CE1 4.19Å
782	S	97.6	Very high	96.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.3	-37.1	177.2	-172.3	0	0	0	0	112.7	K718 A778 L779 L780 A786 N808 Y892	K718-S782 WeakPolarHBondContact CE-OG 3.19Å; K718-S782 PolarHBondContact NZ-OG 3.27Å; A778-S782 WeakPolarHBondContact O-CB 3.35Å; A778-S782 PolarHBondContact O-N 3.25Å; L779-S782 WeakPolarHBondContact O-CB 3.36Å; L779-S782 PolarHBondContact O-N 2.95Å; L779-S782 VanDerWaalsContact O-N 3.11Å; L780-S782 VanDerWaalsContact C-N 3.31Å; L780-S782 PolarHBondContact O-N 2.98Å; S782-A786 WeakPolarHBondContact O-CB 3.29Å; S782-A786 PolarHBondContact O-N 2.92Å; S782-A786 VanDerWaalsContact O-N 3.08Å; S782-N808 WeakPolarHBondContact CB-OD1 3.4Å; S782-N808 PolarHBondContact OG-ND2 2.93Å; S782-N808 PolarHBondContact OG-OD1 3.04Å; S782-Y892 PolarHBondContact OG-O 2.97Å
783	L	97.9	Very high	96.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-71.2	-43.6	175	-68.8	170.9	0	0	0	111.4	L779 L780 L785 A786 I787 N808 F825 L828 F829 A832	L779-L783 WeakPolarHBondContact O-CG 3.25Å; L779-L783 PolarHBondContact O-N 3.07Å; L780-L783 PolarHBondContact O-N 2.96Å; L783-L785 PolarHBondContact O-N 2.89Å; L783-A786 WeakPolarHBondContact O-CB 3.11Å; L783-A786 PolarHBondContact O-N 3.46Å; L783-A786 VanDerWaalsContact O-N 3.15Å; L783-I787 WeakPolarHBondContact O-CG1 2.95Å; L783-I787 PolarHBondContact O-N 3.18Å; L783-N808 HydrophobicContact CD2-CB 3.61Å; L783-N808 HydrophobicContact CG-CB 4.37Å; L783-F825 HydrophobicContact CD1-CE2 4.18Å; L783-F825 HydrophobicContact CD1-CZ 4.47Å; L783-F825 HydrophobicContact CD2-CE2 4.14Å; L783-F825 HydrophobicContact CD2-CZ 3.98Å; L783-L828 HydrophobicContact CD1-CB 3.98Å; L783-F829 HydrophobicContact CD1-CB 4.36Å; L783-F829 HydrophobicContact CD2-CD2 4.27Å; L783-A832 HydrophobicContact CB-CB 3.67Å
784	D	96.8	Very high	96.1	Very high	52 Å²	52	32.3 Å²	32.3	28%	0.278	17%	0.165	S	C	.	.	H	α-helix	trans	-58.7	-47.1	174.9	177.4	59.4	0	0	0	111.5	L780 A786 I787 N788 A832 R842	L780-D784 WeakPolarHBondContact O-CB 3.31Å; L780-D784 PolarHBondContact O-N 2.95Å; D784-A786 VanDerWaalsContact C-N 3.3Å; D784-A786 PolarHBondContact O-N 3.24Å; D784-I787 PolarHBondContact O-N 3.23Å; D784-N788 WeakPolarHBondContact O-CB 3.25Å; D784-N788 PolarHBondContact O-N 3.24Å; D784-N788 PolarHBondContact O-ND2 3.36Å; D784-N788 PolarHBondContact OD1-ND2 3.18Å; D784-N788 PolarHBondContact OD2-ND2 3.24Å; D784-A832 HydrophobicContact CB-CB 4.48Å; D784-R842 IonicContact OD1-CZ 3.91Å; D784-R842 IonicContact OD1-NH1 3.43Å; D784-R842 PolarHBondContact OD1-NH1 2.92Å; D784-R842 IonicContact OD1-NH2 2.8Å
785	L	96.7	Very high	95.9	Very high	12 Å²	12	28.1 Å²	28.1	6%	0.063	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-34.5	175	-73.5	169.5	0	0	0	113	K781 L783 H789 P886 A888 Y892 F893	K781-L785 HydrophobicContact CG-CD1 4Å; K781-L785 HydrophobicContact CG-CG 4.45Å; K781-L785 WeakPolarHBondContact O-CB 3.49Å; K781-L785 VanDerWaalsContact O-CG 3.23Å; K781-L785 WeakPolarHBondContact O-CG 3.47Å; K781-L785 PolarHBondContact O-N 3.4Å; L783-L785 PolarHBondContact O-N 2.89Å; L785-H789 VanDerWaalsContact O-CB 3.31Å; L785-H789 WeakPolarHBondContact O-CB 3.35Å; L785-H789 PolarHBondContact O-N 3.28Å; L785-P886 HydrophobicContact CD2-CB 4.04Å; L785-P886 HydrophobicContact CD2-CG 3.69Å; L785-A888 HydrophobicContact CD1-CB 3.49Å; L785-A888 VanDerWaalsContact CD1-CB 3.49Å; L785-A888 HydrophobicContact CD2-CB 4.13Å; L785-A888 HydrophobicContact CG-CB 4.46Å; L785-Y892 HydrophobicContact CD1-CD2 4.38Å; L785-Y892 HydrophobicContact CD1-CG 3.97Å; L785-F893 HydrophobicContact CB-CE1 4.25Å
786	A	96.5	Very high	95.8	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-43.2	174.9	0	0	0	0	0	111.5	S782 L783 D784 H789 F790 L801 L804	S782-A786 WeakPolarHBondContact O-CB 3.29Å; S782-A786 PolarHBondContact O-N 2.92Å; S782-A786 VanDerWaalsContact O-N 3.08Å; L783-A786 WeakPolarHBondContact O-CB 3.11Å; L783-A786 PolarHBondContact O-N 3.46Å; L783-A786 VanDerWaalsContact O-N 3.15Å; D784-A786 VanDerWaalsContact C-N 3.3Å; D784-A786 PolarHBondContact O-N 3.24Å; A786-H789 PolarHBondContact O-N 2.83Å; A786-F790 PolarHBondContact O-N 3.47Å; A786-L801 HydrophobicContact CB-CD1 4.11Å; A786-L801 WeakPolarHBondContact O-CD1 3.37Å; A786-L804 HydrophobicContact CB-CB 4.4Å; A786-L804 HydrophobicContact CB-CD2 3.4Å; A786-L804 HydrophobicContact CB-CG 3.79Å
787	I	96.7	Very high	95.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.2	-44.4	179.1	-61.7	171.8	0	0	0	110.8	L783 D784 H789 F790 E791 L801 F829 A832 N833 R842 I843	L783-I787 WeakPolarHBondContact O-CG1 2.95Å; L783-I787 PolarHBondContact O-N 3.18Å; D784-I787 PolarHBondContact O-N 3.23Å; I787-H789 PolarHBondContact O-N 2.98Å; I787-F790 WeakPolarHBondContact O-CA 3.41Å; I787-F790 WeakPolarHBondContact O-CB 3.29Å; I787-F790 PolarHBondContact O-N 3.42Å; I787-E791 HydrophobicContact CG2-CG 4.47Å; I787-E791 PolarHBondContact O-N 3.4Å; I787-L801 HydrophobicContact CG1-CD1 4.41Å; I787-F829 HydrophobicContact CD1-CE2 4.48Å; I787-A832 HydrophobicContact CD1-CB 4.1Å; I787-N833 HydrophobicContact CD1-CB 3.81Å; I787-R842 HydrophobicContact CG2-CB 3.83Å; I787-I843 HydrophobicContact CD1-CD1 4.28Å; I787-I843 HydrophobicContact CD1-CG1 4.47Å; I787-I843 HydrophobicContact CG1-CD1 4.21Å; I787-I843 HydrophobicContact CG1-CG1 4.24Å; I787-I843 HydrophobicContact CG2-CG1 4.17Å
788	N	95.3	Very high	95.7	Very high	42 Å²	42	24 Å²	24	23%	0.225	12%	0.123	C	C	.	.	H	α-helix	trans	-56.5	-39.3	173.3	-75.6	-47.9	0	0	0	111.7	D784 F790 E791 A792 R842 P886	D784-N788 WeakPolarHBondContact O-CB 3.25Å; D784-N788 PolarHBondContact O-N 3.24Å; D784-N788 PolarHBondContact O-ND2 3.36Å; D784-N788 PolarHBondContact OD1-ND2 3.18Å; D784-N788 PolarHBondContact OD2-ND2 3.24Å; N788-F790 VanDerWaalsContact C-N 3.31Å; N788-F790 PolarHBondContact O-N 2.95Å; N788-E791 PolarHBondContact O-N 3.25Å; N788-A792 WeakPolarHBondContact O-CB 3.4Å; N788-A792 PolarHBondContact O-N 3.04Å; N788-R842 VanDerWaalsContact CG-NH2 3.27Å; N788-R842 PolarHBondContact OD1-NH2 2.96Å; N788-P886 HydrophobicContact CB-CG 3.78Å
789	H	94.1	Very high	95.7	Very high	67 Å²	67	24.4 Å²	24.4	31%	0.31	12%	0.124	S	C	.	.	H	α-helix	trans	-65.4	-35.7	176.5	-169.7	73.3	0	0	0	112.1	L785 A786 I787 N793	L785-H789 VanDerWaalsContact O-CB 3.31Å; L785-H789 WeakPolarHBondContact O-CB 3.35Å; L785-H789 PolarHBondContact O-N 3.28Å; A786-H789 PolarHBondContact O-N 2.83Å; I787-H789 PolarHBondContact O-N 2.98Å; H789-N793 PolarHBondContact O-ND2 3.31Å
790	F	95.6	Very high	95.6	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-68.9	-43.1	173.4	175.2	-120.9	0	0	0	112.1	A786 I787 N788 A792 N793 E797 I798 L801 I843 H846 V847	A786-F790 PolarHBondContact O-N 3.47Å; I787-F790 WeakPolarHBondContact O-CA 3.41Å; I787-F790 WeakPolarHBondContact O-CB 3.29Å; I787-F790 PolarHBondContact O-N 3.42Å; N788-F790 VanDerWaalsContact C-N 3.31Å; N788-F790 PolarHBondContact O-N 2.95Å; F790-A792 PolarHBondContact O-N 2.86Å; F790-N793 PolarHBondContact O-N 3.22Å; F790-N793 VanDerWaalsContact O-O 3.09Å; F790-E797 HydrophobicContact CD2-CB 4.29Å; F790-I798 HydrophobicContact CD2-CB 4.5Å; F790-I798 HydrophobicContact CE2-CB 3.72Å; F790-I798 HydrophobicContact CE2-CG1 4.21Å; F790-I798 HydrophobicContact CZ-CB 4.07Å; F790-I798 HydrophobicContact CZ-CD1 4.27Å; F790-I798 HydrophobicContact CZ-CG1 4.15Å; F790-L801 HydrophobicContact CB-CB 4.23Å; F790-L801 HydrophobicContact CB-CD1 4.28Å; F790-L801 HydrophobicContact CB-CD2 3.84Å; F790-L801 HydrophobicContact CB-CG 4.34Å; F790-L801 HydrophobicContact CD1-CD2 3.62Å; F790-L801 HydrophobicContact CD2-CB 4.49Å; F790-L801 HydrophobicContact CD2-CD2 4.31Å; F790-L801 HydrophobicContact CE1-CD2 4.22Å; F790-L801 HydrophobicContact CG-CB 4.39Å; F790-L801 HydrophobicContact CG-CD2 3.66Å; F790-I843 HydrophobicContact CD1-CG2 4.49Å; F790-I843 HydrophobicContact CE1-CG2 4.03Å; F790-H846 HydrophobicContact CD1-CB 4.43Å; F790-H846 AromaticContact CD1-CD2 3.7Å; F790-H846 HydrophobicContact CE1-CB 4.09Å; F790-H846 AromaticContact CE1-CD2 3.52Å; F790-H846 AromaticContact CZ-CD2 3.77Å; F790-H846 PolarHBondContact O-CD2 2.96Å; F790-H846 PolarHBondContact O-NE2 3.01Å; F790-H846 VanDerWaalsContact O-NE2 3.07Å; F790-V847 HydrophobicContact CE1-CG2 4.12Å; F790-V847 HydrophobicContact CZ-CG2 3.91Å
791	E	94.9	Very high	95.6	Very high	57 Å²	57	23.1 Å²	23.1	27%	0.266	12%	0.119	S	C	.	.	H	α-helix	trans	-61	-30.2	177.2	-71.9	171.6	157.7	0	0	112.9	I787 N788 N793 R842 H846	I787-E791 HydrophobicContact CG2-CG 4.47Å; I787-E791 PolarHBondContact O-N 3.4Å; N788-E791 PolarHBondContact O-N 3.25Å; E791-N793 VanDerWaalsContact C-N 3.28Å; E791-N793 PolarHBondContact O-N 2.92Å; E791-R842 VanDerWaalsContact OE1-CB 3.31Å; E791-R842 WeakPolarHBondContact OE1-CB 3.24Å; E791-R842 IonicContact OE1-CZ 2.62Å; E791-R842 IonicContact OE1-NE 2.76Å; E791-R842 PolarHBondContact OE1-NE 2.88Å; E791-R842 IonicContact OE1-NH2 2.7Å; E791-R842 IonicContact OE2-CZ 3.14Å; E791-R842 IonicContact OE2-NE 2.87Å; E791-R842 PolarHBondContact OE2-NE 3.13Å; E791-R842 IonicContact OE2-NH2 3.35Å; E791-R842 PolarHBondContact OE2-NH2 3.36Å; E791-H846 WeakPolarHBondContact CA-NE2 3.5Å; E791-H846 HydrophobicContact CG-CB 4.11Å; E791-H846 PolarHBondContact O-CE1 3.16Å; E791-H846 PolarHBondContact O-NE2 2.87Å
792	A	93.1	Very high	95.6	Very high	13 Å²	13	19.7 Å²	19.7	11%	0.107	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-7.9	175.7	0	0	0	0	0	114.3	N788 F790 R882 D883 P885	N788-A792 WeakPolarHBondContact O-CB 3.4Å; N788-A792 PolarHBondContact O-N 3.04Å; F790-A792 PolarHBondContact O-N 2.86Å; A792-R882 WeakPolarHBondContact O-CB 3.24Å; A792-R882 VanDerWaalsContact O-CD 3.27Å; A792-R882 WeakPolarHBondContact O-CD 3.42Å; A792-D883 WeakPolarHBondContact CB-O 3.2Å; A792-P885 HydrophobicContact CB-CB 3.86Å; A792-P885 HydrophobicContact CB-CG 4.48Å
793	N	91.6	Very high	95.6	Very high	47 Å²	47	20 Å²	20	25%	0.251	11%	0.107	S	C	.	.	S	Bend	trans	-127.5	171.6	-172.8	-73.4	-69.5	0	0	0	112.9	H789 F790 E791 E797 H846 R882	H789-N793 PolarHBondContact O-ND2 3.31Å; F790-N793 PolarHBondContact O-N 3.22Å; F790-N793 VanDerWaalsContact O-O 3.09Å; E791-N793 VanDerWaalsContact C-N 3.28Å; E791-N793 PolarHBondContact O-N 2.92Å; N793-E797 HydrophobicContact CB-CB 3.96Å; N793-E797 HydrophobicContact CB-CG 3.53Å; N793-H846 PolarHBondContact O-NE2 3.26Å; N793-R882 PolarHBondContact O-NE 3.15Å
794	S	91.3	Very high	95.5	Very high	19 Å²	19	20.1 Å²	20.1	13%	0.133	11%	0.108	C	C	.	.			trans	-72.6	162.7	178.7	76.6	0	0	0	0	112.8	T796 E797 E850	S794-T796 PolarHBondContact O-N 3.33Å; S794-T796 PolarHBondContact OG-OG1 2.96Å; S794-E797 PolarHBondContact O-N 3.23Å; S794-E850 VanDerWaalsContact CA-OE2 3.29Å; S794-E850 WeakPolarHBondContact CA-OE2 3.33Å
795	I	94.7	Very high	95.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-51.3	-23	179.2	-167.1	166	0	0	0	115.1	E797 I798 V847 E850 L851 L914 L922	I795-E797 PolarHBondContact O-N 2.96Å; I795-I798 WeakPolarHBondContact O-CB 3.38Å; I795-I798 VanDerWaalsContact O-CG2 3.24Å; I795-I798 WeakPolarHBondContact O-CG2 3.46Å; I795-I798 PolarHBondContact O-N 2.9Å; I795-V847 HydrophobicContact CD1-CG1 4.18Å; I795-E850 HydrophobicContact CB-CB 3.94Å; I795-E850 HydrophobicContact CB-CG 4.38Å; I795-E850 PolarHBondContact N-OE2 2.8Å; I795-L851 HydrophobicContact CD1-CD2 3.82Å; I795-L851 HydrophobicContact CD1-CG 4.1Å; I795-L914 HydrophobicContact CD1-CD1 4.34Å; I795-L914 HydrophobicContact CG1-CD1 4.37Å; I795-L914 HydrophobicContact CG2-CD1 3.67Å; I795-L922 HydrophobicContact CD1-CD2 4.47Å
796	T	95	Very high	95.5	Very high	3 Å²	3	22 Å²	22	2%	0.018	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-66.1	-23.9	178.2	55.7	0	0	0	0	113.3	S794 I798 F913 L914 H918	S794-T796 PolarHBondContact O-N 3.33Å; S794-T796 PolarHBondContact OG-OG1 2.96Å; T796-I798 PolarHBondContact O-N 2.91Å; T796-F913 WeakPolarHBondContact CG2-O 3.48Å; T796-L914 HydrophobicContact CG2-CB 4.47Å; T796-H918 PolarHBondContact O-CD2 3.09Å
797	E	95.2	Very high	95.6	Very high	38 Å²	38	21.9 Å²	21.9	18%	0.178	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-74	-2	177.4	-72	-54.9	138.8	0	0	113.7	F790 N793 S794 I795 V799 A800 L801	F790-E797 HydrophobicContact CD2-CB 4.29Å; N793-E797 HydrophobicContact CB-CB 3.96Å; N793-E797 HydrophobicContact CB-CG 3.53Å; S794-E797 PolarHBondContact O-N 3.23Å; I795-E797 PolarHBondContact O-N 2.96Å; E797-V799 PolarHBondContact O-N 3.39Å; E797-V799 VanDerWaalsContact O-N 3.16Å; E797-A800 WeakPolarHBondContact O-CB 3.37Å; E797-A800 PolarHBondContact O-N 2.75Å; E797-A800 VanDerWaalsContact OE2-CB 3.3Å; E797-A800 WeakPolarHBondContact OE2-CB 3.31Å; E797-L801 PolarHBondContact O-N 3.44Å
798	I	97.5	Very high	95.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.8	-28.4	177	-162.7	168.9	0	0	0	112.8	F790 I795 T796 L801 E802 V847 H918 L922 L925	F790-I798 HydrophobicContact CD2-CB 4.5Å; F790-I798 HydrophobicContact CE2-CB 3.72Å; F790-I798 HydrophobicContact CE2-CG1 4.21Å; F790-I798 HydrophobicContact CZ-CB 4.07Å; F790-I798 HydrophobicContact CZ-CD1 4.27Å; F790-I798 HydrophobicContact CZ-CG1 4.15Å; I795-I798 WeakPolarHBondContact O-CB 3.38Å; I795-I798 VanDerWaalsContact O-CG2 3.24Å; I795-I798 WeakPolarHBondContact O-CG2 3.46Å; I795-I798 PolarHBondContact O-N 2.9Å; T796-I798 PolarHBondContact O-N 2.91Å; I798-L801 PolarHBondContact O-N 2.91Å; I798-E802 PolarHBondContact O-N 3.28Å; I798-V847 HydrophobicContact CD1-CG2 4.06Å; I798-H918 HydrophobicContact CG2-CB 4.4Å; I798-L922 HydrophobicContact CD1-CB 4.35Å; I798-L922 HydrophobicContact CD1-CD2 3.29Å; I798-L922 HydrophobicContact CD1-CG 3.7Å; I798-L925 HydrophobicContact CD1-CD1 4.16Å; I798-L925 HydrophobicContact CG1-CD1 3.72Å
799	V	97.5	Very high	95.8	Very high	13 Å²	13	23.9 Å²	23.9	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-69.5	-39.8	176.3	-175.8	0	0	0	0	110.7	E797 E802 G803 Y907 Y910 H918	E797-V799 PolarHBondContact O-N 3.39Å; E797-V799 VanDerWaalsContact O-N 3.16Å; V799-E802 PolarHBondContact O-N 3.43Å; V799-G803 PolarHBondContact O-N 3.29Å; V799-G803 VanDerWaalsContact O-N 3.1Å; V799-Y907 HydrophobicContact CG1-CD1 4.13Å; V799-Y907 HydrophobicContact CG1-CE1 4.16Å; V799-Y910 HydrophobicContact CB-CG 4.46Å; V799-Y910 HydrophobicContact CG1-CD1 4.36Å; V799-Y910 HydrophobicContact CG1-CD2 4.12Å; V799-Y910 HydrophobicContact CG1-CE2 4.36Å; V799-Y910 HydrophobicContact CG1-CG 4.12Å; V799-H918 HydrophobicContact CG2-CB 4.45Å
800	A	95.7	Very high	96	Very high	11 Å²	11	22.1 Å²	22.1	9%	0.091	11%	0.113	C	C	.	.	H	α-helix	trans	-68.4	-39.8	175.1	0	0	0	0	0	111.2	E797 G803 L804 Y907	E797-A800 WeakPolarHBondContact O-CB 3.37Å; E797-A800 PolarHBondContact O-N 2.75Å; E797-A800 VanDerWaalsContact OE2-CB 3.3Å; E797-A800 WeakPolarHBondContact OE2-CB 3.31Å; A800-G803 PolarHBondContact O-N 2.99Å; A800-L804 WeakPolarHBondContact O-CB 3.41Å; A800-L804 PolarHBondContact O-N 3.19Å; A800-Y907 HydrophobicContact CB-CD1 4.22Å; A800-Y907 HydrophobicContact CB-CD2 4.18Å; A800-Y907 HydrophobicContact CB-CG 3.85Å
801	L	97.2	Very high	96.1	Very high	6 Å²	6	22 Å²	22	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-57.8	-49.2	172.7	174.1	65	0	0	0	111.5	A786 I787 F790 E797 I798 G803 L804 V805 I843 L925	A786-L801 HydrophobicContact CB-CD1 4.11Å; A786-L801 WeakPolarHBondContact O-CD1 3.37Å; I787-L801 HydrophobicContact CG1-CD1 4.41Å; F790-L801 HydrophobicContact CB-CB 4.23Å; F790-L801 HydrophobicContact CB-CD1 4.28Å; F790-L801 HydrophobicContact CB-CD2 3.84Å; F790-L801 HydrophobicContact CB-CG 4.34Å; F790-L801 HydrophobicContact CD1-CD2 3.62Å; F790-L801 HydrophobicContact CD2-CB 4.49Å; F790-L801 HydrophobicContact CD2-CD2 4.31Å; F790-L801 HydrophobicContact CE1-CD2 4.22Å; F790-L801 HydrophobicContact CG-CB 4.39Å; F790-L801 HydrophobicContact CG-CD2 3.66Å; E797-L801 PolarHBondContact O-N 3.44Å; I798-L801 PolarHBondContact O-N 2.91Å; L801-G803 VanDerWaalsContact C-N 3.29Å; L801-G803 PolarHBondContact O-N 3.41Å; L801-L804 PolarHBondContact O-N 2.91Å; L801-L804 VanDerWaalsContact O-N 3.13Å; L801-V805 HydrophobicContact CD1-CG2 4.05Å; L801-V805 HydrophobicContact CG-CG2 4.4Å; L801-V805 WeakPolarHBondContact O-CG2 3.32Å; L801-V805 PolarHBondContact O-N 3Å; L801-I843 HydrophobicContact CD2-CD1 3.94Å; L801-I843 HydrophobicContact CD2-CG1 3.93Å; L801-I843 HydrophobicContact CD2-CG2 4.2Å; L801-L925 HydrophobicContact CD2-CD1 3.96Å; L801-L925 HydrophobicContact CG-CD1 4.23Å
802	E	97.1	Very high	96.3	Very high	29 Å²	29	19.6 Å²	19.6	14%	0.136	10%	0.101	C	C	.	.	H	α-helix	trans	-56.6	-45.3	176.9	-174.7	-171.9	-175.8	0	0	110.9	I798 V799 L804 V805 M806 S921 R924 L925	I798-E802 PolarHBondContact O-N 3.28Å; V799-E802 PolarHBondContact O-N 3.43Å; E802-L804 VanDerWaalsContact C-N 3.34Å; E802-L804 PolarHBondContact O-N 2.99Å; E802-V805 PolarHBondContact O-N 2.96Å; E802-M806 WeakPolarHBondContact O-CB 3.4Å; E802-M806 PolarHBondContact O-N 3.39Å; E802-S921 WeakPolarHBondContact OE2-CA 3.25Å; E802-S921 WeakPolarHBondContact OE2-CB 3.42Å; E802-S921 PolarHBondContact OE2-OG 2.92Å; E802-R924 VanDerWaalsContact OE1-CD 3.24Å; E802-R924 WeakPolarHBondContact OE1-CD 3.1Å; E802-R924 IonicContact OE1-CZ 3.6Å; E802-R924 IonicContact OE1-NE 3.63Å; E802-R924 IonicContact OE1-NH1 3.47Å; E802-R924 PolarHBondContact OE1-NH1 3.19Å; E802-R924 IonicContact OE2-NH1 3.49Å; E802-L925 HydrophobicContact CB-CD1 4.28Å
803	G	96.4	Very high	96.4	Very high	5 Å²	5	24 Å²	24	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-57.8	-43.6	175.1	0	0	0	0	0	113.3	V799 A800 L801 M806 L807 Y907	V799-G803 PolarHBondContact O-N 3.29Å; V799-G803 VanDerWaalsContact O-N 3.1Å; A800-G803 PolarHBondContact O-N 2.99Å; L801-G803 VanDerWaalsContact C-N 3.29Å; L801-G803 PolarHBondContact O-N 3.41Å; G803-M806 PolarHBondContact O-N 2.91Å; G803-L807 WeakPolarHBondContact O-CB 3.42Å; G803-L807 PolarHBondContact O-N 2.94Å; G803-Y907 WeakPolarHBondContact CA-OH 3.35Å
804	L	96.4	Very high	96.7	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-72.5	-34.9	-178.5	-169.4	56.5	0	0	0	112.2	A786 A800 L801 E802 L807 N808 F893 W894	A786-L804 HydrophobicContact CB-CB 4.4Å; A786-L804 HydrophobicContact CB-CD2 3.4Å; A786-L804 HydrophobicContact CB-CG 3.79Å; A800-L804 WeakPolarHBondContact O-CB 3.41Å; A800-L804 PolarHBondContact O-N 3.19Å; L801-L804 PolarHBondContact O-N 2.91Å; L801-L804 VanDerWaalsContact O-N 3.13Å; E802-L804 VanDerWaalsContact C-N 3.34Å; E802-L804 PolarHBondContact O-N 2.99Å; L804-L807 PolarHBondContact O-N 3.18Å; L804-N808 WeakPolarHBondContact O-CB 3.38Å; L804-N808 PolarHBondContact O-N 3.44Å; L804-N808 PolarHBondContact O-ND2 3Å; L804-F893 VanDerWaalsContact CD1-O 3.29Å; L804-F893 WeakPolarHBondContact CD1-O 3.5Å; L804-F893 HydrophobicContact CD2-CD1 4.21Å; L804-W894 HydrophobicContact CB-CH2 3.74Å; L804-W894 HydrophobicContact CB-CZ2 3.97Å; L804-W894 HydrophobicContact CB-CZ3 4.36Å; L804-W894 HydrophobicContact CD1-CD2 4.05Å; L804-W894 HydrophobicContact CD1-CE3 4.16Å; L804-W894 HydrophobicContact CD1-CH2 4.17Å; L804-W894 HydrophobicContact CD1-CZ2 4.14Å; L804-W894 HydrophobicContact CD1-CZ3 4.19Å; L804-W894 HydrophobicContact CG-CZ2 4.48Å
805	V	97.7	Very high	96.9	Very high	10 Å²	10	22.2 Å²	22.2	6%	0.061	11%	0.108	C	C	.	.	H	α-helix	trans	-65.4	-42.6	171.5	171.9	0	0	0	0	110.4	L801 E802 L807 N808 R809 F825 F829	L801-V805 HydrophobicContact CD1-CG2 4.05Å; L801-V805 HydrophobicContact CG-CG2 4.4Å; L801-V805 WeakPolarHBondContact O-CG2 3.32Å; L801-V805 PolarHBondContact O-N 3Å; E802-V805 PolarHBondContact O-N 2.96Å; V805-L807 PolarHBondContact O-N 3.43Å; V805-N808 PolarHBondContact O-N 2.85Å; V805-R809 WeakPolarHBondContact O-CB 3.48Å; V805-R809 PolarHBondContact O-N 2.67Å; V805-F825 HydrophobicContact CG1-CE1 4.24Å; V805-F825 HydrophobicContact CG1-CZ 4.06Å; V805-F829 HydrophobicContact CG1-CD2 4.18Å; V805-F829 HydrophobicContact CG1-CE2 3.98Å; V805-F829 HydrophobicContact CG2-CD2 4.35Å; V805-F829 HydrophobicContact CG2-CE2 3.7Å; V805-F829 HydrophobicContact CG2-CZ 4.5Å
806	M	97.2	Very high	97	Very high	92 Å²	92	27 Å²	27	45%	0.453	13%	0.126	S	C	.	.	H	α-helix	trans	-62.9	-41.6	176.5	-170.2	-174.1	-48.7	0	0	112	L725 E802 G803 R809 L810	L725-M806 HydrophobicContact CD1-CG 4.48Å; L725-M806 HydrophobicContact CD2-SD 4.43Å; E802-M806 WeakPolarHBondContact O-CB 3.4Å; E802-M806 PolarHBondContact O-N 3.39Å; G803-M806 PolarHBondContact O-N 2.91Å; M806-R809 WeakPolarHBondContact O-CB 3.46Å; M806-R809 PolarHBondContact O-N 3.44Å; M806-L810 PolarHBondContact O-N 3.49Å
807	L	97.7	Very high	96.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-43	174.9	-176.8	158.4	0	0	0	111.9	K718 A721 S722 L725 G803 L804 V805 R809 L810 C811 W894 F903	K718-L807 HydrophobicContact CD-CD2 3.5Å; K718-L807 HydrophobicContact CG-CD2 4.03Å; K718-L807 VanDerWaalsContact NZ-CD2 3.3Å; A721-L807 HydrophobicContact CB-CG 4.43Å; S722-L807 WeakPolarHBondContact OG-CD1 3.5Å; L725-L807 HydrophobicContact CD1-CB 3.92Å; L725-L807 HydrophobicContact CD1-CG 4.41Å; G803-L807 WeakPolarHBondContact O-CB 3.42Å; G803-L807 PolarHBondContact O-N 2.94Å; L804-L807 PolarHBondContact O-N 3.18Å; V805-L807 PolarHBondContact O-N 3.43Å; L807-R809 VanDerWaalsContact C-N 3.31Å; L807-R809 PolarHBondContact O-N 3.07Å; L807-L810 PolarHBondContact O-N 3.44Å; L807-C811 WeakPolarHBondContact O-CB 3.44Å; L807-C811 PolarHBondContact O-N 3.02Å; L807-W894 HydrophobicContact CB-CZ3 4.49Å; L807-W894 HydrophobicContact CD1-CD2 4.34Å; L807-W894 HydrophobicContact CD1-CE3 3.33Å; L807-W894 HydrophobicContact CD1-CZ3 3.81Å; L807-F903 HydrophobicContact CD1-CE2 4.5Å
808	N	98.2	Very high	96.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-39	173.3	-85.5	-60.1	0	0	0	112.2	K718 S782 L783 L804 V805 C811 H812 F825	K718-N808 PolarHBondContact NZ-ND2 3.13Å; K718-N808 VanDerWaalsContact NZ-ND2 3.19Å; K718-N808 PolarHBondContact NZ-OD1 2.83Å; S782-N808 WeakPolarHBondContact CB-OD1 3.4Å; S782-N808 PolarHBondContact OG-ND2 2.93Å; S782-N808 PolarHBondContact OG-OD1 3.04Å; L783-N808 HydrophobicContact CD2-CB 3.61Å; L783-N808 HydrophobicContact CG-CB 4.37Å; L804-N808 WeakPolarHBondContact O-CB 3.38Å; L804-N808 PolarHBondContact O-N 3.44Å; L804-N808 PolarHBondContact O-ND2 3Å; V805-N808 PolarHBondContact O-N 2.85Å; N808-C811 PolarHBondContact O-N 3.47Å; N808-H812 WeakPolarHBondContact O-CB 3.4Å; N808-H812 PolarHBondContact O-N 3.35Å; N808-F825 HydrophobicContact CB-CE2 3.96Å; N808-F825 HydrophobicContact CB-CZ 4.34Å
809	R	98.3	Very high	96.6	Very high	85 Å²	85	33.1 Å²	33.1	32%	0.321	16%	0.155	S	C	.	.	H	α-helix	trans	-62.6	-45.3	176	-172.7	-178.3	-67.1	-84.6	2.1	111.7	V805 M806 L807 H812 Q813 F825 N826	V805-R809 WeakPolarHBondContact O-CB 3.48Å; V805-R809 PolarHBondContact O-N 2.67Å; M806-R809 WeakPolarHBondContact O-CB 3.46Å; M806-R809 PolarHBondContact O-N 3.44Å; L807-R809 VanDerWaalsContact C-N 3.31Å; L807-R809 PolarHBondContact O-N 3.07Å; R809-H812 PolarHBondContact O-N 3.07Å; R809-Q813 WeakPolarHBondContact O-CG 3.29Å; R809-Q813 PolarHBondContact O-N 2.93Å; R809-F825 HydrophobicContact CB-CD1 4.27Å; R809-F825 HydrophobicContact CB-CD2 4.2Å; R809-F825 HydrophobicContact CB-CE1 3.91Å; R809-F825 HydrophobicContact CB-CE2 3.85Å; R809-F825 HydrophobicContact CB-CG 4.39Å; R809-F825 HydrophobicContact CB-CZ 3.67Å; R809-F825 HydrophobicContact CG-CD1 4.08Å; R809-F825 HydrophobicContact CG-CD2 4.44Å; R809-F825 HydrophobicContact CG-CE1 4.17Å; R809-F825 HydrophobicContact CG-CG 4.21Å; R809-F825 HydrophobicContact CG-CZ 4.38Å; R809-F825 VanDerWaalsContact N-CE2 3.29Å; R809-F825 VanDerWaalsContact NH1-CD1 3.29Å; R809-F825 VanDerWaalsContact NH2-CE1 3.32Å; R809-N826 PolarHBondContact NH1-OD1 3.07Å; R809-N826 PolarHBondContact NH2-OD1 3.44Å
810	L	97.8	Very high	96.4	Very high	30 Å²	30	36.5 Å²	36.5	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-41.9	176.8	-179.1	61.6	0	0	0	111.7	A721 I724 L725 M806 L807 H812 Q813 L814	A721-L810 HydrophobicContact CB-CB 4.16Å; A721-L810 HydrophobicContact CB-CD2 3.97Å; A721-L810 HydrophobicContact CB-CG 3.96Å; I724-L810 HydrophobicContact CB-CD2 3.98Å; I724-L810 HydrophobicContact CD1-CD2 4.36Å; I724-L810 HydrophobicContact CG2-CD2 3.82Å; L725-L810 HydrophobicContact CD1-CB 4.43Å; L725-L810 HydrophobicContact CD1-CD2 4.03Å; L725-L810 HydrophobicContact CD2-CD2 4.05Å; L725-L810 HydrophobicContact CG-CD2 3.71Å; M806-L810 PolarHBondContact O-N 3.49Å; L807-L810 PolarHBondContact O-N 3.44Å; L810-H812 VanDerWaalsContact C-N 3.32Å; L810-H812 PolarHBondContact O-N 3.28Å; L810-Q813 PolarHBondContact O-N 3.23Å; L810-L814 HydrophobicContact CD1-CD1 4.4Å; L810-L814 HydrophobicContact CD1-CG 4.26Å; L810-L814 HydrophobicContact CG-CD1 4.13Å; L810-L814 HydrophobicContact CG-CG 4.45Å; L810-L814 VanDerWaalsContact O-CG 3.3Å; L810-L814 WeakPolarHBondContact O-CG 3.01Å; L810-L814 PolarHBondContact O-N 3.04Å
811	C	97.7	Very high	96.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56.6	-47.4	174.2	-175.7	0	0	0	0	111.2	K718 A721 L807 N808 L814 L815	K718-C811 HydrophobicContact CD-CB 4.4Å; A721-C811 HydrophobicContact CB-CB 4.15Å; L807-C811 WeakPolarHBondContact O-CB 3.44Å; L807-C811 PolarHBondContact O-N 3.02Å; N808-C811 PolarHBondContact O-N 3.47Å; C811-L814 PolarHBondContact O-N 2.88Å; C811-L815 WeakPolarHBondContact O-CB 3.46Å; C811-L815 WeakPolarHBondContact O-CD1 3.49Å; C811-L815 VanDerWaalsContact O-CG 3.32Å; C811-L815 WeakPolarHBondContact O-CG 3.35Å; C811-L815 PolarHBondContact O-N 2.88Å
812	H	98.3	Very high	96.2	Very high	5 Å²	5	38.4 Å²	38.4	2%	0.023	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-46.1	175.2	173.3	-87.9	0	0	0	112.3	L779 N808 R809 L810 L814 L815 R816 T823 F825	L779-H812 HydrophobicContact CD1-CB 4.37Å; L779-H812 HydrophobicContact CD2-CB 4.43Å; N808-H812 WeakPolarHBondContact O-CB 3.4Å; N808-H812 PolarHBondContact O-N 3.35Å; R809-H812 PolarHBondContact O-N 3.07Å; L810-H812 VanDerWaalsContact C-N 3.32Å; L810-H812 PolarHBondContact O-N 3.28Å; H812-L814 PolarHBondContact O-N 3.33Å; H812-L815 PolarHBondContact O-N 2.77Å; H812-R816 VanDerWaalsContact O-CB 3.31Å; H812-R816 WeakPolarHBondContact O-CB 3.45Å; H812-R816 PolarHBondContact O-N 3.43Å; H812-T823 PolarHBondContact NE2-O 3.19Å; H812-F825 HydrophobicContact CB-CD2 3.85Å
813	Q	97.2	Very high	96.2	Very high	106 Å²	106	39.3 Å²	39.3	50%	0.495	21%	0.205	S	C	.	.	H	α-helix	trans	-59	-47.9	178.2	-75.7	173.7	-16	0	0	112.2	R809 L810 L815 R816 E817	R809-Q813 WeakPolarHBondContact O-CG 3.29Å; R809-Q813 PolarHBondContact O-N 2.93Å; L810-Q813 PolarHBondContact O-N 3.23Å; Q813-L815 VanDerWaalsContact C-N 3.3Å; Q813-L815 PolarHBondContact O-N 2.81Å; Q813-R816 PolarHBondContact O-N 3.46Å; Q813-E817 PolarHBondContact O-N 3.35Å
814	L	95.8	Very high	96.2	Very high	28 Å²	28	41.3 Å²	41.3	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-35.8	179.1	-65.3	169.5	0	0	0	112.2	Y717 L720 A721 I724 L810 C811 H812	Y717-L814 HydrophobicContact CD1-CB 3.68Å; Y717-L814 HydrophobicContact CE1-CB 4.09Å; L720-L814 HydrophobicContact CD2-CD1 4.09Å; L720-L814 HydrophobicContact CG-CD1 4.14Å; A721-L814 HydrophobicContact CB-CD1 4.33Å; I724-L814 HydrophobicContact CD1-CD1 4.08Å; L810-L814 HydrophobicContact CD1-CD1 4.4Å; L810-L814 HydrophobicContact CD1-CG 4.26Å; L810-L814 HydrophobicContact CG-CD1 4.13Å; L810-L814 HydrophobicContact CG-CG 4.45Å; L810-L814 VanDerWaalsContact O-CG 3.3Å; L810-L814 WeakPolarHBondContact O-CG 3.01Å; L810-L814 PolarHBondContact O-N 3.04Å; C811-L814 PolarHBondContact O-N 2.88Å; H812-L814 PolarHBondContact O-N 3.33Å
815	L	96.5	Very high	96.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-73.4	-37.3	176	-72.4	163.6	0	0	0	111.9	I713 Y717 M753 I775 C811 H812 Q813 E817 H818 L819 L822	I713-L815 HydrophobicContact CG2-CD2 3.74Å; Y717-L815 HydrophobicContact CD1-CD2 4.29Å; Y717-L815 HydrophobicContact CD1-CG 4.38Å; Y717-L815 HydrophobicContact CD2-CD2 3.43Å; Y717-L815 VanDerWaalsContact CD2-CD2 3.43Å; Y717-L815 HydrophobicContact CD2-CG 4.28Å; Y717-L815 HydrophobicContact CE2-CD2 4.01Å; Y717-L815 HydrophobicContact CG-CD2 3.59Å; Y717-L815 HydrophobicContact CG-CG 3.93Å; M753-L815 HydrophobicContact SD-CD2 4.45Å; I775-L815 HydrophobicContact CD1-CD2 4.42Å; I775-L815 HydrophobicContact CG2-CD1 3.77Å; C811-L815 WeakPolarHBondContact O-CB 3.46Å; C811-L815 WeakPolarHBondContact O-CD1 3.49Å; C811-L815 VanDerWaalsContact O-CG 3.32Å; C811-L815 WeakPolarHBondContact O-CG 3.35Å; C811-L815 PolarHBondContact O-N 2.88Å; H812-L815 PolarHBondContact O-N 2.77Å; Q813-L815 VanDerWaalsContact C-N 3.3Å; Q813-L815 PolarHBondContact O-N 2.81Å; L815-E817 PolarHBondContact O-N 3.35Å; L815-H818 PolarHBondContact O-N 3.38Å; L815-L819 HydrophobicContact CD2-CD1 4.35Å; L815-L819 WeakPolarHBondContact O-CB 3.18Å; L815-L819 PolarHBondContact O-N 2.92Å; L815-L822 HydrophobicContact CB-CD1 3.66Å
816	R	95.8	Very high	96.2	Very high	101 Å²	101	44 Å²	44	38%	0.381	23%	0.228	S	C	.	.	H	α-helix	trans	-65.6	-21.7	-177.7	-166.5	164.1	-172	178.7	7.2	113.3	H812 Q813 H818 L822 D824	H812-R816 VanDerWaalsContact O-CB 3.31Å; H812-R816 WeakPolarHBondContact O-CB 3.45Å; H812-R816 PolarHBondContact O-N 3.43Å; Q813-R816 PolarHBondContact O-N 3.46Å; R816-H818 PolarHBondContact O-N 3.2Å; R816-L822 HydrophobicContact CB-CD1 4.31Å; R816-D824 IonicContact CZ-OD2 3.47Å; R816-D824 IonicContact NH1-OD2 2.75Å; R816-D824 PolarHBondContact NH1-OD2 3.25Å
817	E	93.5	Very high	96.2	Very high	142 Å²	142	44.8 Å²	44.8	66%	0.664	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-25	170.4	-67.5	-176.1	-177.7	0	0	113.4	Q813 L815	Q813-E817 PolarHBondContact O-N 3.35Å; L815-E817 PolarHBondContact O-N 3.35Å
818	H	93	Very high	96.1	Very high	28 Å²	28	45 Å²	45	13%	0.13	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-22.7	-178.9	-58.1	-36	0	0	0	113	Y717 M753 N768 L815 R816 P820	Y717-H818 PolarHBondContact OH-CD2 3.15Å; M753-H818 HydrophobicContact CB-CB 4.07Å; M753-H818 HydrophobicContact CE-CB 3.75Å; M753-H818 VanDerWaalsContact CE-CD2 3.43Å; M753-H818 WeakPolarHBondContact CE-CD2 3.48Å; M753-H818 HydrophobicContact SD-CB 4.18Å; N768-H818 PolarHBondContact ND2-O 2.98Å; L815-H818 PolarHBondContact O-N 3.38Å; R816-H818 PolarHBondContact O-N 3.2Å; H818-P820 WeakPolarHBondContact O-CD 3.19Å
819	L	94.8	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.			trans	-119.7	76.3	-179.5	-58.3	172.9	0	0	0	109.1	M753 L771 I775 L815 G821 L822	M753-L819 HydrophobicContact CB-CD2 4.03Å; M753-L819 HydrophobicContact CG-CD2 4.19Å; M753-L819 HydrophobicContact SD-CD1 3.97Å; M753-L819 HydrophobicContact SD-CD2 4.3Å; M753-L819 HydrophobicContact SD-CG 4.02Å; L771-L819 HydrophobicContact CB-CD2 4.34Å; I775-L819 HydrophobicContact CD1-CD1 3.38Å; I775-L819 HydrophobicContact CG2-CD1 4.48Å; L815-L819 HydrophobicContact CD2-CD1 4.35Å; L815-L819 WeakPolarHBondContact O-CB 3.18Å; L815-L819 PolarHBondContact O-N 2.92Å; L819-G821 PolarHBondContact O-N 3.22Å; L819-G821 VanDerWaalsContact O-N 3.15Å; L819-L822 HydrophobicContact CB-CD1 3.94Å; L819-L822 HydrophobicContact CB-CG 3.84Å; L819-L822 HydrophobicContact CD1-CD1 4.48Å; L819-L822 WeakPolarHBondContact O-CG 3.41Å; L819-L822 PolarHBondContact O-N 3.45Å
820	P	92.3	Very high	95.9	Very high	83 Å²	83	45.8 Å²	45.8	54%	0.539	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.1	-175.7	26.7	-35	0	0	0	112.9	H818 L822	H818-P820 WeakPolarHBondContact O-CD 3.19Å; P820-L822 VanDerWaalsContact C-N 3.25Å; P820-L822 PolarHBondContact O-N 3.1Å
821	G	93.3	Very high	95.9	Very high	51 Å²	51	49.1 Å²	49.1	53%	0.526	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	1.3	177	0	0	0	0	0	115.2	T772 L819	T772-G821 VanDerWaalsContact CG2-O 3.3Å; T772-G821 WeakPolarHBondContact CG2-O 3.47Å; L819-G821 PolarHBondContact O-N 3.22Å; L819-G821 VanDerWaalsContact O-N 3.15Å
822	L	96.2	Very high	95.8	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	-61.5	138.5	174.2	-72.4	173.4	0	0	0	110.7	T772 I775 N776 L779 L815 R816 L819 P820	T772-L822 HydrophobicContact CG2-CD2 4.04Å; T772-L822 HydrophobicContact CG2-CG 4.35Å; I775-L822 HydrophobicContact CB-CD2 4.28Å; I775-L822 HydrophobicContact CG2-CD2 3.8Å; N776-L822 WeakPolarHBondContact OD1-CD2 3.45Å; L779-L822 HydrophobicContact CD1-CD2 4.42Å; L815-L822 HydrophobicContact CB-CD1 3.66Å; R816-L822 HydrophobicContact CB-CD1 4.31Å; L819-L822 HydrophobicContact CB-CD1 3.94Å; L819-L822 HydrophobicContact CB-CG 3.84Å; L819-L822 HydrophobicContact CD1-CD1 4.48Å; L819-L822 WeakPolarHBondContact O-CG 3.41Å; L819-L822 PolarHBondContact O-N 3.45Å; P820-L822 VanDerWaalsContact C-N 3.25Å; P820-L822 PolarHBondContact O-N 3.1Å
823	T	96.6	Very high	95.7	Very high	48 Å²	48	49.6 Å²	49.6	29%	0.294	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-60.6	150.1	176	-54.9	0	0	0	0	109.2	N776 H812 F825 E827 L828	N776-T823 PolarHBondContact ND2-N 3.1Å; N776-T823 PolarHBondContact ND2-OG1 3.44Å; N776-T823 PolarHBondContact OD1-N 3.3Å; N776-T823 VanDerWaalsContact OD1-N 3.1Å; H812-T823 PolarHBondContact NE2-O 3.19Å; T823-F825 PolarHBondContact O-N 2.68Å; T823-E827 HydrophobicContact CG2-CB 4.01Å; T823-E827 VanDerWaalsContact CG2-OE2 3.24Å; T823-E827 WeakPolarHBondContact CG2-OE2 3.49Å; T823-L828 HydrophobicContact CG2-CD2 4.1Å; T823-L828 HydrophobicContact CG2-CG 4.06Å
824	D	96.7	Very high	95.7	Very high	48 Å²	48	50 Å²	50	26%	0.257	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-59.6	140.8	179.8	-168.8	-100.9	0	0	0	111	R816 N826 E827 L828	R816-D824 IonicContact CZ-OD2 3.47Å; R816-D824 IonicContact NH1-OD2 2.75Å; R816-D824 PolarHBondContact NH1-OD2 3.25Å; D824-N826 PolarHBondContact O-N 3.42Å; D824-N826 WeakPolarHBondContact OD1-CB 2.99Å; D824-N826 PolarHBondContact OD1-N 3.04Å; D824-N826 PolarHBondContact OD1-ND2 2.9Å; D824-E827 HydrophobicContact CB-CB 4.43Å; D824-E827 HydrophobicContact CB-CG 4.11Å; D824-E827 PolarHBondContact O-N 2.99Å; D824-L828 PolarHBondContact O-N 2.87Å; D824-L828 VanDerWaalsContact O-N 3.09Å
825	F	97.8	Very high	95.5	Very high	5 Å²	5	50.2 Å²	50.2	2%	0.022	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-37.7	-177.9	179.8	-91.1	0	0	0	111.7	L783 V805 N808 R809 H812 T823 E827 L828 F829	L783-F825 HydrophobicContact CD1-CE2 4.18Å; L783-F825 HydrophobicContact CD1-CZ 4.47Å; L783-F825 HydrophobicContact CD2-CE2 4.14Å; L783-F825 HydrophobicContact CD2-CZ 3.98Å; V805-F825 HydrophobicContact CG1-CE1 4.24Å; V805-F825 HydrophobicContact CG1-CZ 4.06Å; N808-F825 HydrophobicContact CB-CE2 3.96Å; N808-F825 HydrophobicContact CB-CZ 4.34Å; R809-F825 HydrophobicContact CB-CD1 4.27Å; R809-F825 HydrophobicContact CB-CD2 4.2Å; R809-F825 HydrophobicContact CB-CE1 3.91Å; R809-F825 HydrophobicContact CB-CE2 3.85Å; R809-F825 HydrophobicContact CB-CG 4.39Å; R809-F825 HydrophobicContact CB-CZ 3.67Å; R809-F825 HydrophobicContact CG-CD1 4.08Å; R809-F825 HydrophobicContact CG-CD2 4.44Å; R809-F825 HydrophobicContact CG-CE1 4.17Å; R809-F825 HydrophobicContact CG-CG 4.21Å; R809-F825 HydrophobicContact CG-CZ 4.38Å; R809-F825 VanDerWaalsContact N-CE2 3.29Å; R809-F825 VanDerWaalsContact NH1-CD1 3.29Å; R809-F825 VanDerWaalsContact NH2-CE1 3.32Å; H812-F825 HydrophobicContact CB-CD2 3.85Å; T823-F825 PolarHBondContact O-N 2.68Å; F825-E827 VanDerWaalsContact C-N 3.34Å; F825-L828 PolarHBondContact O-N 3.38Å; F825-F829 HydrophobicContact CE1-CB 4.18Å; F825-F829 WeakPolarHBondContact O-CB 3.41Å; F825-F829 PolarHBondContact O-N 2.95Å
826	N	95.6	Very high	95.2	Very high	67 Å²	67	55.1 Å²	55.1	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-71.4	-33.1	-177	-58.6	-51.8	0	0	0	111.5	R809 D824 F829 Q830	R809-N826 PolarHBondContact NH1-OD1 3.07Å; R809-N826 PolarHBondContact NH2-OD1 3.44Å; D824-N826 PolarHBondContact O-N 3.42Å; D824-N826 WeakPolarHBondContact OD1-CB 2.99Å; D824-N826 PolarHBondContact OD1-N 3.04Å; D824-N826 PolarHBondContact OD1-ND2 2.9Å; N826-F829 PolarHBondContact O-N 3.39Å; N826-Q830 WeakPolarHBondContact O-CB 3.23Å; N826-Q830 WeakPolarHBondContact O-CG 3.43Å; N826-Q830 PolarHBondContact O-N 3.45Å
827	E	96.5	Very high	94.8	Very high	108 Å²	108	56.2 Å²	56.2	51%	0.505	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-48.7	173	-67.8	172.3	178.5	0	0	110.5	T823 D824 F825 F829 Q830 E831	T823-E827 HydrophobicContact CG2-CB 4.01Å; T823-E827 VanDerWaalsContact CG2-OE2 3.24Å; T823-E827 WeakPolarHBondContact CG2-OE2 3.49Å; D824-E827 HydrophobicContact CB-CB 4.43Å; D824-E827 HydrophobicContact CB-CG 4.11Å; D824-E827 PolarHBondContact O-N 2.99Å; F825-E827 VanDerWaalsContact C-N 3.34Å; E827-F829 VanDerWaalsContact C-N 3.28Å; E827-F829 PolarHBondContact O-N 3.35Å; E827-Q830 PolarHBondContact O-N 2.9Å; E827-E831 WeakPolarHBondContact O-CB 3.27Å; E827-E831 PolarHBondContact O-N 3.49Å
828	L	97.2	Very high	94.5	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-40.6	175.7	-68.1	173.7	0	0	0	112.1	L779 L780 L783 T823 D824 F825 A832	L779-L828 HydrophobicContact CB-CD1 4.27Å; L779-L828 HydrophobicContact CD1-CD1 4.47Å; L780-L828 HydrophobicContact CB-CD2 4.35Å; L780-L828 HydrophobicContact CD1-CD2 4.48Å; L780-L828 WeakPolarHBondContact CD1-O 3.41Å; L783-L828 HydrophobicContact CD1-CB 3.98Å; T823-L828 HydrophobicContact CG2-CD2 4.1Å; T823-L828 HydrophobicContact CG2-CG 4.06Å; D824-L828 PolarHBondContact O-N 2.87Å; D824-L828 VanDerWaalsContact O-N 3.09Å; F825-L828 PolarHBondContact O-N 3.38Å; L828-A832 WeakPolarHBondContact O-CB 3.4Å; L828-A832 PolarHBondContact O-N 3.23Å
829	F	97.2	Very high	94.2	Very high	21 Å²	21	53.9 Å²	53.9	9%	0.092	32%	0.319	C	S	.	.	H	α-helix	trans	-68.5	-41.7	177.4	179.9	-109.6	0	0	0	112.3	L783 I787 V805 F825 N826 E827 E831 N833 I843 L925	L783-F829 HydrophobicContact CD1-CB 4.36Å; L783-F829 HydrophobicContact CD2-CD2 4.27Å; I787-F829 HydrophobicContact CD1-CE2 4.48Å; V805-F829 HydrophobicContact CG1-CD2 4.18Å; V805-F829 HydrophobicContact CG1-CE2 3.98Å; V805-F829 HydrophobicContact CG2-CD2 4.35Å; V805-F829 HydrophobicContact CG2-CE2 3.7Å; V805-F829 HydrophobicContact CG2-CZ 4.5Å; F825-F829 HydrophobicContact CE1-CB 4.18Å; F825-F829 WeakPolarHBondContact O-CB 3.41Å; F825-F829 PolarHBondContact O-N 2.95Å; N826-F829 PolarHBondContact O-N 3.39Å; E827-F829 VanDerWaalsContact C-N 3.28Å; E827-F829 PolarHBondContact O-N 3.35Å; F829-E831 VanDerWaalsContact C-N 3.35Å; F829-N833 WeakPolarHBondContact O-CB 3.43Å; F829-N833 PolarHBondContact O-N 2.75Å; F829-I843 HydrophobicContact CE2-CD1 4.01Å; F829-I843 HydrophobicContact CZ-CD1 3.58Å; F829-L925 HydrophobicContact CZ-CD2 4.44Å
830	Q	95.3	Very high	93.9	Very high	81 Å²	81	58 Å²	58	38%	0.379	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-39.4	175.9	-74.6	173.5	-6.9	0	0	111.7	N826 E827 N833 H834 S835 V836	N826-Q830 WeakPolarHBondContact O-CB 3.23Å; N826-Q830 WeakPolarHBondContact O-CG 3.43Å; N826-Q830 PolarHBondContact O-N 3.45Å; E827-Q830 PolarHBondContact O-N 2.9Å; Q830-N833 CarbonylContact O-C 3.45Å; Q830-N833 PolarHBondContact O-N 3.22Å; Q830-H834 PolarHBondContact O-N 3.24Å; Q830-S835 WeakPolarHBondContact CA-OG 3.43Å; Q830-S835 WeakPolarHBondContact CB-OG 3.32Å; Q830-S835 WeakPolarHBondContact CG-OG 3.4Å; Q830-S835 PolarHBondContact O-N 2.92Å; Q830-S835 PolarHBondContact O-OG 3.48Å; Q830-V836 HydrophobicContact CB-CG2 3.81Å
831	E	96.2	Very high	94	Very high	99 Å²	99	54.2 Å²	54.2	46%	0.463	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-53.4	174.9	-173.8	-179	173	0	0	110.5	L780 E827 F829 N833 H834 V836	L780-E831 HydrophobicContact CD1-CB 3.97Å; L780-E831 HydrophobicContact CD1-CG 3.92Å; L780-E831 HydrophobicContact CD2-CG 4.49Å; L780-E831 WeakPolarHBondContact CD2-OE1 3.33Å; E827-E831 WeakPolarHBondContact O-CB 3.27Å; E827-E831 PolarHBondContact O-N 3.49Å; F829-E831 VanDerWaalsContact C-N 3.35Å; E831-N833 VanDerWaalsContact C-N 3.25Å; E831-N833 PolarHBondContact O-N 3Å; E831-H834 PolarHBondContact O-CD2 2.85Å; E831-H834 PolarHBondContact O-N 2.91Å; E831-V836 HydrophobicContact CB-CG2 4.45Å
832	A	96.7	Very high	94.1	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-36	176.6	0	0	0	0	0	112.8	L780 L783 D784 I787 L828 H834 R842	L780-A832 HydrophobicContact CD1-CB 4.04Å; L783-A832 HydrophobicContact CB-CB 3.67Å; D784-A832 HydrophobicContact CB-CB 4.48Å; I787-A832 HydrophobicContact CD1-CB 4.1Å; L828-A832 WeakPolarHBondContact O-CB 3.4Å; L828-A832 PolarHBondContact O-N 3.23Å; A832-H834 PolarHBondContact O-N 3.4Å; A832-R842 PolarHBondContact O-NH1 3.47Å
833	N	96.4	Very high	94.1	Very high	11 Å²	11	52.5 Å²	52.5	6%	0.059	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	1.7	178.2	-167.3	32.6	0	0	0	113.4	I787 F829 Q830 E831 S835 G841 R842 I843	I787-N833 HydrophobicContact CD1-CB 3.81Å; F829-N833 WeakPolarHBondContact O-CB 3.43Å; F829-N833 PolarHBondContact O-N 2.75Å; Q830-N833 CarbonylContact O-C 3.45Å; Q830-N833 PolarHBondContact O-N 3.22Å; E831-N833 VanDerWaalsContact C-N 3.25Å; E831-N833 PolarHBondContact O-N 3Å; N833-S835 PolarHBondContact O-N 3.43Å; N833-G841 CarbonylContact O-C 3.52Å; N833-G841 WeakPolarHBondContact O-CA 3.47Å; N833-R842 PolarHBondContact O-N 3.35Å; N833-R842 PolarHBondContact OD1-N 3.38Å; N833-R842 VanDerWaalsContact OD1-N 3.09Å; N833-I843 WeakPolarHBondContact OD1-CG1 3.34Å; N833-I843 PolarHBondContact OD1-N 3.49Å
834	H	95.6	Very high	94.1	Very high	115 Å²	115	50.7 Å²	50.7	53%	0.532	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	35.3	-174.5	-60	174.4	0	0	0	113.7	Q830 E831 A832 A838 R842	Q830-H834 PolarHBondContact O-N 3.24Å; E831-H834 PolarHBondContact O-CD2 2.85Å; E831-H834 PolarHBondContact O-N 2.91Å; A832-H834 PolarHBondContact O-N 3.4Å; H834-A838 WeakPolarHBondContact O-CB 3.49Å; H834-R842 HydrophobicContact CB-CG 4.16Å
835	S	91.8	Very high	94	Very high	33 Å²	33	53.2 Å²	53.2	23%	0.231	29%	0.29	C	S	.	.			trans	-107.7	22.2	-178	72.5	0	0	0	0	113.4	Q830 N833 A838	Q830-S835 WeakPolarHBondContact CA-OG 3.43Å; Q830-S835 WeakPolarHBondContact CB-OG 3.32Å; Q830-S835 WeakPolarHBondContact CG-OG 3.4Å; Q830-S835 PolarHBondContact O-N 2.92Å; Q830-S835 PolarHBondContact O-OG 3.48Å; N833-S835 PolarHBondContact O-N 3.43Å; S835-A838 CarbonylContact C-O 3.44Å
836	V	90	Very high	93.9	Very high	103 Å²	103	53.7 Å²	53.7	62%	0.624	29%	0.292	S	S	*	.	S	Bend	trans	-90.4	-54	175.8	-179.5	0	0	0	0	110.2	Q830 E831	Q830-V836 HydrophobicContact CB-CG2 3.81Å; E831-V836 HydrophobicContact CB-CG2 4.45Å
837	S	88.5	Confident	94	Very high	123 Å²	123	50.5 Å²	50.5	86%	0.86	28%	0.275	S	S	*	.	S	Bend	trans	-94.7	-12.7	179.5	54.5	0	0	0	0	113.6
838	A	87.7	Confident	93.9	Very high	40 Å²	40	47.9 Å²	47.9	33%	0.331	26%	0.262	S	S	.	.	S	Bend	trans	-115.8	145.1	178.1	0	0	0	0	0	111	H834 S835 Y840	H834-A838 WeakPolarHBondContact O-CB 3.49Å; S835-A838 CarbonylContact C-O 3.44Å; A838-Y840 PolarHBondContact O-N 3.24Å
839	P	85.8	Confident	93.8	Very high	82 Å²	82	52 Å²	52	53%	0.532	28%	0.277	S	S	.	.	S	Bend	trans	-69.4	-22	-179	27.8	-34.8	0	0	0	113.1	Q929	P839-Q929 PolarHBondContact O-NE2 3.48Å
840	Y	89	Confident	93.7	Very high	86 Å²	86	51 Å²	51	34%	0.337	27%	0.273	S	S	.	.	S	Bend	trans	-128	123.3	-176.9	-46.2	-59.7	0	0	0	109.4	A838 Q929 V933	A838-Y840 PolarHBondContact O-N 3.24Å; Y840-Q929 HydrophobicContact CD1-CG 4.49Å; Y840-Q929 HydrophobicContact CE1-CG 4.2Å; Y840-V933 HydrophobicContact CD1-CB 4.15Å; Y840-V933 HydrophobicContact CD1-CG1 3.7Å; Y840-V933 HydrophobicContact CD1-CG2 4.39Å; Y840-V933 HydrophobicContact CD2-CG2 4.5Å; Y840-V933 HydrophobicContact CE1-CB 3.61Å; Y840-V933 HydrophobicContact CE1-CG1 3.69Å; Y840-V933 HydrophobicContact CE1-CG2 3.89Å; Y840-V933 HydrophobicContact CE2-CG2 4.02Å; Y840-V933 HydrophobicContact CG-CG1 4.36Å
841	G	93.1	Very high	93.7	Very high	3 Å²	3	47.1 Å²	47.1	3%	0.031	26%	0.255	C	S	.	.			trans	-76.8	164.5	176.6	0	0	0	0	0	112.7	N833 I843 T844 L845	N833-G841 CarbonylContact O-C 3.52Å; N833-G841 WeakPolarHBondContact O-CA 3.47Å; G841-I843 VanDerWaalsContact C-N 3.27Å; G841-I843 PolarHBondContact O-N 2.96Å; G841-T844 WeakPolarHBondContact O-CB 3.3Å; G841-T844 PolarHBondContact O-N 2.91Å; G841-L845 PolarHBondContact O-N 3.34Å; G841-L845 VanDerWaalsContact O-N 3.15Å
842	R	95.8	Very high	93.5	Very high	20 Å²	20	44.6 Å²	44.6	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-46.3	-45.4	175.6	-74.7	170	62.8	-175.1	9.1	114	D784 I787 N788 E791 A832 N833 H834 T844 L845 H846	D784-R842 IonicContact OD1-CZ 3.91Å; D784-R842 IonicContact OD1-NH1 3.43Å; D784-R842 PolarHBondContact OD1-NH1 2.92Å; D784-R842 IonicContact OD1-NH2 2.8Å; I787-R842 HydrophobicContact CG2-CB 3.83Å; N788-R842 VanDerWaalsContact CG-NH2 3.27Å; N788-R842 PolarHBondContact OD1-NH2 2.96Å; E791-R842 VanDerWaalsContact OE1-CB 3.31Å; E791-R842 WeakPolarHBondContact OE1-CB 3.24Å; E791-R842 IonicContact OE1-CZ 2.62Å; E791-R842 IonicContact OE1-NE 2.76Å; E791-R842 PolarHBondContact OE1-NE 2.88Å; E791-R842 IonicContact OE1-NH2 2.7Å; E791-R842 IonicContact OE2-CZ 3.14Å; E791-R842 IonicContact OE2-NE 2.87Å; E791-R842 PolarHBondContact OE2-NE 3.13Å; E791-R842 IonicContact OE2-NH2 3.35Å; E791-R842 PolarHBondContact OE2-NH2 3.36Å; A832-R842 PolarHBondContact O-NH1 3.47Å; N833-R842 PolarHBondContact O-N 3.35Å; N833-R842 PolarHBondContact OD1-N 3.38Å; N833-R842 VanDerWaalsContact OD1-N 3.09Å; H834-R842 HydrophobicContact CB-CG 4.16Å; R842-T844 VanDerWaalsContact C-N 3.3Å; R842-T844 PolarHBondContact O-N 2.94Å; R842-L845 PolarHBondContact O-N 3.36Å; R842-H846 WeakPolarHBondContact O-CB 3.45Å; R842-H846 PolarHBondContact O-N 3.5Å
843	I	97	Very high	93.1	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-42.9	178.5	-62.3	165.7	0	0	0	111.1	I787 F790 L801 F829 N833 G841 V847 L925	I787-I843 HydrophobicContact CD1-CD1 4.28Å; I787-I843 HydrophobicContact CD1-CG1 4.47Å; I787-I843 HydrophobicContact CG1-CD1 4.21Å; I787-I843 HydrophobicContact CG1-CG1 4.24Å; I787-I843 HydrophobicContact CG2-CG1 4.17Å; F790-I843 HydrophobicContact CD1-CG2 4.49Å; F790-I843 HydrophobicContact CE1-CG2 4.03Å; L801-I843 HydrophobicContact CD2-CD1 3.94Å; L801-I843 HydrophobicContact CD2-CG1 3.93Å; L801-I843 HydrophobicContact CD2-CG2 4.2Å; F829-I843 HydrophobicContact CE2-CD1 4.01Å; F829-I843 HydrophobicContact CZ-CD1 3.58Å; N833-I843 WeakPolarHBondContact OD1-CG1 3.34Å; N833-I843 PolarHBondContact OD1-N 3.49Å; G841-I843 VanDerWaalsContact C-N 3.27Å; G841-I843 PolarHBondContact O-N 2.96Å; I843-V847 WeakPolarHBondContact O-CB 3.43Å; I843-V847 VanDerWaalsContact O-CG2 3.24Å; I843-V847 WeakPolarHBondContact O-CG2 3.43Å; I843-V847 PolarHBondContact O-N 3.43Å; I843-L925 HydrophobicContact CG2-CB 4.4Å
844	T	96.2	Very high	92.9	Very high	11 Å²	11	49.9 Å²	49.9	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-42.7	179.9	-58.9	0	0	0	0	111.2	G841 R842 V847 F848 L926 V933 I934	G841-T844 WeakPolarHBondContact O-CB 3.3Å; G841-T844 PolarHBondContact O-N 2.91Å; R842-T844 VanDerWaalsContact C-N 3.3Å; R842-T844 PolarHBondContact O-N 2.94Å; T844-V847 PolarHBondContact O-N 3.26Å; T844-F848 PolarHBondContact O-N 2.79Å; T844-F848 VanDerWaalsContact O-N 3.07Å; T844-L926 HydrophobicContact CG2-CD2 3.92Å; T844-L926 WeakPolarHBondContact OG1-CD2 3.3Å; T844-V933 HydrophobicContact CG2-CG1 3.68Å; T844-I934 HydrophobicContact CG2-CD1 4.29Å; T844-I934 HydrophobicContact CG2-CG1 4.38Å
845	L	95.1	Very high	92.8	Very high	100 Å²	100	44.4 Å²	44.4	52%	0.524	24%	0.239	S	C	.	.	H	α-helix	trans	-63.9	-45.1	178.3	-62.6	174.2	0	0	0	111.3	G841 R842 F848 W849	G841-L845 PolarHBondContact O-N 3.34Å; G841-L845 VanDerWaalsContact O-N 3.15Å; R842-L845 PolarHBondContact O-N 3.36Å; L845-F848 PolarHBondContact O-N 3Å; L845-W849 WeakPolarHBondContact O-CB 3.28Å; L845-W849 PolarHBondContact O-N 3.24Å
846	H	95.8	Very high	92.9	Very high	15 Å²	15	43 Å²	43	7%	0.069	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-40.5	177.9	-168.9	56.1	0	0	0	112.2	F790 E791 N793 R842 F848 W849 E850	F790-H846 HydrophobicContact CD1-CB 4.43Å; F790-H846 AromaticContact CD1-CD2 3.7Å; F790-H846 HydrophobicContact CE1-CB 4.09Å; F790-H846 AromaticContact CE1-CD2 3.52Å; F790-H846 AromaticContact CZ-CD2 3.77Å; F790-H846 PolarHBondContact O-CD2 2.96Å; F790-H846 PolarHBondContact O-NE2 3.01Å; F790-H846 VanDerWaalsContact O-NE2 3.07Å; E791-H846 WeakPolarHBondContact CA-NE2 3.5Å; E791-H846 HydrophobicContact CG-CB 4.11Å; E791-H846 PolarHBondContact O-CE1 3.16Å; E791-H846 PolarHBondContact O-NE2 2.87Å; N793-H846 PolarHBondContact O-NE2 3.26Å; R842-H846 WeakPolarHBondContact O-CB 3.45Å; R842-H846 PolarHBondContact O-N 3.5Å; H846-F848 PolarHBondContact O-N 3.22Å; H846-W849 AromaticContact CE1-CE3 3.87Å; H846-W849 PolarHBondContact O-N 3.27Å; H846-E850 IonicContact CE1-OE1 2.78Å; H846-E850 WeakPolarHBondContact NE2-CG 3.43Å; H846-E850 IonicContact NE2-OE1 3.25Å; H846-E850 WeakPolarHBondContact O-CB 3.48Å; H846-E850 WeakPolarHBondContact O-CG 3.21Å; H846-E850 PolarHBondContact O-N 2.9Å
847	V	97	Very high	92.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-48.9	174.1	167.8	0	0	0	0	110.6	F790 I795 I798 I843 T844 W849 E850 L851 L922 L926 I934	F790-V847 HydrophobicContact CE1-CG2 4.12Å; F790-V847 HydrophobicContact CZ-CG2 3.91Å; I795-V847 HydrophobicContact CD1-CG1 4.18Å; I798-V847 HydrophobicContact CD1-CG2 4.06Å; I843-V847 WeakPolarHBondContact O-CB 3.43Å; I843-V847 VanDerWaalsContact O-CG2 3.24Å; I843-V847 WeakPolarHBondContact O-CG2 3.43Å; I843-V847 PolarHBondContact O-N 3.43Å; T844-V847 PolarHBondContact O-N 3.26Å; V847-W849 VanDerWaalsContact C-N 3.31Å; V847-W849 PolarHBondContact O-N 2.99Å; V847-E850 PolarHBondContact O-N 3.03Å; V847-L851 HydrophobicContact CG1-CD1 3.98Å; V847-L851 HydrophobicContact CG1-CG 4.37Å; V847-L851 WeakPolarHBondContact O-CB 3.47Å; V847-L851 WeakPolarHBondContact O-CG 3.43Å; V847-L851 PolarHBondContact O-N 2.74Å; V847-L922 HydrophobicContact CB-CD2 4.34Å; V847-L922 HydrophobicContact CG1-CD2 3.62Å; V847-L922 HydrophobicContact CG2-CD2 3.66Å; V847-L926 HydrophobicContact CB-CD2 4.43Å; V847-L926 HydrophobicContact CG1-CD1 4.37Å; V847-L926 HydrophobicContact CG2-CD2 4.42Å; V847-I934 HydrophobicContact CB-CD1 4.17Å; V847-I934 HydrophobicContact CG1-CD1 3.58Å
848	F	95.6	Very high	92.9	Very high	54 Å²	54	34.6 Å²	34.6	24%	0.237	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-41.4	178	175	-110.7	0	0	0	112.2	T844 L845 H846 L851 N852 I934 E937	T844-F848 PolarHBondContact O-N 2.79Å; T844-F848 VanDerWaalsContact O-N 3.07Å; L845-F848 PolarHBondContact O-N 3Å; H846-F848 PolarHBondContact O-N 3.22Å; F848-L851 WeakPolarHBondContact O-CB 3.35Å; F848-L851 PolarHBondContact O-N 3.31Å; F848-N852 PolarHBondContact O-N 2.94Å; F848-I934 HydrophobicContact CB-CG1 4.41Å; F848-E937 HydrophobicContact CD2-CB 3.82Å; F848-E937 HydrophobicContact CE1-CB 4.44Å; F848-E937 HydrophobicContact CE2-CB 3.29Å; F848-E937 HydrophobicContact CE2-CG 4.19Å; F848-E937 HydrophobicContact CZ-CB 3.65Å; F848-E937 HydrophobicContact CZ-CG 4.21Å
849	W	94.8	Very high	93.2	Very high	90 Å²	90	32.9 Å²	32.9	34%	0.341	16%	0.155	S	C	.	.	H	α-helix	trans	-60.1	-50.2	177.1	-171.6	87.2	0	0	0	111.8	L845 H846 V847 L851 N852 Y853 V880	L845-W849 WeakPolarHBondContact O-CB 3.28Å; L845-W849 PolarHBondContact O-N 3.24Å; H846-W849 AromaticContact CE1-CE3 3.87Å; H846-W849 PolarHBondContact O-N 3.27Å; V847-W849 VanDerWaalsContact C-N 3.31Å; V847-W849 PolarHBondContact O-N 2.99Å; W849-L851 VanDerWaalsContact C-N 3.28Å; W849-L851 PolarHBondContact O-N 3.25Å; W849-N852 PolarHBondContact O-N 2.65Å; W849-Y853 AromaticContact CD1-CD2 3.45Å; W849-Y853 VanDerWaalsContact CD1-CD2 3.45Å; W849-Y853 AromaticContact CD1-CE2 3.43Å; W849-Y853 VanDerWaalsContact CD1-CE2 3.43Å; W849-Y853 AromaticContact CD2-CD2 3.96Å; W849-Y853 HydrophobicContact CD2-CD2 3.96Å; W849-Y853 AromaticContact CE2-CD2 3.74Å; W849-Y853 AromaticContact CG-CD2 3.79Å; W849-Y853 HydrophobicContact CG-CD2 3.79Å; W849-Y853 HydrophobicContact CG-CE2 4.2Å; W849-Y853 AromaticContact NE1-CD2 3.38Å; W849-Y853 AromaticContact NE1-CE2 3.43Å; W849-Y853 VanDerWaalsContact O-CD2 3.28Å; W849-Y853 WeakPolarHBondContact O-CD2 3.45Å; W849-Y853 PolarHBondContact O-N 3.32Å; W849-V880 HydrophobicContact CH2-CG1 3.12Å; W849-V880 HydrophobicContact CZ2-CG1 3.99Å; W849-V880 HydrophobicContact CZ3-CG1 3.54Å
850	E	94.4	Very high	93.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-35	175.7	-75.9	-71.3	141.6	0	0	112.4	S794 I795 H846 V847 D854 F855 R882	S794-E850 VanDerWaalsContact CA-OE2 3.29Å; S794-E850 WeakPolarHBondContact CA-OE2 3.33Å; I795-E850 HydrophobicContact CB-CB 3.94Å; I795-E850 HydrophobicContact CB-CG 4.38Å; I795-E850 PolarHBondContact N-OE2 2.8Å; H846-E850 IonicContact CE1-OE1 2.78Å; H846-E850 WeakPolarHBondContact NE2-CG 3.43Å; H846-E850 IonicContact NE2-OE1 3.25Å; H846-E850 WeakPolarHBondContact O-CB 3.48Å; H846-E850 WeakPolarHBondContact O-CG 3.21Å; H846-E850 PolarHBondContact O-N 2.9Å; V847-E850 PolarHBondContact O-N 3.03Å; E850-D854 WeakPolarHBondContact O-CA 3.23Å; E850-D854 WeakPolarHBondContact O-CB 3.47Å; E850-D854 PolarHBondContact O-N 2.94Å; E850-F855 PolarHBondContact O-N 2.84Å; E850-R882 VanDerWaalsContact CD-NH2 3.31Å; E850-R882 IonicContact OE1-CZ 3.92Å; E850-R882 IonicContact OE1-NE 3.78Å; E850-R882 PolarHBondContact OE1-NE 2.95Å; E850-R882 IonicContact OE1-NH2 2.8Å; E850-R882 PolarHBondContact OE1-NH2 3.3Å; E850-R882 IonicContact OE2-CZ 2.82Å; E850-R882 IonicContact OE2-NE 3.79Å; E850-R882 IonicContact OE2-NH2 3.55Å; E850-R882 PolarHBondContact OE2-NH2 2.7Å
851	L	94.8	Very high	93.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.118	C	C	.	.	I	π-helix	trans	-61.6	-51	174.5	-71.6	171.9	0	0	0	111.2	I795 V847 F848 W849 F855 L856 I934 L938 F1011	I795-L851 HydrophobicContact CD1-CD2 3.82Å; I795-L851 HydrophobicContact CD1-CG 4.1Å; V847-L851 HydrophobicContact CG1-CD1 3.98Å; V847-L851 HydrophobicContact CG1-CG 4.37Å; V847-L851 WeakPolarHBondContact O-CB 3.47Å; V847-L851 WeakPolarHBondContact O-CG 3.43Å; V847-L851 PolarHBondContact O-N 2.74Å; F848-L851 WeakPolarHBondContact O-CB 3.35Å; F848-L851 PolarHBondContact O-N 3.31Å; W849-L851 VanDerWaalsContact C-N 3.28Å; W849-L851 PolarHBondContact O-N 3.25Å; L851-F855 HydrophobicContact CD2-CB 3.94Å; L851-F855 HydrophobicContact CD2-CD1 3.59Å; L851-F855 HydrophobicContact CD2-CE1 4.33Å; L851-F855 HydrophobicContact CD2-CG 3.89Å; L851-L856 WeakPolarHBondContact O-CB 3.3Å; L851-L856 WeakPolarHBondContact O-CG 3.47Å; L851-L856 PolarHBondContact O-N 3.1Å; L851-L856 VanDerWaalsContact O-N 3.09Å; L851-I934 HydrophobicContact CD1-CG2 3.74Å; L851-L938 HydrophobicContact CD1-CD1 4.36Å; L851-F1011 HydrophobicContact CD1-CD1 4.24Å; L851-F1011 HydrophobicContact CD1-CE1 3.63Å; L851-F1011 HydrophobicContact CD1-CE2 4.2Å; L851-F1011 HydrophobicContact CD1-CZ 3.62Å; L851-F1011 HydrophobicContact CD2-CD1 4.43Å; L851-F1011 HydrophobicContact CD2-CD2 3.62Å; L851-F1011 HydrophobicContact CD2-CE1 4.24Å; L851-F1011 HydrophobicContact CD2-CE2 3.42Å; L851-F1011 VanDerWaalsContact CD2-CE2 3.42Å; L851-F1011 HydrophobicContact CD2-CG 4.15Å; L851-F1011 HydrophobicContact CD2-CZ 3.75Å; L851-F1011 HydrophobicContact CG-CE2 4.4Å; L851-F1011 HydrophobicContact CG-CZ 4.28Å
852	N	91.5	Very high	94	Very high	46 Å²	46	28.7 Å²	28.7	25%	0.246	13%	0.133	C	C	.	.	I	π-helix	trans	-70.8	-39.4	-174.4	-167.7	53.8	0	0	0	113.1	F848 W849	F848-N852 PolarHBondContact O-N 2.94Å; W849-N852 PolarHBondContact O-N 2.65Å
853	Y	90.2	Very high	93.9	Very high	123 Å²	123	28.9 Å²	28.9	48%	0.482	14%	0.141	S	C	.	.	I	π-helix	trans	-100.3	-16.1	-171.7	-66.9	-72.3	0	0	0	114.9	W849 V880	W849-Y853 AromaticContact CD1-CD2 3.45Å; W849-Y853 VanDerWaalsContact CD1-CD2 3.45Å; W849-Y853 AromaticContact CD1-CE2 3.43Å; W849-Y853 VanDerWaalsContact CD1-CE2 3.43Å; W849-Y853 AromaticContact CD2-CD2 3.96Å; W849-Y853 HydrophobicContact CD2-CD2 3.96Å; W849-Y853 AromaticContact CE2-CD2 3.74Å; W849-Y853 AromaticContact CG-CD2 3.79Å; W849-Y853 HydrophobicContact CG-CD2 3.79Å; W849-Y853 HydrophobicContact CG-CE2 4.2Å; W849-Y853 AromaticContact NE1-CD2 3.38Å; W849-Y853 AromaticContact NE1-CE2 3.43Å; W849-Y853 VanDerWaalsContact O-CD2 3.28Å; W849-Y853 WeakPolarHBondContact O-CD2 3.45Å; W849-Y853 PolarHBondContact O-N 3.32Å; Y853-V880 VanDerWaalsContact O-CG2 3.23Å; Y853-V880 WeakPolarHBondContact O-CG2 3.3Å
854	D	91.5	Very high	93.7	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	18%	0.178	C	C	.	.	I	π-helix	trans	-129	-59.7	-179.8	-164.7	1.4	0	0	0	112.8	E850 L856 L857 S858 R870 V880 R882	E850-D854 WeakPolarHBondContact O-CA 3.23Å; E850-D854 WeakPolarHBondContact O-CB 3.47Å; E850-D854 PolarHBondContact O-N 2.94Å; D854-L856 PolarHBondContact O-N 3.48Å; D854-L857 CarbonylContact O-C 3.59Å; D854-L857 PolarHBondContact O-N 2.94Å; D854-S858 VanDerWaalsContact O-CB 3.26Å; D854-S858 WeakPolarHBondContact O-CB 3.41Å; D854-S858 PolarHBondContact O-N 3.4Å; D854-S858 PolarHBondContact O-OG 3.45Å; D854-S858 WeakPolarHBondContact OD1-CB 3.48Å; D854-S858 PolarHBondContact OD1-OG 2.9Å; D854-R870 IonicContact OD1-CZ 2.79Å; D854-R870 IonicContact OD1-NH1 2.75Å; D854-R870 PolarHBondContact OD1-NH1 3.22Å; D854-R870 IonicContact OD1-NH2 3.59Å; D854-R870 IonicContact OD2-CZ 3.69Å; D854-R870 IonicContact OD2-NH1 3.53Å; D854-R870 PolarHBondContact OD2-NH1 2.94Å; D854-R870 IonicContact OD2-NH2 3.61Å; D854-R870 PolarHBondContact OD2-NH2 3.39Å; D854-V880 HydrophobicContact CB-CG2 4.07Å; D854-R882 IonicContact OD2-CZ 3.84Å; D854-R882 IonicContact OD2-NH2 2.8Å; D854-R882 PolarHBondContact OD2-NH2 3.06Å
855	F	93.6	Very high	93.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	I	π-helix	trans	-60.4	-55	-168.2	176.9	-101	0	0	0	113.1	E850 L851 L857 S858 Y859 F868 L914 N1007 F1011	E850-F855 PolarHBondContact O-N 2.84Å; L851-F855 HydrophobicContact CD2-CB 3.94Å; L851-F855 HydrophobicContact CD2-CD1 3.59Å; L851-F855 HydrophobicContact CD2-CE1 4.33Å; L851-F855 HydrophobicContact CD2-CG 3.89Å; F855-L857 PolarHBondContact O-N 2.83Å; F855-S858 PolarHBondContact O-N 3.37Å; F855-Y859 HydrophobicContact CB-CD2 4.36Å; F855-Y859 HydrophobicContact CD2-CD1 4.11Å; F855-Y859 AromaticContact CD2-CD2 3.9Å; F855-Y859 HydrophobicContact CD2-CD2 3.9Å; F855-Y859 HydrophobicContact CD2-CE2 4.35Å; F855-Y859 AromaticContact CD2-CG 3.75Å; F855-Y859 HydrophobicContact CD2-CG 3.75Å; F855-Y859 HydrophobicContact CE2-CD1 4.27Å; F855-Y859 HydrophobicContact CE2-CG 4.13Å; F855-Y859 HydrophobicContact CG-CD2 4.46Å; F855-Y859 WeakPolarHBondContact O-CB 3.29Å; F855-Y859 PolarHBondContact O-N 3.38Å; F855-F868 HydrophobicContact CE1-CE1 4.31Å; F855-F868 HydrophobicContact CE2-CB 4Å; F855-F868 AromaticContact CE2-CD1 3.82Å; F855-F868 HydrophobicContact CE2-CD1 3.82Å; F855-F868 HydrophobicContact CE2-CD2 4.07Å; F855-F868 HydrophobicContact CE2-CE1 4.23Å; F855-F868 HydrophobicContact CE2-CE2 4.48Å; F855-F868 AromaticContact CE2-CG 3.72Å; F855-F868 HydrophobicContact CE2-CG 3.72Å; F855-F868 AromaticContact CZ-CD1 3.59Å; F855-F868 HydrophobicContact CZ-CD1 3.59Å; F855-F868 AromaticContact CZ-CD2 3.97Å; F855-F868 HydrophobicContact CZ-CD2 3.97Å; F855-F868 AromaticContact CZ-CE1 3.51Å; F855-F868 HydrophobicContact CZ-CE1 3.51Å; F855-F868 AromaticContact CZ-CE2 3.92Å; F855-F868 HydrophobicContact CZ-CE2 3.92Å; F855-F868 AromaticContact CZ-CG 3.8Å; F855-F868 HydrophobicContact CZ-CG 3.8Å; F855-F868 AromaticContact CZ-CZ 3.67Å; F855-F868 HydrophobicContact CZ-CZ 3.67Å; F855-L914 HydrophobicContact CD2-CD1 3.79Å; F855-L914 HydrophobicContact CE2-CB 4.43Å; F855-L914 HydrophobicContact CE2-CD1 3.73Å; F855-L914 HydrophobicContact CE2-CD2 4.31Å; F855-L914 HydrophobicContact CE2-CG 4.39Å; F855-N1007 HydrophobicContact CE1-CB 4.28Å; F855-F1011 HydrophobicContact CD1-CD2 4.34Å; F855-F1011 HydrophobicContact CE1-CB 3.99Å; F855-F1011 AromaticContact CE1-CD2 3.83Å; F855-F1011 HydrophobicContact CE1-CD2 3.83Å; F855-F1011 HydrophobicContact CE1-CG 4.29Å; F855-F1011 HydrophobicContact CZ-CD2 4.13Å
856	L	93	Very high	93.6	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-35.3	-178.3	-63.7	179	0	0	0	111.2	L851 D854 L938 V941 E1004 N1007 T1008	L851-L856 WeakPolarHBondContact O-CB 3.3Å; L851-L856 WeakPolarHBondContact O-CG 3.47Å; L851-L856 PolarHBondContact O-N 3.1Å; L851-L856 VanDerWaalsContact O-N 3.09Å; D854-L856 PolarHBondContact O-N 3.48Å; L856-L938 HydrophobicContact CD1-CD2 4.05Å; L856-V941 HydrophobicContact CD1-CG1 4.32Å; L856-E1004 HydrophobicContact CB-CB 4.4Å; L856-E1004 HydrophobicContact CB-CG 4.35Å; L856-E1004 WeakPolarHBondContact O-CG 3.33Å; L856-N1007 HydrophobicContact CD2-CB 3.74Å; L856-N1007 PolarHBondContact O-ND2 3.15Å; L856-T1008 WeakPolarHBondContact CD1-OG1 3.31Å; L856-T1008 VanDerWaalsContact CD2-OG1 3.24Å; L856-T1008 WeakPolarHBondContact CD2-OG1 3.32Å
857	L	90	Very high	93.7	Very high	50 Å²	50	40.6 Å²	40.6	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-86.5	-14.8	-175.5	-70.2	171.1	0	0	0	115.2	D854 F855 R1003 E1004	D854-L857 CarbonylContact O-C 3.59Å; D854-L857 PolarHBondContact O-N 2.94Å; F855-L857 PolarHBondContact O-N 2.83Å; L857-R1003 VanDerWaalsContact C-NH2 3.32Å; L857-R1003 PolarHBondContact O-NH2 3.45Å; L857-E1004 HydrophobicContact CD2-CG 3.94Å; L857-E1004 WeakPolarHBondContact CD2-OE1 3.21Å
858	S	89.3	Confident	93.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-133	-11.7	-170.2	-56.5	0	0	0	0	114.1	D854 F855 R870 S871	D854-S858 VanDerWaalsContact O-CB 3.26Å; D854-S858 WeakPolarHBondContact O-CB 3.41Å; D854-S858 PolarHBondContact O-N 3.4Å; D854-S858 PolarHBondContact O-OG 3.45Å; D854-S858 WeakPolarHBondContact OD1-CB 3.48Å; D854-S858 PolarHBondContact OD1-OG 2.9Å; F855-S858 PolarHBondContact O-N 3.37Å; S858-R870 WeakPolarHBondContact O-CA 3.39Å; S858-S871 WeakPolarHBondContact O-CB 3.46Å; S858-S871 PolarHBondContact O-N 3.15Å
859	Y	93.1	Very high	93.6	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	145.5	-173.3	-74.1	-110.4	0	0	0	113.3	F855 F868 V869 R870 L914 N1007	F855-Y859 HydrophobicContact CB-CD2 4.36Å; F855-Y859 HydrophobicContact CD2-CD1 4.11Å; F855-Y859 AromaticContact CD2-CD2 3.9Å; F855-Y859 HydrophobicContact CD2-CD2 3.9Å; F855-Y859 HydrophobicContact CD2-CE2 4.35Å; F855-Y859 AromaticContact CD2-CG 3.75Å; F855-Y859 HydrophobicContact CD2-CG 3.75Å; F855-Y859 HydrophobicContact CE2-CD1 4.27Å; F855-Y859 HydrophobicContact CE2-CG 4.13Å; F855-Y859 HydrophobicContact CG-CD2 4.46Å; F855-Y859 WeakPolarHBondContact O-CB 3.29Å; F855-Y859 PolarHBondContact O-N 3.38Å; Y859-F868 HydrophobicContact CD1-CB 3.8Å; Y859-F868 HydrophobicContact CG-CB 4.43Å; Y859-V869 CarbonylContact C-O 3.51Å; Y859-V869 WeakPolarHBondContact CA-O 3.49Å; Y859-R870 HydrophobicContact CD2-CG 4.5Å; Y859-R870 HydrophobicContact CE1-CG 4.18Å; Y859-R870 HydrophobicContact CE2-CG 4.14Å; Y859-R870 PolarHBondContact OH-NH2 3.31Å; Y859-L914 HydrophobicContact CE1-CB 4.34Å; Y859-N1007 PolarHBondContact O-ND2 2.86Å
860	C	94.2	Very high	93.3	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.034	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.5	177.7	-65.6	0	0	0	0	109	F868 V869 T1158	C860-F868 WeakPolarHBondContact O-CA 3.03Å; C860-V869 HydrophobicContact CB-CG2 4.39Å; C860-V869 PolarHBondContact N-O 2.89Å; C860-V869 PolarHBondContact O-N 2.73Å; C860-T1158 VanDerWaalsContact SG-C 3.56Å; C860-T1158 PolarHBondContact SG-O 3.49Å
861	Y	97	Very high	93	Very high	13 Å²	13	42.7 Å²	42.7	5%	0.051	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.4	174.8	-174.6	-117.2	0	0	0	112.1	N866 F868 L1010 H1014 E1161	Y861-N866 PolarHBondContact OH-OD1 3.11Å; Y861-F868 AromaticContact CD2-CD1 3.96Å; Y861-F868 HydrophobicContact CD2-CD1 3.96Å; Y861-F868 AromaticContact CD2-CD2 3.84Å; Y861-F868 HydrophobicContact CD2-CD2 3.84Å; Y861-F868 AromaticContact CD2-CE1 3.72Å; Y861-F868 HydrophobicContact CD2-CE1 3.72Å; Y861-F868 AromaticContact CD2-CE2 3.57Å; Y861-F868 HydrophobicContact CD2-CE2 3.57Å; Y861-F868 HydrophobicContact CD2-CG 4.03Å; Y861-F868 AromaticContact CD2-CZ 3.52Å; Y861-F868 HydrophobicContact CD2-CZ 3.52Å; Y861-F868 HydrophobicContact CE2-CD2 4.41Å; Y861-F868 AromaticContact CE2-CE2 3.99Å; Y861-F868 HydrophobicContact CE2-CE2 3.99Å; Y861-F868 HydrophobicContact CE2-CZ 4.21Å; Y861-F868 HydrophobicContact CG-CD1 4.33Å; Y861-F868 AromaticContact CG-CE1 3.97Å; Y861-F868 HydrophobicContact CG-CE1 3.97Å; Y861-F868 HydrophobicContact CG-CZ 4.1Å; Y861-L1010 HydrophobicContact CD1-CD1 3.5Å; Y861-L1010 VanDerWaalsContact CD1-CD1 3.5Å; Y861-L1010 HydrophobicContact CD1-CD2 3.76Å; Y861-L1010 HydrophobicContact CD1-CG 4.28Å; Y861-L1010 HydrophobicContact CD2-CD1 4.37Å; Y861-L1010 HydrophobicContact CE1-CD1 4.28Å; Y861-L1010 HydrophobicContact CE1-CD2 3.66Å; Y861-L1010 HydrophobicContact CG-CD1 3.56Å; Y861-L1010 HydrophobicContact CG-CD2 4.3Å; Y861-L1010 HydrophobicContact CG-CG 4.5Å; Y861-H1014 AromaticContact CE2-NE2 3.27Å; Y861-H1014 VanDerWaalsContact CE2-NE2 3.27Å; Y861-H1014 WeakPolarHBondContact CE2-NE2 3.36Å; Y861-H1014 AromaticContact CZ-NE2 3.33Å; Y861-H1014 VanDerWaalsContact CZ-NE2 3.33Å; Y861-H1014 PolarHBondContact OH-CE1 3.39Å; Y861-H1014 VanDerWaalsContact OH-CE1 3.31Å; Y861-H1014 PolarHBondContact OH-NE2 3.28Å; Y861-E1161 HydrophobicContact CD1-CB 4.04Å; Y861-E1161 PolarHBondContact O-N 3.34Å
862	N	94.8	Very high	92.1	Very high	65 Å²	65	50 Å²	50	35%	0.348	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	107.8	170.6	179.2	-35	0	0	0	109.3	A864 T865 N866 R867	N862-A864 VanDerWaalsContact C-N 3.31Å; N862-A864 PolarHBondContact O-N 3.48Å; N862-A864 WeakPolarHBondContact OD1-CB 3.22Å; N862-A864 PolarHBondContact OD1-N 3.08Å; N862-T865 PolarHBondContact O-N 3.47Å; N862-T865 PolarHBondContact O-OG1 2.94Å; N862-T865 PolarHBondContact OD1-N 3.27Å; N862-N866 WeakPolarHBondContact O-CA 3.4Å; N862-N866 PolarHBondContact O-N 3.19Å; N862-R867 PolarHBondContact N-O 2.98Å; N862-R867 PolarHBondContact O-N 2.88Å
863	G	92.3	Very high	91.1	Very high	25 Å²	25	51.4 Å²	51.4	26%	0.258	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-23.8	-175.3	0	0	0	0	0	114.1	T865 N866 E1161	G863-T865 VanDerWaalsContact C-N 3.32Å; G863-N866 PolarHBondContact O-OD1 3.01Å; G863-E1161 WeakPolarHBondContact CA-OE2 3.32Å; G863-E1161 PolarHBondContact N-OE1 3.41Å; G863-E1161 PolarHBondContact N-OE2 2.74Å
864	A	93	Very high	89.6	Confident	94 Å²	94	48 Å²	48	78%	0.777	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-32.1	175.5	0	0	0	0	0	112.1	N862	N862-A864 VanDerWaalsContact C-N 3.31Å; N862-A864 PolarHBondContact O-N 3.48Å; N862-A864 WeakPolarHBondContact OD1-CB 3.22Å; N862-A864 PolarHBondContact OD1-N 3.08Å
865	T	95	Very high	87.7	Confident	74 Å²	74	51.7 Å²	51.7	45%	0.454	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-11.6	179.1	62.7	0	0	0	0	113.6	N862 G863 R867	N862-T865 PolarHBondContact O-N 3.47Å; N862-T865 PolarHBondContact O-OG1 2.94Å; N862-T865 PolarHBondContact OD1-N 3.27Å; G863-T865 VanDerWaalsContact C-N 3.32Å; T865-R867 PolarHBondContact O-N 3.42Å; T865-R867 PolarHBondContact OG1-N 2.83Å
866	N	94.9	Very high	85.4	Confident	88 Å²	88	56.1 Å²	56.1	47%	0.471	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	41.3	-168.1	-65.1	-51.1	0	0	0	112.5	Y861 N862 G863	Y861-N866 PolarHBondContact OH-OD1 3.11Å; N862-N866 WeakPolarHBondContact O-CA 3.4Å; N862-N866 PolarHBondContact O-N 3.19Å; G863-N866 PolarHBondContact O-OD1 3.01Å
867	R	97.1	Very high	83.1	Confident	117 Å²	117	60.5 Å²	60.5	44%	0.442	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.3	179.7	-66.7	176.9	-179.4	-170	-1.4	111.1	N862 T865 F913 L914	N862-R867 PolarHBondContact N-O 2.98Å; N862-R867 PolarHBondContact O-N 2.88Å; T865-R867 PolarHBondContact O-N 3.42Å; T865-R867 PolarHBondContact OG1-N 2.83Å; R867-F913 HydrophobicContact CB-CD2 4.18Å; R867-F913 HydrophobicContact CG-CD2 3.66Å; R867-F913 HydrophobicContact CG-CE2 4.12Å; R867-F913 HydrophobicContact CG-CG 4.43Å; R867-L914 CarbonylContact C-O 3.58Å; R867-L914 WeakPolarHBondContact CA-O 3.43Å
868	F	96.7	Very high	81.3	Confident	0 Å²	0	60 Å²	60	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.4	166.1	-63.8	-97.9	0	0	0	109.4	F855 Y859 C860 Y861 F913 L914 F919 L1010	F855-F868 HydrophobicContact CE1-CE1 4.31Å; F855-F868 HydrophobicContact CE2-CB 4Å; F855-F868 AromaticContact CE2-CD1 3.82Å; F855-F868 HydrophobicContact CE2-CD1 3.82Å; F855-F868 HydrophobicContact CE2-CD2 4.07Å; F855-F868 HydrophobicContact CE2-CE1 4.23Å; F855-F868 HydrophobicContact CE2-CE2 4.48Å; F855-F868 AromaticContact CE2-CG 3.72Å; F855-F868 HydrophobicContact CE2-CG 3.72Å; F855-F868 AromaticContact CZ-CD1 3.59Å; F855-F868 HydrophobicContact CZ-CD1 3.59Å; F855-F868 AromaticContact CZ-CD2 3.97Å; F855-F868 HydrophobicContact CZ-CD2 3.97Å; F855-F868 AromaticContact CZ-CE1 3.51Å; F855-F868 HydrophobicContact CZ-CE1 3.51Å; F855-F868 AromaticContact CZ-CE2 3.92Å; F855-F868 HydrophobicContact CZ-CE2 3.92Å; F855-F868 AromaticContact CZ-CG 3.8Å; F855-F868 HydrophobicContact CZ-CG 3.8Å; F855-F868 AromaticContact CZ-CZ 3.67Å; F855-F868 HydrophobicContact CZ-CZ 3.67Å; Y859-F868 HydrophobicContact CD1-CB 3.8Å; Y859-F868 HydrophobicContact CG-CB 4.43Å; C860-F868 WeakPolarHBondContact O-CA 3.03Å; Y861-F868 AromaticContact CD2-CD1 3.96Å; Y861-F868 HydrophobicContact CD2-CD1 3.96Å; Y861-F868 AromaticContact CD2-CD2 3.84Å; Y861-F868 HydrophobicContact CD2-CD2 3.84Å; Y861-F868 AromaticContact CD2-CE1 3.72Å; Y861-F868 HydrophobicContact CD2-CE1 3.72Å; Y861-F868 AromaticContact CD2-CE2 3.57Å; Y861-F868 HydrophobicContact CD2-CE2 3.57Å; Y861-F868 HydrophobicContact CD2-CG 4.03Å; Y861-F868 AromaticContact CD2-CZ 3.52Å; Y861-F868 HydrophobicContact CD2-CZ 3.52Å; Y861-F868 HydrophobicContact CE2-CD2 4.41Å; Y861-F868 AromaticContact CE2-CE2 3.99Å; Y861-F868 HydrophobicContact CE2-CE2 3.99Å; Y861-F868 HydrophobicContact CE2-CZ 4.21Å; Y861-F868 HydrophobicContact CG-CD1 4.33Å; Y861-F868 AromaticContact CG-CE1 3.97Å; Y861-F868 HydrophobicContact CG-CE1 3.97Å; Y861-F868 HydrophobicContact CG-CZ 4.1Å; F868-F913 CarbonylContact O-C 3.44Å; F868-F913 WeakPolarHBondContact O-CA 3.36Å; F868-L914 HydrophobicContact CB-CB 4.22Å; F868-L914 HydrophobicContact CD2-CD2 4.21Å; F868-L914 PolarHBondContact N-O 3.42Å; F868-L914 PolarHBondContact O-N 3.49Å; F868-F919 HydrophobicContact CD2-CE2 4.39Å; F868-F919 HydrophobicContact CE2-CE2 4.02Å; F868-F919 AromaticContact CE2-CZ 3.99Å; F868-F919 HydrophobicContact CE2-CZ 3.99Å; F868-L1010 HydrophobicContact CE1-CB 4.29Å; F868-L1010 HydrophobicContact CE1-CD1 4.27Å; F868-L1010 HydrophobicContact CZ-CB 3.74Å; F868-L1010 HydrophobicContact CZ-CD1 4.36Å
869	V	94	Very high	80	Confident	65 Å²	65	64.4 Å²	64.4	39%	0.394	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.1	175.6	-65.8	0	0	0	0	109.5	Y859 C860 F913	Y859-V869 CarbonylContact C-O 3.51Å; Y859-V869 WeakPolarHBondContact CA-O 3.49Å; C860-V869 HydrophobicContact CB-CG2 4.39Å; C860-V869 PolarHBondContact N-O 2.89Å; C860-V869 PolarHBondContact O-N 2.73Å; V869-F913 HydrophobicContact CG1-CB 4.36Å
870	R	89.9	Confident	79.1	Confident	111 Å²	111	65.7 Å²	65.7	42%	0.419	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	140.9	178.5	-74.3	-175.7	179.9	-84.2	-3	111.3	D854 S858 Y859	D854-R870 IonicContact OD1-CZ 2.79Å; D854-R870 IonicContact OD1-NH1 2.75Å; D854-R870 PolarHBondContact OD1-NH1 3.22Å; D854-R870 IonicContact OD1-NH2 3.59Å; D854-R870 IonicContact OD2-CZ 3.69Å; D854-R870 IonicContact OD2-NH1 3.53Å; D854-R870 PolarHBondContact OD2-NH1 2.94Å; D854-R870 IonicContact OD2-NH2 3.61Å; D854-R870 PolarHBondContact OD2-NH2 3.39Å; S858-R870 WeakPolarHBondContact O-CA 3.39Å; Y859-R870 HydrophobicContact CD2-CG 4.5Å; Y859-R870 HydrophobicContact CE1-CG 4.18Å; Y859-R870 HydrophobicContact CE2-CG 4.14Å; Y859-R870 PolarHBondContact OH-NH2 3.31Å
871	S	86.6	Confident	78.4	Confident	11 Å²	11	74.2 Å²	74.2	8%	0.077	44%	0.441	C	S	.	.			trans	-65.3	134.3	174.8	-179.2	0	0	0	0	111	S858 V873 S874 T1158	S858-S871 WeakPolarHBondContact O-CB 3.46Å; S858-S871 PolarHBondContact O-N 3.15Å; S871-V873 PolarHBondContact O-N 3.42Å; S871-V873 PolarHBondContact OG-N 2.88Å; S871-S874 PolarHBondContact O-OG 3.05Å; S871-T1158 WeakPolarHBondContact CB-O 3.39Å; S871-T1158 PolarHBondContact OG-O 2.93Å
872	K	76.3	Confident	77.8	Confident	153 Å²	153	77 Å²	77	67%	0.665	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.2	177.5	-68.2	-177.8	179.9	171.6	0	113.5	E1157	K872-E1157 IonicContact NZ-OE1 3.09Å; K872-E1157 PolarHBondContact NZ-OE1 3.3Å
873	V	70.2	Confident	77.2	Confident	77 Å²	77	80.6 Å²	80.6	47%	0.467	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	14.6	-173.2	-158	0	0	0	0	111.5	S871 S875 V1153 T1158	S871-V873 PolarHBondContact O-N 3.42Å; S871-V873 PolarHBondContact OG-N 2.88Å; V873-S875 PolarHBondContact O-N 3.12Å; V873-V1153 HydrophobicContact CG2-CB 3.78Å; V873-V1153 HydrophobicContact CG2-CG1 3.55Å; V873-V1153 HydrophobicContact CG2-CG2 3.96Å; V873-T1158 HydrophobicContact CB-CG2 4Å; V873-T1158 HydrophobicContact CG2-CG2 4.01Å; V873-T1158 WeakPolarHBondContact CG2-OG1 3.24Å
874	S	58.5	Low	76.8	Confident	50 Å²	50	84.8 Å²	84.8	35%	0.35	50%	0.496	S	S	.	.			trans	-55.7	114.2	176.1	-66.8	0	0	0	0	109.2	S871 A876	S871-S874 PolarHBondContact O-OG 3.05Å; S874-A876 PolarHBondContact O-N 3.41Å
875	S	52.3	Low	76.2	Confident	82 Å²	82	83.3 Å²	83.3	57%	0.573	48%	0.478	S	S	*	.			trans	-54	139.4	174.6	175.3	0	0	0	0	108.6	V873 A877 S878	V873-S875 PolarHBondContact O-N 3.12Å; S875-A877 PolarHBondContact O-N 3.44Å; S875-A877 PolarHBondContact OG-N 2.96Å; S875-S878 PolarHBondContact O-N 3.01Å; S875-S878 PolarHBondContact O-OG 3.36Å
876	A	44.7	Very low	75.4	Confident	93 Å²	93	82.3 Å²	82.3	77%	0.769	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-52.2	-15	173.7	0	0	0	0	0	113.6	S874 S878	S874-A876 PolarHBondContact O-N 3.41Å; A876-S878 PolarHBondContact O-N 3.26Å
877	A	44.9	Very low	74.9	Confident	94 Å²	94	87.7 Å²	87.7	78%	0.777	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-67.5	-12.1	172.4	0	0	0	0	0	115.3	S875	S875-A877 PolarHBondContact O-N 3.44Å; S875-A877 PolarHBondContact OG-N 2.96Å
878	S	53.3	Low	74.5	Confident	39 Å²	39	83.8 Å²	83.8	27%	0.273	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-102.9	13.4	179.6	68.5	0	0	0	0	114.8	S875 A876 V880	S875-S878 PolarHBondContact O-N 3.01Å; S875-S878 PolarHBondContact O-OG 3.36Å; A876-S878 PolarHBondContact O-N 3.26Å; S878-V880 VanDerWaalsContact C-N 3.32Å; S878-V880 PolarHBondContact O-N 2.91Å
879	S	60.7	Low	74.3	Confident	94 Å²	94	87.8 Å²	87.8	66%	0.657	51%	0.513	S	S	*	.			trans	-70.4	92.9	170	66.3	0	0	0	0	109.2	Q881	S879-Q881 PolarHBondContact O-N 3.33Å
880	V	74.8	Confident	74.2	Confident	30 Å²	30	85.7 Å²	85.7	18%	0.182	50%	0.502	C	S	.	.			trans	-53.8	112.8	171.9	177.9	0	0	0	0	108.2	W849 Y853 D854 S878 R882	W849-V880 HydrophobicContact CH2-CG1 3.12Å; W849-V880 HydrophobicContact CZ2-CG1 3.99Å; W849-V880 HydrophobicContact CZ3-CG1 3.54Å; Y853-V880 VanDerWaalsContact O-CG2 3.23Å; Y853-V880 WeakPolarHBondContact O-CG2 3.3Å; D854-V880 HydrophobicContact CB-CG2 4.07Å; S878-V880 VanDerWaalsContact C-N 3.32Å; S878-V880 PolarHBondContact O-N 2.91Å; V880-R882 HydrophobicContact CG1-CG 4.24Å; V880-R882 PolarHBondContact O-N 3.12Å
881	Q	79	Confident	74.4	Confident	183 Å²	183	81.6 Å²	81.6	86%	0.855	49%	0.49	S	S	*	.			trans	-69.2	117.5	172.9	-79.3	-172.5	-19.5	0	0	108	S879	S879-Q881 PolarHBondContact O-N 3.33Å
882	R	84.6	Confident	74.8	Confident	71 Å²	71	82.2 Å²	82.2	27%	0.268	49%	0.491	S	S	.	.			trans	-108.1	147.6	174.7	-62.2	-174.8	-179	81.3	-1.7	109.1	A792 N793 E850 D854 V880	A792-R882 WeakPolarHBondContact O-CB 3.24Å; A792-R882 VanDerWaalsContact O-CD 3.27Å; A792-R882 WeakPolarHBondContact O-CD 3.42Å; N793-R882 PolarHBondContact O-NE 3.15Å; E850-R882 VanDerWaalsContact CD-NH2 3.31Å; E850-R882 IonicContact OE1-CZ 3.92Å; E850-R882 IonicContact OE1-NE 3.78Å; E850-R882 PolarHBondContact OE1-NE 2.95Å; E850-R882 IonicContact OE1-NH2 2.8Å; E850-R882 PolarHBondContact OE1-NH2 3.3Å; E850-R882 IonicContact OE2-CZ 2.82Å; E850-R882 IonicContact OE2-NE 3.79Å; E850-R882 IonicContact OE2-NH2 3.55Å; E850-R882 PolarHBondContact OE2-NH2 2.7Å; D854-R882 IonicContact OD2-CZ 3.84Å; D854-R882 IonicContact OD2-NH2 2.8Å; D854-R882 PolarHBondContact OD2-NH2 3.06Å; V880-R882 HydrophobicContact CG1-CG 4.24Å; V880-R882 PolarHBondContact O-N 3.12Å
883	D	82.7	Confident	75.7	Confident	142 Å²	142	76.1 Å²	76.1	76%	0.759	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-66.3	149	171.5	-69.4	-30.1	0	0	0	110.3	A792	A792-D883 WeakPolarHBondContact CB-O 3.2Å
884	S	83.8	Confident	76.9	Confident	113 Å²	113	73.4 Å²	73.4	79%	0.79	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-70.8	140.1	177.9	-67.5	0	0	0	0	110.7
885	P	79.8	Confident	78.6	Confident	62 Å²	62	71.1 Å²	71.1	40%	0.403	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-64.8	142.4	-179.7	25.7	-33.2	0	0	0	111.2	A792 Q887	A792-P885 HydrophobicContact CB-CB 3.86Å; A792-P885 HydrophobicContact CB-CG 4.48Å; P885-Q887 PolarHBondContact O-N 3.46Å
886	P	78.8	Confident	80.5	Confident	53 Å²	53	68 Å²	68	34%	0.344	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-65.4	135.7	-180	25.1	-33.1	0	0	0	111.7	L785 N788	L785-P886 HydrophobicContact CD2-CB 4.04Å; L785-P886 HydrophobicContact CD2-CG 3.69Å; N788-P886 HydrophobicContact CB-CG 3.78Å
887	Q	84	Confident	82.9	Confident	202 Å²	202	71.7 Å²	71.7	94%	0.944	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-78.4	125.3	174.7	-66.6	-169	-0.4	0	0	110.6	P885	P885-Q887 PolarHBondContact O-N 3.46Å
888	A	90	Very high	85.1	Confident	35 Å²	35	71.5 Å²	71.5	29%	0.289	39%	0.393	S	S	.	.			trans	-140.8	163.9	175.4	0	0	0	0	0	111.5	L785 Y892 F893	L785-A888 HydrophobicContact CD1-CB 3.49Å; L785-A888 VanDerWaalsContact CD1-CB 3.49Å; L785-A888 HydrophobicContact CD2-CB 4.13Å; L785-A888 HydrophobicContact CG-CB 4.46Å; A888-Y892 HydrophobicContact CB-CD2 4.37Å; A888-F893 HydrophobicContact CB-CE2 3.79Å; A888-F893 HydrophobicContact CB-CZ 4.17Å
889	T	91.9	Very high	87.1	Confident	84 Å²	84	69.6 Å²	69.6	52%	0.515	38%	0.38	S	S	.	.			trans	-63	144.7	175.8	51.9	0	0	0	0	110.8	S891 Y892	T889-S891 PolarHBondContact O-N 3.12Å; T889-S891 PolarHBondContact OG1-OG 2.92Å; T889-Y892 PolarHBondContact O-N 2.92Å; T889-Y892 WeakPolarHBondContact OG1-CD2 3.23Å; T889-Y892 WeakPolarHBondContact OG1-CE2 3.3Å
890	A	92.1	Very high	88.7	Confident	20 Å²	20	66.8 Å²	66.8	17%	0.165	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-55.8	-25	-177.9	0	0	0	0	0	113.7	Y892 F893 G895 K897	A890-Y892 PolarHBondContact O-N 3.26Å; A890-F893 PolarHBondContact O-N 3.34Å; A890-F893 VanDerWaalsContact O-N 3.1Å; A890-G895 CarbonylContact O-C 3.55Å; A890-G895 WeakPolarHBondContact O-CA 3.5Å; A890-G895 PolarHBondContact O-N 2.99Å; A890-K897 HydrophobicContact CB-CG 4.25Å
891	S	92.7	Very high	89.5	Confident	25 Å²	25	68.7 Å²	68.7	18%	0.175	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-58.4	-26.6	173.8	52.6	0	0	0	0	114.3	F714 K718 T889	F714-S891 WeakPolarHBondContact CE1-O 3.28Å; K718-S891 VanDerWaalsContact CE-O 3.27Å; K718-S891 WeakPolarHBondContact CE-O 3.37Å; K718-S891 WeakPolarHBondContact CG-O 3.49Å; T889-S891 PolarHBondContact O-N 3.12Å; T889-S891 PolarHBondContact OG1-OG 2.92Å
892	Y	96.4	Very high	90.3	Very high	24 Å²	24	60.2 Å²	60.2	9%	0.094	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-86	-11.4	177.4	-66.3	-71.4	0	0	0	113.6	F714 A778 K781 S782 L785 A888 T889 A890	F714-Y892 AromaticContact CE1-CD1 3.76Å; F714-Y892 HydrophobicContact CE1-CD1 3.76Å; F714-Y892 AromaticContact CE1-CE1 3.93Å; F714-Y892 HydrophobicContact CE1-CE1 3.93Å; F714-Y892 HydrophobicContact CZ-CD1 4.15Å; F714-Y892 HydrophobicContact CZ-CE1 4.48Å; A778-Y892 HydrophobicContact CB-CE1 4.21Å; K781-Y892 HydrophobicContact CB-CE1 4.33Å; K781-Y892 HydrophobicContact CD-CD1 4.46Å; K781-Y892 HydrophobicContact CD-CE1 3.95Å; K781-Y892 HydrophobicContact CD-CE2 4.49Å; K781-Y892 HydrophobicContact CG-CD1 4.29Å; K781-Y892 HydrophobicContact CG-CE1 4.19Å; S782-Y892 PolarHBondContact OG-O 2.97Å; L785-Y892 HydrophobicContact CD1-CD2 4.38Å; L785-Y892 HydrophobicContact CD1-CG 3.97Å; A888-Y892 HydrophobicContact CB-CD2 4.37Å; T889-Y892 PolarHBondContact O-N 2.92Å; T889-Y892 WeakPolarHBondContact OG1-CD2 3.23Å; T889-Y892 WeakPolarHBondContact OG1-CE2 3.3Å; A890-Y892 PolarHBondContact O-N 3.26Å
893	F	95.2	Very high	90.7	Very high	25 Å²	25	57.2 Å²	57.2	11%	0.11	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-104.7	177.4	-62.1	-73.3	0	0	0	110.3	K718 L785 L804 A888 A890 G895	K718-F893 WeakPolarHBondContact CE-O 3.25Å; K718-F893 PolarHBondContact NZ-O 2.92Å; L785-F893 HydrophobicContact CB-CE1 4.25Å; L804-F893 VanDerWaalsContact CD1-O 3.29Å; L804-F893 WeakPolarHBondContact CD1-O 3.5Å; L804-F893 HydrophobicContact CD2-CD1 4.21Å; A888-F893 HydrophobicContact CB-CE2 3.79Å; A888-F893 HydrophobicContact CB-CZ 4.17Å; A890-F893 PolarHBondContact O-N 3.34Å; A890-F893 VanDerWaalsContact O-N 3.1Å; F893-G895 VanDerWaalsContact C-N 3.35Å
894	W	95	Very high	91.2	Very high	21 Å²	21	53.7 Å²	53.7	8%	0.08	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	17.9	-179.2	-48	94.1	0	0	0	112.4	S722 L804 L807 S896 F899 N900 F903 Y907	S722-W894 WeakPolarHBondContact CB-O 3.47Å; S722-W894 PolarHBondContact OG-O 3.19Å; L804-W894 HydrophobicContact CB-CH2 3.74Å; L804-W894 HydrophobicContact CB-CZ2 3.97Å; L804-W894 HydrophobicContact CB-CZ3 4.36Å; L804-W894 HydrophobicContact CD1-CD2 4.05Å; L804-W894 HydrophobicContact CD1-CE3 4.16Å; L804-W894 HydrophobicContact CD1-CH2 4.17Å; L804-W894 HydrophobicContact CD1-CZ2 4.14Å; L804-W894 HydrophobicContact CD1-CZ3 4.19Å; L804-W894 HydrophobicContact CG-CZ2 4.48Å; L807-W894 HydrophobicContact CB-CZ3 4.49Å; L807-W894 HydrophobicContact CD1-CD2 4.34Å; L807-W894 HydrophobicContact CD1-CE3 3.33Å; L807-W894 HydrophobicContact CD1-CZ3 3.81Å; W894-S896 PolarHBondContact O-N 2.94Å; W894-F899 HydrophobicContact CB-CB 4Å; W894-F899 WeakPolarHBondContact O-CB 3.44Å; W894-N900 WeakPolarHBondContact CA-OD1 3.42Å; W894-N900 WeakPolarHBondContact CB-OD1 3.42Å; W894-N900 VanDerWaalsContact CD1-OD1 3.26Å; W894-N900 PolarHBondContact N-OD1 3.45Å; W894-F903 HydrophobicContact CB-CD2 3.8Å; W894-F903 HydrophobicContact CD2-CB 3.45Å; W894-F903 VanDerWaalsContact CD2-CB 3.45Å; W894-F903 HydrophobicContact CD2-CD1 4.43Å; W894-F903 AromaticContact CD2-CD2 3.75Å; W894-F903 HydrophobicContact CD2-CD2 3.75Å; W894-F903 AromaticContact CD2-CG 3.63Å; W894-F903 HydrophobicContact CD2-CG 3.63Å; W894-F903 HydrophobicContact CE3-CB 3.66Å; W894-F903 AromaticContact CE3-CD1 3.75Å; W894-F903 HydrophobicContact CE3-CD1 3.75Å; W894-F903 AromaticContact CE3-CD2 3.42Å; W894-F903 HydrophobicContact CE3-CD2 3.42Å; W894-F903 VanDerWaalsContact CE3-CD2 3.42Å; W894-F903 HydrophobicContact CE3-CE1 4.21Å; W894-F903 AromaticContact CE3-CE2 3.94Å; W894-F903 HydrophobicContact CE3-CE2 3.94Å; W894-F903 AromaticContact CE3-CG 3.31Å; W894-F903 HydrophobicContact CE3-CG 3.31Å; W894-F903 HydrophobicContact CE3-CZ 4.29Å; W894-F903 HydrophobicContact CG-CB 3.83Å; W894-F903 AromaticContact CG-CD2 3.91Å; W894-F903 HydrophobicContact CG-CD2 3.91Å; W894-F903 HydrophobicContact CG-CG 4.14Å; W894-F903 HydrophobicContact CH2-CB 4.43Å; W894-F903 HydrophobicContact CH2-CD1 4.49Å; W894-F903 HydrophobicContact CZ2-CB 4.19Å; W894-F903 HydrophobicContact CZ3-CB 4.18Å; W894-F903 AromaticContact CZ3-CD1 3.81Å; W894-F903 HydrophobicContact CZ3-CD1 3.81Å; W894-F903 HydrophobicContact CZ3-CD2 4.32Å; W894-F903 HydrophobicContact CZ3-CE1 4.23Å; W894-F903 AromaticContact CZ3-CG 3.85Å; W894-F903 HydrophobicContact CZ3-CG 3.85Å; W894-Y907 AromaticContact CH2-CD2 3.98Å; W894-Y907 HydrophobicContact CH2-CD2 3.98Å; W894-Y907 AromaticContact CH2-CE2 3.3Å; W894-Y907 HydrophobicContact CH2-CE2 3.3Å; W894-Y907 AromaticContact CZ2-CD2 3.97Å; W894-Y907 HydrophobicContact CZ2-CD2 3.97Å; W894-Y907 AromaticContact CZ2-CE2 3.76Å; W894-Y907 HydrophobicContact CZ2-CE2 3.76Å; W894-Y907 AromaticContact CZ3-CE2 3.86Å; W894-Y907 HydrophobicContact CZ3-CE2 3.86Å
895	G	93.3	Very high	91.6	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	91.5	-39.1	170.4	0	0	0	0	0	115.7	Q719 A890 F893	Q719-G895 WeakPolarHBondContact CG-O 3.14Å; Q719-G895 PolarHBondContact NE2-O 2.92Å; A890-G895 CarbonylContact O-C 3.55Å; A890-G895 WeakPolarHBondContact O-CA 3.5Å; A890-G895 PolarHBondContact O-N 2.99Å; F893-G895 VanDerWaalsContact C-N 3.35Å
896	S	93.8	Very high	92.3	Very high	17 Å²	17	51.6 Å²	51.6	12%	0.119	29%	0.286	C	S	.	.	S	Bend	trans	-144.3	168.8	176.2	83	0	0	0	0	111.9	W894 D898 F899 N900	W894-S896 PolarHBondContact O-N 2.94Å; S896-D898 VanDerWaalsContact C-N 3.3Å; S896-D898 PolarHBondContact O-N 3.43Å; S896-D898 PolarHBondContact OG-N 3.31Å; S896-F899 PolarHBondContact O-N 3.41Å; S896-F899 WeakPolarHBondContact OG-CD2 3.15Å; S896-F899 PolarHBondContact OG-N 2.88Å; S896-N900 WeakPolarHBondContact O-CB 3.41Å; S896-N900 VanDerWaalsContact O-CG 3.3Å; S896-N900 PolarHBondContact O-N 3.45Å; S896-N900 PolarHBondContact O-OD1 2.69Å
897	K	93.9	Very high	93	Very high	169 Å²	169	51.2 Å²	51.2	74%	0.735	28%	0.278	S	S	*	.	H	α-helix	trans	-61.5	-39.5	175.6	-68.5	-175.1	178.3	-178.2	0	111.8	A890 N900 S901	A890-K897 HydrophobicContact CB-CG 4.25Å; K897-N900 PolarHBondContact O-N 2.91Å; K897-S901 PolarHBondContact O-N 3.32Å; K897-S901 PolarHBondContact O-OG 3.36Å
898	D	92.3	Very high	93.5	Very high	90 Å²	90	43.9 Å²	43.9	48%	0.481	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-44.3	179.3	-54.3	-38.4	0	0	0	111.4	S896 S901 A902	S896-D898 VanDerWaalsContact C-N 3.3Å; S896-D898 PolarHBondContact O-N 3.43Å; S896-D898 PolarHBondContact OG-N 3.31Å; D898-S901 PolarHBondContact O-N 2.86Å; D898-A902 WeakPolarHBondContact O-CB 3.5Å; D898-A902 PolarHBondContact O-N 3.43Å
899	F	94.5	Very high	93.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.9	-39.1	175.7	-73.6	-60.3	0	0	0	111.9	Q719 L726 I741 V744 W894 S896 S901 A902 F903	Q719-F899 HydrophobicContact CB-CD2 4.45Å; Q719-F899 HydrophobicContact CB-CE2 4.11Å; Q719-F899 HydrophobicContact CG-CD2 4.35Å; Q719-F899 HydrophobicContact CG-CE2 4.39Å; L726-F899 HydrophobicContact CD2-CD1 4.45Å; L726-F899 HydrophobicContact CD2-CE1 4.17Å; I741-F899 HydrophobicContact CG2-CD1 4.17Å; I741-F899 HydrophobicContact CG2-CE1 3.81Å; I741-F899 HydrophobicContact CG2-CZ 4.38Å; V744-F899 HydrophobicContact CG2-CE2 4.14Å; V744-F899 HydrophobicContact CG2-CZ 4.33Å; W894-F899 HydrophobicContact CB-CB 4Å; W894-F899 WeakPolarHBondContact O-CB 3.44Å; S896-F899 PolarHBondContact O-N 3.41Å; S896-F899 WeakPolarHBondContact OG-CD2 3.15Å; S896-F899 PolarHBondContact OG-N 2.88Å; F899-S901 VanDerWaalsContact C-N 3.31Å; F899-S901 PolarHBondContact O-N 3.4Å; F899-A902 PolarHBondContact O-N 3.07Å; F899-F903 HydrophobicContact CB-CD2 4.36Å; F899-F903 HydrophobicContact CD1-CE2 4.26Å; F899-F903 VanDerWaalsContact O-CD2 3.31Å; F899-F903 WeakPolarHBondContact O-CD2 3.35Å; F899-F903 PolarHBondContact O-N 3.45Å
900	N	94.1	Very high	93.8	Very high	35 Å²	35	47.8 Å²	47.8	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-47.3	174.6	-80	8	0	0	0	111	W894 S896 K897 S904	W894-N900 WeakPolarHBondContact CA-OD1 3.42Å; W894-N900 WeakPolarHBondContact CB-OD1 3.42Å; W894-N900 VanDerWaalsContact CD1-OD1 3.26Å; W894-N900 PolarHBondContact N-OD1 3.45Å; S896-N900 WeakPolarHBondContact O-CB 3.41Å; S896-N900 VanDerWaalsContact O-CG 3.3Å; S896-N900 PolarHBondContact O-N 3.45Å; S896-N900 PolarHBondContact O-OD1 2.69Å; K897-N900 PolarHBondContact O-N 2.91Å; N900-S904 VanDerWaalsContact O-CB 3.22Å; N900-S904 WeakPolarHBondContact O-CB 3.41Å; N900-S904 PolarHBondContact O-N 2.85Å; N900-S904 PolarHBondContact O-OG 2.82Å
901	S	92.8	Very high	93.7	Very high	70 Å²	70	49.5 Å²	49.5	49%	0.49	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-43.1	177.1	-60.6	0	0	0	0	112.2	K897 D898 F899 N905	K897-S901 PolarHBondContact O-N 3.32Å; K897-S901 PolarHBondContact O-OG 3.36Å; D898-S901 PolarHBondContact O-N 2.86Å; F899-S901 VanDerWaalsContact C-N 3.31Å; F899-S901 PolarHBondContact O-N 3.4Å; S901-N905 PolarHBondContact O-N 3.25Å; S901-N905 VanDerWaalsContact O-N 3.07Å; S901-N905 PolarHBondContact O-ND2 3.04Å; S901-N905 VanDerWaalsContact O-ND2 3.15Å
902	A	93.8	Very high	93.6	Very high	5 Å²	5	51.2 Å²	51.2	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-52.7	179	0	0	0	0	0	112.3	L726 F730 I741 D898 F899 N905 L906	L726-A902 HydrophobicContact CD1-CB 4.19Å; F730-A902 HydrophobicContact CE1-CB 3.91Å; F730-A902 HydrophobicContact CZ-CB 4.49Å; I741-A902 HydrophobicContact CD1-CB 3.88Å; D898-A902 WeakPolarHBondContact O-CB 3.5Å; D898-A902 PolarHBondContact O-N 3.43Å; F899-A902 PolarHBondContact O-N 3.07Å; A902-N905 PolarHBondContact O-N 3.06Å; A902-L906 WeakPolarHBondContact O-CG 3.4Å; A902-L906 PolarHBondContact O-N 3.45Å; A902-L906 VanDerWaalsContact O-N 3.08Å
903	F	95	Very high	93.6	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-68.7	-36.5	179.7	-77.7	-73.8	0	0	0	112.2	L726 L807 W894 F899 N905 L906 Y907	L726-F903 HydrophobicContact CB-CZ 4.11Å; L726-F903 HydrophobicContact CD1-CE1 4.3Å; L726-F903 HydrophobicContact CD1-CE2 4.25Å; L726-F903 HydrophobicContact CD1-CZ 4.07Å; L807-F903 HydrophobicContact CD1-CE2 4.5Å; W894-F903 HydrophobicContact CB-CD2 3.8Å; W894-F903 HydrophobicContact CD2-CB 3.45Å; W894-F903 VanDerWaalsContact CD2-CB 3.45Å; W894-F903 HydrophobicContact CD2-CD1 4.43Å; W894-F903 AromaticContact CD2-CD2 3.75Å; W894-F903 HydrophobicContact CD2-CD2 3.75Å; W894-F903 AromaticContact CD2-CG 3.63Å; W894-F903 HydrophobicContact CD2-CG 3.63Å; W894-F903 HydrophobicContact CE3-CB 3.66Å; W894-F903 AromaticContact CE3-CD1 3.75Å; W894-F903 HydrophobicContact CE3-CD1 3.75Å; W894-F903 AromaticContact CE3-CD2 3.42Å; W894-F903 HydrophobicContact CE3-CD2 3.42Å; W894-F903 VanDerWaalsContact CE3-CD2 3.42Å; W894-F903 HydrophobicContact CE3-CE1 4.21Å; W894-F903 AromaticContact CE3-CE2 3.94Å; W894-F903 HydrophobicContact CE3-CE2 3.94Å; W894-F903 AromaticContact CE3-CG 3.31Å; W894-F903 HydrophobicContact CE3-CG 3.31Å; W894-F903 HydrophobicContact CE3-CZ 4.29Å; W894-F903 HydrophobicContact CG-CB 3.83Å; W894-F903 AromaticContact CG-CD2 3.91Å; W894-F903 HydrophobicContact CG-CD2 3.91Å; W894-F903 HydrophobicContact CG-CG 4.14Å; W894-F903 HydrophobicContact CH2-CB 4.43Å; W894-F903 HydrophobicContact CH2-CD1 4.49Å; W894-F903 HydrophobicContact CZ2-CB 4.19Å; W894-F903 HydrophobicContact CZ3-CB 4.18Å; W894-F903 AromaticContact CZ3-CD1 3.81Å; W894-F903 HydrophobicContact CZ3-CD1 3.81Å; W894-F903 HydrophobicContact CZ3-CD2 4.32Å; W894-F903 HydrophobicContact CZ3-CE1 4.23Å; W894-F903 AromaticContact CZ3-CG 3.85Å; W894-F903 HydrophobicContact CZ3-CG 3.85Å; F899-F903 HydrophobicContact CB-CD2 4.36Å; F899-F903 HydrophobicContact CD1-CE2 4.26Å; F899-F903 VanDerWaalsContact O-CD2 3.31Å; F899-F903 WeakPolarHBondContact O-CD2 3.35Å; F899-F903 PolarHBondContact O-N 3.45Å; F903-N905 VanDerWaalsContact C-N 3.3Å; F903-N905 PolarHBondContact O-N 2.93Å; F903-L906 HydrophobicContact CD1-CD1 4.25Å; F903-L906 PolarHBondContact O-N 2.81Å; F903-Y907 HydrophobicContact CB-CD2 4.18Å; F903-Y907 HydrophobicContact CB-CE2 4.14Å; F903-Y907 HydrophobicContact CD1-CD2 4.48Å; F903-Y907 AromaticContact CD1-CE2 3.72Å; F903-Y907 HydrophobicContact CD1-CE2 3.72Å; F903-Y907 HydrophobicContact CG-CE2 4.37Å; F903-Y907 WeakPolarHBondContact O-CD2 3.37Å; F903-Y907 PolarHBondContact O-N 2.89Å
904	S	92.9	Very high	93.7	Very high	67 Å²	67	50 Å²	50	47%	0.469	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-42	174.7	-58.6	0	0	0	0	111.6	N900 Y907 A908	N900-S904 VanDerWaalsContact O-CB 3.22Å; N900-S904 WeakPolarHBondContact O-CB 3.41Å; N900-S904 PolarHBondContact O-N 2.85Å; N900-S904 PolarHBondContact O-OG 2.82Å; S904-Y907 PolarHBondContact O-N 2.54Å; S904-A908 VanDerWaalsContact O-CB 3.27Å; S904-A908 WeakPolarHBondContact O-CB 3.18Å; S904-A908 PolarHBondContact O-N 3.1Å
905	N	92.3	Very high	93.7	Very high	102 Å²	102	49 Å²	49	55%	0.545	28%	0.28	S	S	.	.	H	α-helix	trans	-66.5	-39.1	175.5	-75.7	-37.1	0	0	0	112.7	S901 A902 F903	S901-N905 PolarHBondContact O-N 3.25Å; S901-N905 VanDerWaalsContact O-N 3.07Å; S901-N905 PolarHBondContact O-ND2 3.04Å; S901-N905 VanDerWaalsContact O-ND2 3.15Å; A902-N905 PolarHBondContact O-N 3.06Å; F903-N905 VanDerWaalsContact C-N 3.3Å; F903-N905 PolarHBondContact O-N 2.93Å
906	L	93	Very high	93.9	Very high	30 Å²	30	51.7 Å²	51.7	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-45.5	175.8	-75.9	169.5	0	0	0	111.5	L726 F730 A902 F903 M909	L726-L906 HydrophobicContact CD1-CD1 3.71Å; F730-L906 HydrophobicContact CB-CD2 4.2Å; F730-L906 HydrophobicContact CD1-CD1 4.12Å; F730-L906 HydrophobicContact CD1-CD2 4.38Å; F730-L906 HydrophobicContact CD1-CG 4.34Å; F730-L906 HydrophobicContact CD2-CD2 3.72Å; F730-L906 HydrophobicContact CD2-CG 4.27Å; F730-L906 HydrophobicContact CE1-CD1 4.37Å; F730-L906 HydrophobicContact CE1-CG 4.39Å; F730-L906 HydrophobicContact CE2-CD2 4.17Å; F730-L906 HydrophobicContact CE2-CG 4.31Å; F730-L906 HydrophobicContact CG-CD1 4.37Å; F730-L906 HydrophobicContact CG-CD2 3.83Å; F730-L906 HydrophobicContact CG-CG 4.28Å; F730-L906 HydrophobicContact CZ-CG 4.37Å; A902-L906 WeakPolarHBondContact O-CG 3.4Å; A902-L906 PolarHBondContact O-N 3.45Å; A902-L906 VanDerWaalsContact O-N 3.08Å; F903-L906 HydrophobicContact CD1-CD1 4.25Å; F903-L906 PolarHBondContact O-N 2.81Å; L906-M909 HydrophobicContact CD2-CE 4.31Å; L906-M909 WeakPolarHBondContact O-CE 3.49Å
907	Y	94.5	Very high	94	Very high	45 Å²	45	52.9 Å²	52.9	18%	0.176	31%	0.31	C	S	.	.	H	α-helix	trans	-79.1	-22.9	-177.5	-69.1	-64	0	0	0	113.6	V799 A800 G803 W894 F903 S904 M909 Y910	V799-Y907 HydrophobicContact CG1-CD1 4.13Å; V799-Y907 HydrophobicContact CG1-CE1 4.16Å; A800-Y907 HydrophobicContact CB-CD1 4.22Å; A800-Y907 HydrophobicContact CB-CD2 4.18Å; A800-Y907 HydrophobicContact CB-CG 3.85Å; G803-Y907 WeakPolarHBondContact CA-OH 3.35Å; W894-Y907 AromaticContact CH2-CD2 3.98Å; W894-Y907 HydrophobicContact CH2-CD2 3.98Å; W894-Y907 AromaticContact CH2-CE2 3.3Å; W894-Y907 HydrophobicContact CH2-CE2 3.3Å; W894-Y907 AromaticContact CZ2-CD2 3.97Å; W894-Y907 HydrophobicContact CZ2-CD2 3.97Å; W894-Y907 AromaticContact CZ2-CE2 3.76Å; W894-Y907 HydrophobicContact CZ2-CE2 3.76Å; W894-Y907 AromaticContact CZ3-CE2 3.86Å; W894-Y907 HydrophobicContact CZ3-CE2 3.86Å; F903-Y907 HydrophobicContact CB-CD2 4.18Å; F903-Y907 HydrophobicContact CB-CE2 4.14Å; F903-Y907 HydrophobicContact CD1-CD2 4.48Å; F903-Y907 AromaticContact CD1-CE2 3.72Å; F903-Y907 HydrophobicContact CD1-CE2 3.72Å; F903-Y907 HydrophobicContact CG-CE2 4.37Å; F903-Y907 WeakPolarHBondContact O-CD2 3.37Å; F903-Y907 PolarHBondContact O-N 2.89Å; S904-Y907 PolarHBondContact O-N 2.54Å; Y907-M909 PolarHBondContact O-N 3.41Å; Y907-Y910 HydrophobicContact CD1-CD2 4.24Å; Y907-Y910 HydrophobicContact CD1-CE2 4.43Å; Y907-Y910 PolarHBondContact O-N 3.1Å
908	A	93.4	Very high	94.2	Very high	48 Å²	48	44.8 Å²	44.8	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-55.4	-27.5	174.1	0	0	0	0	0	112.9	S904 Y910 S911	S904-A908 VanDerWaalsContact O-CB 3.27Å; S904-A908 WeakPolarHBondContact O-CB 3.18Å; S904-A908 PolarHBondContact O-N 3.1Å; A908-Y910 PolarHBondContact O-N 3.16Å; A908-Y910 VanDerWaalsContact O-N 3.17Å; A908-S911 WeakPolarHBondContact O-CB 3.26Å; A908-S911 PolarHBondContact O-N 3.38Å; A908-S911 VanDerWaalsContact O-N 3.16Å; A908-S911 PolarHBondContact O-OG 3.41Å
909	M	93.7	Very high	94.5	Very high	124 Å²	124	40.8 Å²	40.8	61%	0.611	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	174.8	-62.1	-169.2	-69.5	0	0	113.9	L906 Y907	L906-M909 HydrophobicContact CD2-CE 4.31Å; L906-M909 WeakPolarHBondContact O-CE 3.49Å; Y907-M909 PolarHBondContact O-N 3.41Å
910	Y	95.2	Very high	94.7	Very high	76 Å²	76	42.7 Å²	42.7	30%	0.298	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-4.3	-179.8	-59	-83.5	0	0	0	113.5	V799 Y907 A908 F913 P917 H918	V799-Y910 HydrophobicContact CB-CG 4.46Å; V799-Y910 HydrophobicContact CG1-CD1 4.36Å; V799-Y910 HydrophobicContact CG1-CD2 4.12Å; V799-Y910 HydrophobicContact CG1-CE2 4.36Å; V799-Y910 HydrophobicContact CG1-CG 4.12Å; Y907-Y910 HydrophobicContact CD1-CD2 4.24Å; Y907-Y910 HydrophobicContact CD1-CE2 4.43Å; Y907-Y910 PolarHBondContact O-N 3.1Å; A908-Y910 PolarHBondContact O-N 3.16Å; A908-Y910 VanDerWaalsContact O-N 3.17Å; Y910-F913 HydrophobicContact CD1-CZ 4.4Å; Y910-P917 HydrophobicContact CD1-CB 4.07Å; Y910-P917 HydrophobicContact CD1-CG 3.85Å; Y910-P917 HydrophobicContact CE1-CB 3.86Å; Y910-P917 HydrophobicContact CE1-CG 3.89Å; Y910-H918 PolarHBondContact O-CE1 2.8Å; Y910-H918 PolarHBondContact O-NE2 3.24Å
911	S	91	Very high	94.8	Very high	57 Å²	57	41.1 Å²	41.1	40%	0.399	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-31.5	-175.3	65.4	0	0	0	0	113.7	A908 F913	A908-S911 WeakPolarHBondContact O-CB 3.26Å; A908-S911 PolarHBondContact O-N 3.38Å; A908-S911 VanDerWaalsContact O-N 3.16Å; A908-S911 PolarHBondContact O-OG 3.41Å; S911-F913 PolarHBondContact O-N 3.47Å
912	G	90.7	Very high	95.1	Very high	61 Å²	61	37.8 Å²	37.8	63%	0.629	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.4	-171.2	0	0	0	0	0	116.2
913	F	95.2	Very high	95.2	Very high	23 Å²	23	37.8 Å²	37.8	10%	0.101	23%	0.23	C	C	.	.			trans	-153	165.8	179.6	73.8	-83.1	0	0	0	111.1	T796 R867 F868 V869 Y910 S911 P917 H918	T796-F913 WeakPolarHBondContact CG2-O 3.48Å; R867-F913 HydrophobicContact CB-CD2 4.18Å; R867-F913 HydrophobicContact CG-CD2 3.66Å; R867-F913 HydrophobicContact CG-CE2 4.12Å; R867-F913 HydrophobicContact CG-CG 4.43Å; F868-F913 CarbonylContact O-C 3.44Å; F868-F913 WeakPolarHBondContact O-CA 3.36Å; V869-F913 HydrophobicContact CG1-CB 4.36Å; Y910-F913 HydrophobicContact CD1-CZ 4.4Å; S911-F913 PolarHBondContact O-N 3.47Å; F913-P917 HydrophobicContact CE2-CG 4.18Å; F913-P917 HydrophobicContact CZ-CG 4.16Å; F913-H918 AromaticContact CD2-CE1 3.89Å; F913-H918 AromaticContact CE2-CE1 3.65Å; F913-H918 AromaticContact CE2-ND1 3.95Å; F913-H918 AromaticContact CZ-CE1 3.93Å; F913-H918 PolarHBondContact O-CE1 2.81Å; F913-H918 PolarHBondContact O-NE2 3.28Å; F913-H918 VanDerWaalsContact O-NE2 3.11Å
914	L	96.7	Very high	95.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-119.6	125.3	164.8	-167.6	161.7	0	0	0	109	I795 T796 F855 Y859 R867 F868 H918 F919	I795-L914 HydrophobicContact CD1-CD1 4.34Å; I795-L914 HydrophobicContact CG1-CD1 4.37Å; I795-L914 HydrophobicContact CG2-CD1 3.67Å; T796-L914 HydrophobicContact CG2-CB 4.47Å; F855-L914 HydrophobicContact CD2-CD1 3.79Å; F855-L914 HydrophobicContact CE2-CB 4.43Å; F855-L914 HydrophobicContact CE2-CD1 3.73Å; F855-L914 HydrophobicContact CE2-CD2 4.31Å; F855-L914 HydrophobicContact CE2-CG 4.39Å; Y859-L914 HydrophobicContact CE1-CB 4.34Å; R867-L914 CarbonylContact C-O 3.58Å; R867-L914 WeakPolarHBondContact CA-O 3.43Å; F868-L914 HydrophobicContact CB-CB 4.22Å; F868-L914 HydrophobicContact CD2-CD2 4.21Å; F868-L914 PolarHBondContact N-O 3.42Å; F868-L914 PolarHBondContact O-N 3.49Å; L914-H918 HydrophobicContact CD2-CB 4.19Å; L914-H918 HydrophobicContact CG-CB 3.9Å; L914-F919 HydrophobicContact CD2-CD2 3.82Å; L914-F919 HydrophobicContact CD2-CE1 4.33Å; L914-F919 HydrophobicContact CD2-CE2 3.24Å; L914-F919 HydrophobicContact CD2-CZ 3.54Å
915	G	96.6	Very high	95.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-155.7	-156.3	-179.2	0	0	0	0	0	112.4	P917 H918 F919	G915-P917 VanDerWaalsContact C-CD 3.48Å; G915-H918 PolarHBondContact N-ND1 3.48Å; G915-H918 WeakPolarHBondContact O-CB 3.37Å; G915-H918 PolarHBondContact O-N 3.01Å; G915-H918 VanDerWaalsContact O-N 3.09Å; G915-F919 VanDerWaalsContact O-CD2 3.26Å; G915-F919 WeakPolarHBondContact O-CD2 3.27Å; G915-F919 PolarHBondContact O-N 3.27Å; G915-F919 VanDerWaalsContact O-N 3.12Å
916	A	96.3	Very high	95.4	Very high	58 Å²	58	36.2 Å²	36.2	48%	0.479	21%	0.208	S	C	.	.	H	α-helix	trans	-45.1	-51.1	-178	0	0	0	0	0	115.3	H918 F919 H920	A916-H918 VanDerWaalsContact C-N 3.28Å; A916-H918 PolarHBondContact O-N 3.3Å; A916-F919 PolarHBondContact O-N 3.09Å; A916-F919 VanDerWaalsContact O-N 3.17Å; A916-H920 PolarHBondContact O-CD2 3.41Å; A916-H920 PolarHBondContact O-N 3.48Å
917	P	97	Very high	95.3	Very high	42 Å²	42	40.9 Å²	40.9	27%	0.273	23%	0.227	S	C	.	.	H	α-helix	trans	-58.2	-41	-178.5	21.8	-32.5	0	0	0	112.3	Y910 F913 G915 H920 S921	Y910-P917 HydrophobicContact CD1-CB 4.07Å; Y910-P917 HydrophobicContact CD1-CG 3.85Å; Y910-P917 HydrophobicContact CE1-CB 3.86Å; Y910-P917 HydrophobicContact CE1-CG 3.89Å; F913-P917 HydrophobicContact CE2-CG 4.18Å; F913-P917 HydrophobicContact CZ-CG 4.16Å; G915-P917 VanDerWaalsContact C-CD 3.48Å; P917-H920 PolarHBondContact O-N 3.17Å; P917-S921 PolarHBondContact O-N 3.42Å; P917-S921 PolarHBondContact O-OG 2.56Å; P917-S921 VanDerWaalsContact O-OG 3.1Å
918	H	98	Very high	95.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-43.1	177.7	-49.2	85.3	0	0	0	112.3	T796 I798 V799 Y910 F913 L914 G915 A916 H920 S921 L922	T796-H918 PolarHBondContact O-CD2 3.09Å; I798-H918 HydrophobicContact CG2-CB 4.4Å; V799-H918 HydrophobicContact CG2-CB 4.45Å; Y910-H918 PolarHBondContact O-CE1 2.8Å; Y910-H918 PolarHBondContact O-NE2 3.24Å; F913-H918 AromaticContact CD2-CE1 3.89Å; F913-H918 AromaticContact CE2-CE1 3.65Å; F913-H918 AromaticContact CE2-ND1 3.95Å; F913-H918 AromaticContact CZ-CE1 3.93Å; F913-H918 PolarHBondContact O-CE1 2.81Å; F913-H918 PolarHBondContact O-NE2 3.28Å; F913-H918 VanDerWaalsContact O-NE2 3.11Å; L914-H918 HydrophobicContact CD2-CB 4.19Å; L914-H918 HydrophobicContact CG-CB 3.9Å; G915-H918 PolarHBondContact N-ND1 3.48Å; G915-H918 WeakPolarHBondContact O-CB 3.37Å; G915-H918 PolarHBondContact O-N 3.01Å; G915-H918 VanDerWaalsContact O-N 3.09Å; A916-H918 VanDerWaalsContact C-N 3.28Å; A916-H918 PolarHBondContact O-N 3.3Å; H918-H920 VanDerWaalsContact C-N 3.32Å; H918-H920 PolarHBondContact O-N 3.41Å; H918-S921 PolarHBondContact O-N 3.41Å; H918-L922 WeakPolarHBondContact O-CB 3.47Å; H918-L922 VanDerWaalsContact O-CG 3.29Å; H918-L922 WeakPolarHBondContact O-CG 3.24Å; H918-L922 PolarHBondContact O-N 3.28Å
919	F	98	Very high	95.1	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-34.7	177.1	-75.5	-73	0	0	0	112.7	F868 L914 G915 A916 L922 A923 F1011 H1014 L1015 A1018	F868-F919 HydrophobicContact CD2-CE2 4.39Å; F868-F919 HydrophobicContact CE2-CE2 4.02Å; F868-F919 AromaticContact CE2-CZ 3.99Å; F868-F919 HydrophobicContact CE2-CZ 3.99Å; L914-F919 HydrophobicContact CD2-CD2 3.82Å; L914-F919 HydrophobicContact CD2-CE1 4.33Å; L914-F919 HydrophobicContact CD2-CE2 3.24Å; L914-F919 HydrophobicContact CD2-CZ 3.54Å; G915-F919 VanDerWaalsContact O-CD2 3.26Å; G915-F919 WeakPolarHBondContact O-CD2 3.27Å; G915-F919 PolarHBondContact O-N 3.27Å; G915-F919 VanDerWaalsContact O-N 3.12Å; A916-F919 PolarHBondContact O-N 3.09Å; A916-F919 VanDerWaalsContact O-N 3.17Å; F919-L922 HydrophobicContact CD1-CD1 4.08Å; F919-A923 WeakPolarHBondContact O-CB 3.38Å; F919-A923 PolarHBondContact O-N 2.81Å; F919-F1011 HydrophobicContact CD1-CE2 4.29Å; F919-F1011 AromaticContact CE1-CD2 3.44Å; F919-F1011 HydrophobicContact CE1-CD2 3.44Å; F919-F1011 VanDerWaalsContact CE1-CD2 3.44Å; F919-F1011 AromaticContact CE1-CE2 3.5Å; F919-F1011 HydrophobicContact CE1-CE2 3.5Å; F919-F1011 HydrophobicContact CE1-CG 4.09Å; F919-F1011 HydrophobicContact CE1-CZ 4.23Å; F919-F1011 AromaticContact CZ-CD2 3.82Å; F919-F1011 HydrophobicContact CZ-CD2 3.82Å; F919-F1011 HydrophobicContact CZ-CE2 4.19Å; F919-H1014 HydrophobicContact CD1-CB 4Å; F919-H1014 HydrophobicContact CD2-CB 3.82Å; F919-H1014 HydrophobicContact CE1-CB 3.72Å; F919-H1014 HydrophobicContact CE2-CB 3.55Å; F919-H1014 HydrophobicContact CG-CB 4.05Å; F919-H1014 HydrophobicContact CZ-CB 3.51Å; F919-L1015 HydrophobicContact CD1-CB 4.1Å; F919-L1015 HydrophobicContact CE1-CB 4.36Å; F919-A1018 HydrophobicContact CB-CB 3.73Å; F919-A1018 WeakPolarHBondContact O-CB 3.2Å
920	H	97.7	Very high	95	Very high	40 Å²	40	40.7 Å²	40.7	19%	0.185	22%	0.216	C	C	.	.	H	α-helix	trans	-66.3	-45.2	172.1	-73.8	-69.8	0	0	0	111.9	A916 P917 H918 L922 A923 R924 H1021 E1022	A916-H920 PolarHBondContact O-CD2 3.41Å; A916-H920 PolarHBondContact O-N 3.48Å; P917-H920 PolarHBondContact O-N 3.17Å; H918-H920 VanDerWaalsContact C-N 3.32Å; H918-H920 PolarHBondContact O-N 3.41Å; H920-L922 VanDerWaalsContact C-N 3.33Å; H920-L922 PolarHBondContact O-N 2.83Å; H920-A923 PolarHBondContact O-N 3.43Å; H920-R924 WeakPolarHBondContact O-CG 3.39Å; H920-R924 PolarHBondContact O-N 3.16Å; H920-R924 VanDerWaalsContact O-N 3.07Å; H920-H1021 AromaticContact CE1-ND1 3.68Å; H920-H1021 AromaticContact NE2-ND1 3.91Å; H920-E1022 IonicContact CE1-OE1 2.64Å; H920-E1022 IonicContact CG-OE1 3.03Å; H920-E1022 IonicContact ND1-OE1 2.97Å; H920-E1022 PolarHBondContact ND1-OE1 3.25Å
921	S	97.5	Very high	95	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-42.2	174.6	-57.5	0	0	0	0	112	E802 P917 H918 R924 L925	E802-S921 WeakPolarHBondContact OE2-CA 3.25Å; E802-S921 WeakPolarHBondContact OE2-CB 3.42Å; E802-S921 PolarHBondContact OE2-OG 2.92Å; P917-S921 PolarHBondContact O-N 3.42Å; P917-S921 PolarHBondContact O-OG 2.56Å; P917-S921 VanDerWaalsContact O-OG 3.1Å; H918-S921 PolarHBondContact O-N 3.41Å; S921-R924 PolarHBondContact O-N 3.06Å; S921-L925 WeakPolarHBondContact O-CB 3.3Å; S921-L925 WeakPolarHBondContact O-CG 2.94Å; S921-L925 PolarHBondContact O-N 2.89Å
922	L	97.8	Very high	95.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-56.8	-51.1	173	-78	165.8	0	0	0	110.8	I795 I798 V847 H918 F919 H920 R924 L925 L926 F1011 L1015	I795-L922 HydrophobicContact CD1-CD2 4.47Å; I798-L922 HydrophobicContact CD1-CB 4.35Å; I798-L922 HydrophobicContact CD1-CD2 3.29Å; I798-L922 HydrophobicContact CD1-CG 3.7Å; V847-L922 HydrophobicContact CB-CD2 4.34Å; V847-L922 HydrophobicContact CG1-CD2 3.62Å; V847-L922 HydrophobicContact CG2-CD2 3.66Å; H918-L922 WeakPolarHBondContact O-CB 3.47Å; H918-L922 VanDerWaalsContact O-CG 3.29Å; H918-L922 WeakPolarHBondContact O-CG 3.24Å; H918-L922 PolarHBondContact O-N 3.28Å; F919-L922 HydrophobicContact CD1-CD1 4.08Å; H920-L922 VanDerWaalsContact C-N 3.33Å; H920-L922 PolarHBondContact O-N 2.83Å; L922-R924 VanDerWaalsContact C-N 3.34Å; L922-R924 PolarHBondContact O-N 3.17Å; L922-L925 PolarHBondContact O-N 2.9Å; L922-L926 HydrophobicContact CB-CD1 4.01Å; L922-L926 HydrophobicContact CD2-CD1 3.77Å; L922-L926 WeakPolarHBondContact O-CB 3.42Å; L922-L926 WeakPolarHBondContact O-CD1 3.42Å; L922-L926 VanDerWaalsContact O-CG 3.25Å; L922-L926 WeakPolarHBondContact O-CG 3.45Å; L922-L926 PolarHBondContact O-N 3.47Å; L922-F1011 HydrophobicContact CD1-CE2 3.87Å; L922-F1011 HydrophobicContact CD1-CZ 3.92Å; L922-L1015 HydrophobicContact CB-CD1 4.11Å
923	A	96.2	Very high	95.3	Very high	5 Å²	5	35.3 Å²	35.3	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-58.7	-43.6	-178.3	0	0	0	0	0	112.4	F919 H920 K927 L1015 A1018 E1022	F919-A923 WeakPolarHBondContact O-CB 3.38Å; F919-A923 PolarHBondContact O-N 2.81Å; H920-A923 PolarHBondContact O-N 3.43Å; A923-K927 PolarHBondContact O-N 2.86Å; A923-K927 VanDerWaalsContact O-N 3.12Å; A923-L1015 HydrophobicContact CB-CD1 4.49Å; A923-A1018 HydrophobicContact CB-CB 4.39Å; A923-E1022 HydrophobicContact CB-CG 4.3Å
924	R	94.7	Very high	95.3	Very high	110 Å²	110	34.2 Å²	34.2	42%	0.415	18%	0.178	S	C	.	.	H	α-helix	trans	-70.1	-40.9	-179.5	-68	176.4	-167.3	138.3	12.4	113.6	E802 H920 S921 L922 K927 E1022	E802-R924 VanDerWaalsContact OE1-CD 3.24Å; E802-R924 WeakPolarHBondContact OE1-CD 3.1Å; E802-R924 IonicContact OE1-CZ 3.6Å; E802-R924 IonicContact OE1-NE 3.63Å; E802-R924 IonicContact OE1-NH1 3.47Å; E802-R924 PolarHBondContact OE1-NH1 3.19Å; E802-R924 IonicContact OE2-NH1 3.49Å; H920-R924 WeakPolarHBondContact O-CG 3.39Å; H920-R924 PolarHBondContact O-N 3.16Å; H920-R924 VanDerWaalsContact O-N 3.07Å; S921-R924 PolarHBondContact O-N 3.06Å; L922-R924 VanDerWaalsContact C-N 3.34Å; L922-R924 PolarHBondContact O-N 3.17Å; R924-K927 WeakPolarHBondContact O-CG 3.24Å; R924-E1022 HydrophobicContact CG-CG 4.45Å; R924-E1022 IonicContact CZ-OE1 2.82Å; R924-E1022 IonicContact CZ-OE2 3.5Å; R924-E1022 IonicContact NE-OE1 3.54Å; R924-E1022 IonicContact NE-OE2 2.84Å; R924-E1022 PolarHBondContact NE-OE2 3.44Å; R924-E1022 IonicContact NH2-OE1 3.63Å; R924-E1022 PolarHBondContact NH2-OE1 2.7Å; R924-E1022 IonicContact NH2-OE2 3.4Å; R924-E1022 PolarHBondContact NH2-OE2 3.03Å
925	L	95.3	Very high	95.2	Very high	25 Å²	25	34.9 Å²	34.9	13%	0.131	18%	0.181	C	C	.	.	H	α-helix	trans	-80.4	-38.9	-176.5	-68.1	178.8	0	0	0	112.8	I798 L801 E802 F829 I843 S921 L922	I798-L925 HydrophobicContact CD1-CD1 4.16Å; I798-L925 HydrophobicContact CG1-CD1 3.72Å; L801-L925 HydrophobicContact CD2-CD1 3.96Å; L801-L925 HydrophobicContact CG-CD1 4.23Å; E802-L925 HydrophobicContact CB-CD1 4.28Å; F829-L925 HydrophobicContact CZ-CD2 4.44Å; I843-L925 HydrophobicContact CG2-CB 4.4Å; S921-L925 WeakPolarHBondContact O-CB 3.3Å; S921-L925 WeakPolarHBondContact O-CG 2.94Å; S921-L925 PolarHBondContact O-N 2.89Å; L922-L925 PolarHBondContact O-N 2.9Å
926	L	94.2	Very high	95	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-75.9	-35.4	179.8	-67.3	165	0	0	0	112.4	T844 V847 L922 G930 I931 I934	T844-L926 HydrophobicContact CG2-CD2 3.92Å; T844-L926 WeakPolarHBondContact OG1-CD2 3.3Å; V847-L926 HydrophobicContact CB-CD2 4.43Å; V847-L926 HydrophobicContact CG1-CD1 4.37Å; V847-L926 HydrophobicContact CG2-CD2 4.42Å; L922-L926 HydrophobicContact CB-CD1 4.01Å; L922-L926 HydrophobicContact CD2-CD1 3.77Å; L922-L926 WeakPolarHBondContact O-CB 3.42Å; L922-L926 WeakPolarHBondContact O-CD1 3.42Å; L922-L926 VanDerWaalsContact O-CG 3.25Å; L922-L926 WeakPolarHBondContact O-CG 3.45Å; L922-L926 PolarHBondContact O-N 3.47Å; L926-G930 VanDerWaalsContact O-CA 3.32Å; L926-G930 WeakPolarHBondContact O-CA 3.29Å; L926-G930 PolarHBondContact O-N 3.16Å; L926-I931 HydrophobicContact CB-CG1 3.98Å; L926-I931 HydrophobicContact CD1-CG1 4.41Å; L926-I934 HydrophobicContact CD1-CD1 3.53Å; L926-I934 HydrophobicContact CD2-CD1 3.46Å; L926-I934 VanDerWaalsContact CD2-CD1 3.46Å; L926-I934 HydrophobicContact CG-CD1 4.12Å
927	K	91	Very high	94.9	Very high	128 Å²	128	39 Å²	39	56%	0.557	19%	0.19	S	C	*	.	H	α-helix	trans	55.2	-174.2	-171.3	-52.4	179.8	179.8	179.4	0	111.6	A923 R924 Q929 G930 I931	A923-K927 PolarHBondContact O-N 2.86Å; A923-K927 VanDerWaalsContact O-N 3.12Å; R924-K927 WeakPolarHBondContact O-CG 3.24Å; K927-Q929 VanDerWaalsContact C-N 3.33Å; K927-Q929 PolarHBondContact O-N 3.07Å; K927-G930 PolarHBondContact O-N 2.8Å; K927-I931 WeakPolarHBondContact O-CB 3.21Å; K927-I931 WeakPolarHBondContact O-CD1 3.41Å; K927-I931 WeakPolarHBondContact O-CG1 3.49Å; K927-I931 PolarHBondContact O-N 2.94Å
928	Y	92.6	Very high	94.9	Very high	96 Å²	96	37 Å²	37	38%	0.376	18%	0.177	S	C	.	.	H	α-helix	trans	-56.4	-43.9	-177.8	-64.6	-68.6	0	0	0	113.6	I931 A932 L1019 E1023 L1091	Y928-I931 PolarHBondContact O-N 3.18Å; Y928-A932 VanDerWaalsContact O-CB 3.3Å; Y928-A932 WeakPolarHBondContact O-CB 3.22Å; Y928-A932 PolarHBondContact O-N 3.08Å; Y928-L1019 HydrophobicContact CD1-CD1 4.36Å; Y928-L1019 HydrophobicContact CD1-CD2 4.15Å; Y928-L1019 HydrophobicContact CE1-CD1 3.91Å; Y928-L1019 HydrophobicContact CE1-CD2 4.02Å; Y928-L1019 HydrophobicContact CE1-CG 4.34Å; Y928-E1023 VanDerWaalsContact CE1-OE1 3.29Å; Y928-E1023 WeakPolarHBondContact CE1-OE1 3.44Å; Y928-E1023 WeakPolarHBondContact OH-CG 3.19Å; Y928-E1023 PolarHBondContact OH-OE1 3.38Å; Y928-L1091 HydrophobicContact CD1-CD1 4.3Å; Y928-L1091 HydrophobicContact CE1-CD1 4.06Å; Y928-L1091 HydrophobicContact CE1-CG 4.28Å
929	Q	91	Very high	94.7	Very high	115 Å²	115	37.3 Å²	37.3	54%	0.537	18%	0.179	S	C	.	.	H	α-helix	trans	-66.3	-44.4	-176.3	-174.9	172.9	-0	0	0	112.3	P839 Y840 K927 A932 V933	P839-Q929 PolarHBondContact O-NE2 3.48Å; Y840-Q929 HydrophobicContact CD1-CG 4.49Å; Y840-Q929 HydrophobicContact CE1-CG 4.2Å; K927-Q929 VanDerWaalsContact C-N 3.33Å; K927-Q929 PolarHBondContact O-N 3.07Å; Q929-A932 PolarHBondContact O-N 3.36Å; Q929-V933 PolarHBondContact O-N 3.4Å
930	G	93	Very high	94.6	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-67.2	-39.4	176.4	0	0	0	0	0	112.3	L926 K927 V933 I934	L926-G930 VanDerWaalsContact O-CA 3.32Å; L926-G930 WeakPolarHBondContact O-CA 3.29Å; L926-G930 PolarHBondContact O-N 3.16Å; K927-G930 PolarHBondContact O-N 2.8Å; G930-V933 VanDerWaalsContact O-CG1 3.23Å; G930-V933 WeakPolarHBondContact O-CG1 3.46Å; G930-I934 WeakPolarHBondContact O-CB 3.24Å; G930-I934 WeakPolarHBondContact O-CG1 3.42Å; G930-I934 PolarHBondContact O-N 2.79Å; G930-I934 VanDerWaalsContact O-N 3.12Å
931	I	94.8	Very high	94.4	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-45.1	175.6	-66.3	167.4	0	0	0	110.4	L926 K927 Y928 V933 I934 M935 L1015 L1019	L926-I931 HydrophobicContact CB-CG1 3.98Å; L926-I931 HydrophobicContact CD1-CG1 4.41Å; K927-I931 WeakPolarHBondContact O-CB 3.21Å; K927-I931 WeakPolarHBondContact O-CD1 3.41Å; K927-I931 WeakPolarHBondContact O-CG1 3.49Å; K927-I931 PolarHBondContact O-N 2.94Å; Y928-I931 PolarHBondContact O-N 3.18Å; I931-V933 PolarHBondContact O-N 3.29Å; I931-I934 PolarHBondContact O-N 3.47Å; I931-M935 HydrophobicContact CG2-CE 4.06Å; I931-M935 HydrophobicContact CG2-CG 4.07Å; I931-M935 WeakPolarHBondContact O-CB 3.5Å; I931-M935 WeakPolarHBondContact O-CG 3.34Å; I931-M935 PolarHBondContact O-N 2.87Å; I931-L1015 HydrophobicContact CD1-CD1 4.42Å; I931-L1015 HydrophobicContact CG1-CD1 4.34Å; I931-L1015 HydrophobicContact CG1-CD2 4.28Å; I931-L1015 HydrophobicContact CG1-CG 4.43Å; I931-L1015 HydrophobicContact CG2-CD2 4.11Å; I931-L1015 HydrophobicContact CG2-CG 4.3Å; I931-L1019 HydrophobicContact CD1-CB 4.48Å; I931-L1019 HydrophobicContact CD1-CD1 4Å; I931-L1019 HydrophobicContact CD1-CD2 3.99Å; I931-L1019 HydrophobicContact CD1-CG 4.4Å
932	A	93.5	Very high	94.3	Very high	59 Å²	59	41.3 Å²	41.3	49%	0.488	20%	0.197	S	C	.	.	H	α-helix	trans	-59.4	-47.5	-178.8	0	0	0	0	0	112.2	Y928 Q929 M935 E936	Y928-A932 VanDerWaalsContact O-CB 3.3Å; Y928-A932 WeakPolarHBondContact O-CB 3.22Å; Y928-A932 PolarHBondContact O-N 3.08Å; Q929-A932 PolarHBondContact O-N 3.36Å; A932-M935 PolarHBondContact O-N 3.27Å; A932-E936 WeakPolarHBondContact O-CB 3.46Å; A932-E936 PolarHBondContact O-N 3.05Å
933	V	93.8	Very high	94.2	Very high	18 Å²	18	41.5 Å²	41.5	11%	0.109	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-40.6	179	66.5	0	0	0	0	111.7	Y840 T844 Q929 G930 I931 M935 E936 E937	Y840-V933 HydrophobicContact CD1-CB 4.15Å; Y840-V933 HydrophobicContact CD1-CG1 3.7Å; Y840-V933 HydrophobicContact CD1-CG2 4.39Å; Y840-V933 HydrophobicContact CD2-CG2 4.5Å; Y840-V933 HydrophobicContact CE1-CB 3.61Å; Y840-V933 HydrophobicContact CE1-CG1 3.69Å; Y840-V933 HydrophobicContact CE1-CG2 3.89Å; Y840-V933 HydrophobicContact CE2-CG2 4.02Å; Y840-V933 HydrophobicContact CG-CG1 4.36Å; T844-V933 HydrophobicContact CG2-CG1 3.68Å; Q929-V933 PolarHBondContact O-N 3.4Å; G930-V933 VanDerWaalsContact O-CG1 3.23Å; G930-V933 WeakPolarHBondContact O-CG1 3.46Å; I931-V933 PolarHBondContact O-N 3.29Å; V933-M935 VanDerWaalsContact C-N 3.34Å; V933-M935 PolarHBondContact O-N 3.31Å; V933-E936 PolarHBondContact O-N 3.4Å; V933-E937 HydrophobicContact CG2-CG 4.31Å; V933-E937 WeakPolarHBondContact O-CG 3.38Å; V933-E937 PolarHBondContact O-N 3.39Å
934	I	95.3	Very high	94.1	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-45.1	176.4	-73.9	166.6	0	0	0	110.4	T844 V847 F848 L851 L926 G930 I931 E936 E937 L938 F1011	T844-I934 HydrophobicContact CG2-CD1 4.29Å; T844-I934 HydrophobicContact CG2-CG1 4.38Å; V847-I934 HydrophobicContact CB-CD1 4.17Å; V847-I934 HydrophobicContact CG1-CD1 3.58Å; F848-I934 HydrophobicContact CB-CG1 4.41Å; L851-I934 HydrophobicContact CD1-CG2 3.74Å; L926-I934 HydrophobicContact CD1-CD1 3.53Å; L926-I934 HydrophobicContact CD2-CD1 3.46Å; L926-I934 VanDerWaalsContact CD2-CD1 3.46Å; L926-I934 HydrophobicContact CG-CD1 4.12Å; G930-I934 WeakPolarHBondContact O-CB 3.24Å; G930-I934 WeakPolarHBondContact O-CG1 3.42Å; G930-I934 PolarHBondContact O-N 2.79Å; G930-I934 VanDerWaalsContact O-N 3.12Å; I931-I934 PolarHBondContact O-N 3.47Å; I934-E936 VanDerWaalsContact C-N 3.32Å; I934-E936 PolarHBondContact O-N 3.38Å; I934-E937 PolarHBondContact O-N 3.27Å; I934-L938 HydrophobicContact CG2-CD1 3.83Å; I934-L938 HydrophobicContact CG2-CG 4.18Å; I934-L938 VanDerWaalsContact O-CB 3.27Å; I934-L938 WeakPolarHBondContact O-CB 3.11Å; I934-L938 WeakPolarHBondContact O-CG 3.5Å; I934-L938 PolarHBondContact O-N 3.15Å; I934-F1011 HydrophobicContact CG2-CE1 4Å
935	M	94.2	Very high	94.1	Very high	13 Å²	13	40.6 Å²	40.6	6%	0.064	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-39.4	178	-67.5	-74.2	-168.8	0	0	111.9	I931 A932 V933 L939 C1012 L1015 I1097 L1101	I931-M935 HydrophobicContact CG2-CE 4.06Å; I931-M935 HydrophobicContact CG2-CG 4.07Å; I931-M935 WeakPolarHBondContact O-CB 3.5Å; I931-M935 WeakPolarHBondContact O-CG 3.34Å; I931-M935 PolarHBondContact O-N 2.87Å; A932-M935 PolarHBondContact O-N 3.27Å; V933-M935 VanDerWaalsContact C-N 3.34Å; V933-M935 PolarHBondContact O-N 3.31Å; M935-L939 WeakPolarHBondContact O-CB 3.48Å; M935-L939 PolarHBondContact O-N 3.08Å; M935-C1012 HydrophobicContact CE-CB 4.16Å; M935-C1012 HydrophobicContact SD-CB 3.63Å; M935-L1015 HydrophobicContact CE-CB 3.99Å; M935-L1015 HydrophobicContact CE-CD2 3.93Å; M935-L1015 HydrophobicContact CE-CG 4.03Å; M935-I1097 HydrophobicContact CE-CG2 4.39Å; M935-I1097 HydrophobicContact CG-CG2 4.36Å; M935-I1097 HydrophobicContact SD-CG2 4.37Å; M935-L1101 HydrophobicContact SD-CD1 4.06Å
936	E	93.9	Very high	94.1	Very high	91 Å²	91	39.5 Å²	39.5	43%	0.425	20%	0.196	S	C	.	.	H	α-helix	trans	-67.4	-44.6	177.5	-175.1	169.7	-171	0	0	112.4	A932 V933 I934 L939 K940	A932-E936 WeakPolarHBondContact O-CB 3.46Å; A932-E936 PolarHBondContact O-N 3.05Å; V933-E936 PolarHBondContact O-N 3.4Å; I934-E936 VanDerWaalsContact C-N 3.32Å; I934-E936 PolarHBondContact O-N 3.38Å; E936-L939 WeakPolarHBondContact O-CB 3.26Å; E936-L939 PolarHBondContact O-N 2.99Å; E936-K940 PolarHBondContact O-N 2.82Å; E936-K940 VanDerWaalsContact O-N 3.12Å
937	E	94.2	Very high	94	Very high	55 Å²	55	43.3 Å²	43.3	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-67.4	-40.6	176.5	-67.3	-55.3	136	0	0	111.8	F848 V933 I934 L939 K940 V941	F848-E937 HydrophobicContact CD2-CB 3.82Å; F848-E937 HydrophobicContact CE1-CB 4.44Å; F848-E937 HydrophobicContact CE2-CB 3.29Å; F848-E937 HydrophobicContact CE2-CG 4.19Å; F848-E937 HydrophobicContact CZ-CB 3.65Å; F848-E937 HydrophobicContact CZ-CG 4.21Å; V933-E937 HydrophobicContact CG2-CG 4.31Å; V933-E937 WeakPolarHBondContact O-CG 3.38Å; V933-E937 PolarHBondContact O-N 3.39Å; I934-E937 PolarHBondContact O-N 3.27Å; E937-L939 PolarHBondContact O-N 3.15Å; E937-K940 WeakPolarHBondContact O-CB 3.48Å; E937-K940 PolarHBondContact O-N 3.33Å; E937-K940 IonicContact OE1-NZ 2.74Å; E937-K940 PolarHBondContact OE1-NZ 2.86Å; E937-K940 IonicContact OE2-NZ 3.27Å; E937-V941 WeakPolarHBondContact O-CG2 3.22Å; E937-V941 PolarHBondContact O-N 3.16Å
938	L	95.3	Very high	94.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-33.3	173.4	-75.2	-178.4	0	0	0	112.2	L851 L856 I934 V941 S942 T1008 F1011	L851-L938 HydrophobicContact CD1-CD1 4.36Å; L856-L938 HydrophobicContact CD1-CD2 4.05Å; I934-L938 HydrophobicContact CG2-CD1 3.83Å; I934-L938 HydrophobicContact CG2-CG 4.18Å; I934-L938 VanDerWaalsContact O-CB 3.27Å; I934-L938 WeakPolarHBondContact O-CB 3.11Å; I934-L938 WeakPolarHBondContact O-CG 3.5Å; I934-L938 PolarHBondContact O-N 3.15Å; L938-V941 PolarHBondContact O-N 3.38Å; L938-S942 WeakPolarHBondContact O-CB 2.97Å; L938-S942 PolarHBondContact O-N 3Å; L938-S942 PolarHBondContact O-OG 3.27Å; L938-T1008 HydrophobicContact CB-CG2 3.82Å; L938-T1008 HydrophobicContact CD1-CG2 4.36Å; L938-T1008 HydrophobicContact CD2-CG2 4.09Å; L938-T1008 HydrophobicContact CG-CG2 4.31Å; L938-F1011 HydrophobicContact CD1-CD1 3.59Å; L938-F1011 HydrophobicContact CD1-CE1 4.09Å
939	L	95.1	Very high	94.1	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-38.6	172.9	-177.1	69.2	0	0	0	111.8	M935 E936 E937 S942 G943 L1101 R1104 M1105 F1108	M935-L939 WeakPolarHBondContact O-CB 3.48Å; M935-L939 PolarHBondContact O-N 3.08Å; E936-L939 WeakPolarHBondContact O-CB 3.26Å; E936-L939 PolarHBondContact O-N 2.99Å; E937-L939 PolarHBondContact O-N 3.15Å; L939-S942 WeakPolarHBondContact O-CB 3.37Å; L939-S942 PolarHBondContact O-N 3.43Å; L939-G943 PolarHBondContact O-N 3.04Å; L939-L1101 HydrophobicContact CD1-CG 4.39Å; L939-R1104 HydrophobicContact CD1-CB 4.02Å; L939-R1104 HydrophobicContact CD2-CB 3.82Å; L939-R1104 HydrophobicContact CD2-CG 4.4Å; L939-M1105 HydrophobicContact CD1-CG 3.7Å; L939-F1108 HydrophobicContact CD1-CE2 3.79Å; L939-F1108 HydrophobicContact CD1-CZ 4.35Å; L939-F1108 HydrophobicContact CG-CE2 4.09Å; L939-F1108 HydrophobicContact CG-CZ 4.22Å
940	K	95.3	Very high	94.3	Very high	109 Å²	109	33.9 Å²	33.9	47%	0.474	18%	0.183	S	C	.	.	H	α-helix	trans	-64.1	-44.3	173.3	-65.7	172.3	-171.6	166.7	0	111.3	E936 E937 S942 G943 N944	E936-K940 PolarHBondContact O-N 2.82Å; E936-K940 VanDerWaalsContact O-N 3.12Å; E937-K940 WeakPolarHBondContact O-CB 3.48Å; E937-K940 PolarHBondContact O-N 3.33Å; E937-K940 IonicContact OE1-NZ 2.74Å; E937-K940 PolarHBondContact OE1-NZ 2.86Å; E937-K940 IonicContact OE2-NZ 3.27Å; K940-S942 VanDerWaalsContact C-N 3.28Å; K940-S942 PolarHBondContact O-N 3.49Å; K940-G943 PolarHBondContact O-N 3.26Å; K940-N944 PolarHBondContact O-N 3.25Å
941	V	94.2	Very high	94.3	Very high	23 Å²	23	34.5 Å²	34.5	14%	0.139	19%	0.186	C	C	.	.	H	α-helix	trans	-56.8	-45.2	173.2	172.9	0	0	0	0	110.4	L856 E937 L938 G943 N944 L945	L856-V941 HydrophobicContact CD1-CG1 4.32Å; E937-V941 WeakPolarHBondContact O-CG2 3.22Å; E937-V941 PolarHBondContact O-N 3.16Å; L938-V941 PolarHBondContact O-N 3.38Å; V941-G943 PolarHBondContact O-N 3.29Å; V941-N944 PolarHBondContact O-N 3.49Å; V941-L945 HydrophobicContact CG1-CD1 4.04Å; V941-L945 HydrophobicContact CG1-CG 4.41Å; V941-L945 WeakPolarHBondContact O-CG 3.49Å; V941-L945 PolarHBondContact O-N 2.82Å
942	S	94.9	Very high	94.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-41.6	177.7	-57.5	0	0	0	0	112.5	L938 L939 K940 L945 L946 T1008 M1105	L938-S942 WeakPolarHBondContact O-CB 2.97Å; L938-S942 PolarHBondContact O-N 3Å; L938-S942 PolarHBondContact O-OG 3.27Å; L939-S942 WeakPolarHBondContact O-CB 3.37Å; L939-S942 PolarHBondContact O-N 3.43Å; K940-S942 VanDerWaalsContact C-N 3.28Å; K940-S942 PolarHBondContact O-N 3.49Å; S942-L945 PolarHBondContact O-N 2.88Å; S942-L946 WeakPolarHBondContact O-CB 3.27Å; S942-L946 VanDerWaalsContact O-CG 3.26Å; S942-L946 WeakPolarHBondContact O-CG 3.49Å; S942-L946 PolarHBondContact O-N 2.72Å; S942-T1008 WeakPolarHBondContact OG-CG2 3.48Å; S942-M1105 VanDerWaalsContact CB-CE 3.47Å; S942-M1105 WeakPolarHBondContact OG-CE 3.33Å
943	G	94.9	Very high	94.2	Very high	4 Å²	4	34.8 Å²	34.8	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-46.8	174.2	0	0	0	0	0	112.2	L939 K940 V941 L946 Q947 F1108	L939-G943 PolarHBondContact O-N 3.04Å; K940-G943 PolarHBondContact O-N 3.26Å; V941-G943 PolarHBondContact O-N 3.29Å; G943-L946 PolarHBondContact O-N 3Å; G943-Q947 WeakPolarHBondContact O-CB 3.36Å; G943-Q947 WeakPolarHBondContact O-CG 3.26Å; G943-Q947 PolarHBondContact O-N 3.1Å; G943-F1108 VanDerWaalsContact CA-CD2 3.49Å
944	N	94.7	Very high	94.1	Very high	89 Å²	89	34 Å²	34	48%	0.476	18%	0.179	S	C	.	.	H	α-helix	trans	-60.9	-46.2	176.2	-175.8	46.5	0	0	0	112	K940 V941 L946 N948	K940-N944 PolarHBondContact O-N 3.25Å; V941-N944 PolarHBondContact O-N 3.49Å; N944-L946 PolarHBondContact O-N 2.75Å; N944-N948 VanDerWaalsContact O-CB 3.3Å; N944-N948 WeakPolarHBondContact O-CB 3.44Å; N944-N948 PolarHBondContact O-N 3.06Å; N944-N948 PolarHBondContact OD1-ND2 3.19Å
945	L	94.7	Very high	93.9	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.037	20%	0.204	C	C	.	.	I	π-helix	trans	-60.5	-43.7	177	-74.6	173.6	0	0	0	111.9	V941 S942 S949 I950 E1004 L1005	V941-L945 HydrophobicContact CG1-CD1 4.04Å; V941-L945 HydrophobicContact CG1-CG 4.41Å; V941-L945 WeakPolarHBondContact O-CG 3.49Å; V941-L945 PolarHBondContact O-N 2.82Å; S942-L945 PolarHBondContact O-N 2.88Å; L945-S949 PolarHBondContact O-N 3.24Å; L945-I950 WeakPolarHBondContact O-CB 3.42Å; L945-I950 WeakPolarHBondContact O-CG1 3.47Å; L945-I950 PolarHBondContact O-N 2.85Å; L945-E1004 HydrophobicContact CD1-CB 3.81Å; L945-E1004 HydrophobicContact CD2-CB 4.49Å; L945-L1005 HydrophobicContact CD1-CB 4.26Å
946	L	95	Very high	93.8	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.223	C	C	.	.	I	π-helix	trans	-69.2	-46.4	-178.9	-75.5	171.5	0	0	0	112.8	S942 G943 N944 I950 L951 L1005 F1108 L1109 L1170	S942-L946 WeakPolarHBondContact O-CB 3.27Å; S942-L946 VanDerWaalsContact O-CG 3.26Å; S942-L946 WeakPolarHBondContact O-CG 3.49Å; S942-L946 PolarHBondContact O-N 2.72Å; G943-L946 PolarHBondContact O-N 3Å; N944-L946 PolarHBondContact O-N 2.75Å; L946-I950 HydrophobicContact CD2-CD1 4.11Å; L946-L951 VanDerWaalsContact O-CB 3.28Å; L946-L951 WeakPolarHBondContact O-CB 3.4Å; L946-L951 PolarHBondContact O-N 3.17Å; L946-L1005 HydrophobicContact CD1-CD2 4.4Å; L946-L1005 HydrophobicContact CD2-CD2 3.45Å; L946-L1005 VanDerWaalsContact CD2-CD2 3.45Å; L946-L1005 HydrophobicContact CG-CD2 3.86Å; L946-F1108 HydrophobicContact CD1-CB 4.2Å; L946-F1108 HydrophobicContact CD1-CD2 4.24Å; L946-L1109 HydrophobicContact CD1-CD2 4.13Å; L946-L1109 HydrophobicContact CD2-CD2 3.91Å; L946-L1109 HydrophobicContact CG-CD2 4.46Å; L946-L1170 HydrophobicContact CD2-CD1 4.31Å; L946-L1170 HydrophobicContact CD2-CD2 3.63Å
947	Q	93.4	Very high	93.7	Very high	87 Å²	87	40.7 Å²	40.7	41%	0.407	20%	0.203	S	C	.	.	I	π-helix	trans	-82.8	-27.7	-173.1	-66.5	-179.9	-31.7	0	0	113.2	G943 L951 F1108	G943-Q947 WeakPolarHBondContact O-CB 3.36Å; G943-Q947 WeakPolarHBondContact O-CG 3.26Å; G943-Q947 PolarHBondContact O-N 3.1Å; Q947-L951 WeakPolarHBondContact O-CB 3.47Å; Q947-L951 VanDerWaalsContact O-CD2 3.3Å; Q947-L951 WeakPolarHBondContact O-CD2 3.39Å; Q947-F1108 HydrophobicContact CG-CB 4.37Å
948	N	93.1	Very high	93.5	Very high	94 Å²	94	41.1 Å²	41.1	50%	0.503	21%	0.206	S	C	.	.	I	π-helix	trans	-109.6	-62.9	-176.1	-62	-38.9	0	0	0	111.7	N944 S952	N944-N948 VanDerWaalsContact O-CB 3.3Å; N944-N948 WeakPolarHBondContact O-CB 3.44Å; N944-N948 PolarHBondContact O-N 3.06Å; N944-N948 PolarHBondContact OD1-ND2 3.19Å; N948-S952 WeakPolarHBondContact O-CB 3.49Å; N948-S952 PolarHBondContact O-N 3.02Å
949	S	93	Very high	93.3	Very high	46 Å²	46	46.1 Å²	46.1	32%	0.322	24%	0.237	S	C	.	.	I	π-helix	trans	-72.3	-58.8	-170.7	-52.8	0	0	0	0	113	L945 S952 A953	L945-S949 PolarHBondContact O-N 3.24Å; S949-S952 PolarHBondContact O-N 3.43Å; S949-A953 WeakPolarHBondContact O-CB 3.42Å; S949-A953 PolarHBondContact O-N 2.78Å
950	I	94.5	Very high	93	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.245	C	C	.	.	I	π-helix	trans	-66.5	-44.1	-177.3	-63.7	171.9	0	0	0	110	L945 L946 S952 A953 L954 L1005 W1114	L945-I950 WeakPolarHBondContact O-CB 3.42Å; L945-I950 WeakPolarHBondContact O-CG1 3.47Å; L945-I950 PolarHBondContact O-N 2.85Å; L946-I950 HydrophobicContact CD2-CD1 4.11Å; I950-S952 PolarHBondContact O-N 3.33Å; I950-A953 PolarHBondContact O-N 2.8Å; I950-L954 HydrophobicContact CG2-CD1 3.75Å; I950-L954 HydrophobicContact CG2-CG 4.15Å; I950-L954 WeakPolarHBondContact O-CB 3.29Å; I950-L954 VanDerWaalsContact O-CG 3.29Å; I950-L954 WeakPolarHBondContact O-CG 3.4Å; I950-L954 PolarHBondContact O-N 3.39Å; I950-L1005 HydrophobicContact CD1-CB 4.16Å; I950-L1005 HydrophobicContact CD1-CD2 3.67Å; I950-W1114 HydrophobicContact CG2-CH2 3.99Å
951	L	93.2	Very high	92.8	Very high	17 Å²	17	42.9 Å²	42.9	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-45.2	177.7	-178.1	60.6	0	0	0	112.1	L946 Q947 A953 L954 R955 D1111 I1113 W1114	L946-L951 VanDerWaalsContact O-CB 3.28Å; L946-L951 WeakPolarHBondContact O-CB 3.4Å; L946-L951 PolarHBondContact O-N 3.17Å; Q947-L951 WeakPolarHBondContact O-CB 3.47Å; Q947-L951 VanDerWaalsContact O-CD2 3.3Å; Q947-L951 WeakPolarHBondContact O-CD2 3.39Å; L951-A953 VanDerWaalsContact C-N 3.35Å; L951-A953 PolarHBondContact O-N 2.9Å; L951-L954 PolarHBondContact O-N 3.06Å; L951-R955 WeakPolarHBondContact O-CG 3.5Å; L951-R955 PolarHBondContact O-N 2.87Å; L951-D1111 HydrophobicContact CD1-CB 3.95Å; L951-D1111 HydrophobicContact CD2-CB 4.17Å; L951-I1113 HydrophobicContact CD1-CG2 3.48Å; L951-I1113 VanDerWaalsContact CD1-CG2 3.48Å; L951-W1114 HydrophobicContact CD1-CZ2 4.42Å
952	S	92.9	Very high	92.5	Very high	61 Å²	61	43 Å²	43	43%	0.427	23%	0.227	S	C	.	.	H	α-helix	trans	-60.1	-44.3	176.2	-178	0	0	0	0	111.8	N948 S949 I950 R955 K956	N948-S952 WeakPolarHBondContact O-CB 3.49Å; N948-S952 PolarHBondContact O-N 3.02Å; S949-S952 PolarHBondContact O-N 3.43Å; I950-S952 PolarHBondContact O-N 3.33Å; S952-R955 PolarHBondContact O-N 2.89Å; S952-K956 PolarHBondContact O-N 3.25Å
953	A	92.4	Very high	92.2	Very high	6 Å²	6	52 Å²	52	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-64.7	-44.1	175.8	0	0	0	0	0	112.1	S949 I950 L951 R955 K956 V957 L994 I998	S949-A953 WeakPolarHBondContact O-CB 3.42Å; S949-A953 PolarHBondContact O-N 2.78Å; I950-A953 PolarHBondContact O-N 2.8Å; L951-A953 VanDerWaalsContact C-N 3.35Å; L951-A953 PolarHBondContact O-N 2.9Å; A953-R955 VanDerWaalsContact C-N 3.34Å; A953-R955 PolarHBondContact O-N 3.36Å; A953-K956 WeakPolarHBondContact O-CA 3.39Å; A953-K956 WeakPolarHBondContact O-CB 3.37Å; A953-K956 PolarHBondContact O-N 3.23Å; A953-V957 WeakPolarHBondContact O-CG2 3.4Å; A953-V957 PolarHBondContact O-N 3.14Å; A953-L994 HydrophobicContact CB-CD1 4.22Å; A953-I998 HydrophobicContact CB-CB 3.92Å; A953-I998 HydrophobicContact CB-CD1 4.16Å; A953-I998 HydrophobicContact CB-CG1 4.05Å
954	L	91.9	Very high	91.9	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-36.7	178.1	-75.1	173.6	0	0	0	112.8	I950 L951 K956 V957 I958 I998 I1113 W1114 F1133 L1136	I950-L954 HydrophobicContact CG2-CD1 3.75Å; I950-L954 HydrophobicContact CG2-CG 4.15Å; I950-L954 WeakPolarHBondContact O-CB 3.29Å; I950-L954 VanDerWaalsContact O-CG 3.29Å; I950-L954 WeakPolarHBondContact O-CG 3.4Å; I950-L954 PolarHBondContact O-N 3.39Å; L951-L954 PolarHBondContact O-N 3.06Å; L954-K956 PolarHBondContact O-N 2.94Å; L954-V957 PolarHBondContact O-N 3.31Å; L954-V957 VanDerWaalsContact O-N 3.09Å; L954-I958 PolarHBondContact O-N 3.42Å; L954-I998 HydrophobicContact CD2-CD1 3.7Å; L954-I998 HydrophobicContact CG-CD1 4.08Å; L954-I1113 HydrophobicContact CB-CD1 3.95Å; L954-W1114 HydrophobicContact CD1-CE3 4.31Å; L954-W1114 HydrophobicContact CD1-CH2 3.41Å; L954-W1114 VanDerWaalsContact CD1-CH2 3.41Å; L954-W1114 HydrophobicContact CD1-CZ2 4.27Å; L954-W1114 HydrophobicContact CD1-CZ3 3.44Å; L954-W1114 VanDerWaalsContact CD1-CZ3 3.44Å; L954-F1133 HydrophobicContact CD1-CD2 3.89Å; L954-F1133 HydrophobicContact CD1-CE2 3.83Å; L954-F1133 HydrophobicContact CD2-CD2 4.35Å; L954-F1133 HydrophobicContact CD2-CE2 4.12Å; L954-L1136 HydrophobicContact CD2-CB 4.34Å; L954-L1136 HydrophobicContact CD2-CD1 4.12Å
955	R	92.1	Very high	91.7	Very high	136 Å²	136	51.3 Å²	51.3	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-29.8	172.4	-76.1	176.5	-179.5	179.5	2.5	112.3	L951 S952 A953 I958 T959 D1111 I1113	L951-R955 WeakPolarHBondContact O-CG 3.5Å; L951-R955 PolarHBondContact O-N 2.87Å; S952-R955 PolarHBondContact O-N 2.89Å; A953-R955 VanDerWaalsContact C-N 3.34Å; A953-R955 PolarHBondContact O-N 3.36Å; R955-I958 WeakPolarHBondContact O-CG2 3.48Å; R955-T959 WeakPolarHBondContact O-CG2 3.41Å; R955-D1111 IonicContact CZ-OD2 2.76Å; R955-D1111 IonicContact NE-OD2 3.42Å; R955-D1111 IonicContact NH2-OD2 3.17Å; R955-D1111 PolarHBondContact NH2-OD2 3.01Å; R955-I1113 HydrophobicContact CG-CD1 4.12Å
956	K	92	Very high	91.5	Very high	110 Å²	110	57.2 Å²	57.2	48%	0.478	29%	0.289	S	S	.	.	H	α-helix	trans	-77.5	-45	170.4	-61.4	173.4	-175.9	176.6	0	110.8	S952 A953 L954 I958 T959 L994	S952-K956 PolarHBondContact O-N 3.25Å; A953-K956 WeakPolarHBondContact O-CA 3.39Å; A953-K956 WeakPolarHBondContact O-CB 3.37Å; A953-K956 PolarHBondContact O-N 3.23Å; L954-K956 PolarHBondContact O-N 2.94Å; K956-I958 PolarHBondContact O-N 3.02Å; K956-T959 PolarHBondContact O-N 3.29Å; K956-T959 VanDerWaalsContact O-N 3.13Å; K956-T959 PolarHBondContact O-OG1 3.46Å; K956-L994 HydrophobicContact CB-CD1 3.82Å; K956-L994 HydrophobicContact CB-CD2 3.97Å; K956-L994 HydrophobicContact CD-CD1 3.93Å
957	V	90.6	Very high	91.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-45.2	-179.8	174	0	0	0	0	112.1	A953 L954 T959 L960 V961 L988 L994 I998 L1136	A953-V957 WeakPolarHBondContact O-CG2 3.4Å; A953-V957 PolarHBondContact O-N 3.14Å; L954-V957 PolarHBondContact O-N 3.31Å; L954-V957 VanDerWaalsContact O-N 3.09Å; V957-T959 PolarHBondContact O-N 2.98Å; V957-T959 VanDerWaalsContact O-N 3.14Å; V957-L960 PolarHBondContact O-N 3.37Å; V957-V961 HydrophobicContact CG1-CG2 3.92Å; V957-V961 WeakPolarHBondContact O-CG2 3.49Å; V957-V961 PolarHBondContact O-N 2.82Å; V957-V961 VanDerWaalsContact O-N 3.08Å; V957-L988 HydrophobicContact CG1-CD1 4.17Å; V957-L988 HydrophobicContact CG1-CD2 4.37Å; V957-L988 HydrophobicContact CG2-CD1 4.18Å; V957-L994 HydrophobicContact CG2-CD1 4.46Å; V957-L994 HydrophobicContact CG2-CD2 3.81Å; V957-L994 HydrophobicContact CG2-CG 4.17Å; V957-I998 HydrophobicContact CG2-CD1 3.95Å; V957-L1136 HydrophobicContact CG1-CD2 4.5Å
958	I	90.1	Very high	91.2	Very high	64 Å²	64	56 Å²	56	33%	0.328	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-24.6	-179	-164.3	165.5	0	0	0	113	L954 R955 K956 L960 I1113 L1136	L954-I958 PolarHBondContact O-N 3.42Å; R955-I958 WeakPolarHBondContact O-CG2 3.48Å; K956-I958 PolarHBondContact O-N 3.02Å; I958-L960 VanDerWaalsContact C-N 3.33Å; I958-I1113 HydrophobicContact CB-CD1 4.4Å; I958-I1113 HydrophobicContact CD1-CD1 4.32Å; I958-I1113 HydrophobicContact CD1-CG1 4.03Å; I958-I1113 HydrophobicContact CG2-CD1 4.14Å; I958-L1136 HydrophobicContact CB-CD1 4.39Å; I958-L1136 HydrophobicContact CB-CD2 4.18Å; I958-L1136 HydrophobicContact CG1-CD2 4.17Å
959	T	90.7	Very high	91.1	Very high	106 Å²	106	60.4 Å²	60.4	65%	0.65	30%	0.296	S	S	*	.	H	α-helix	trans	-77.7	-19.8	174.5	71	0	0	0	0	113.3	R955 K956 V957	R955-T959 WeakPolarHBondContact O-CG2 3.41Å; K956-T959 PolarHBondContact O-N 3.29Å; K956-T959 VanDerWaalsContact O-N 3.13Å; K956-T959 PolarHBondContact O-OG1 3.46Å; V957-T959 PolarHBondContact O-N 2.98Å; V957-T959 VanDerWaalsContact O-N 3.14Å
960	L	90.7	Very high	91.1	Very high	37 Å²	37	63 Å²	63	19%	0.194	30%	0.299	C	S	.	.	H	α-helix	trans	-96.6	-21.8	-179.7	-56.5	-178.2	0	0	0	112.8	V957 I958 K987 L988 N991 L994	V957-L960 PolarHBondContact O-N 3.37Å; I958-L960 VanDerWaalsContact C-N 3.33Å; L960-K987 HydrophobicContact CB-CB 4.36Å; L960-K987 HydrophobicContact CD2-CB 4.3Å; L960-L988 HydrophobicContact CB-CB 4.42Å; L960-L988 HydrophobicContact CD1-CD1 4.24Å; L960-N991 HydrophobicContact CD1-CB 4.21Å; L960-L994 HydrophobicContact CD1-CD2 3.61Å
961	V	89.2	Confident	90.8	Very high	9 Å²	9	69.7 Å²	69.7	6%	0.055	34%	0.335	C	S	.	.	S	Bend	trans	-85.5	137.6	176	178	0	0	0	0	109.5	V957 L985 L988 C1130 L1136 A1139	V957-V961 HydrophobicContact CG1-CG2 3.92Å; V957-V961 WeakPolarHBondContact O-CG2 3.49Å; V957-V961 PolarHBondContact O-N 2.82Å; V957-V961 VanDerWaalsContact O-N 3.08Å; V961-L985 HydrophobicContact CG1-CD2 4.4Å; V961-L985 HydrophobicContact CG2-CD2 4.43Å; V961-L988 HydrophobicContact CG2-CD2 4.3Å; V961-C1130 HydrophobicContact CG1-CB 3.89Å; V961-L1136 HydrophobicContact CB-CD2 4.35Å; V961-L1136 HydrophobicContact CG1-CD2 4.46Å; V961-L1136 HydrophobicContact CG2-CD2 4.27Å; V961-A1139 HydrophobicContact CG1-CB 4.49Å; V961-A1139 HydrophobicContact CG2-CB 3.78Å
962	P	89	Confident	90.6	Very high	27 Å²	27	76.8 Å²	76.8	18%	0.175	36%	0.362	C	S	.	.			trans	-63.7	140	177	27.8	-37.8	0	0	0	111.4	V964 C965 Q984 C1130	P962-V964 PolarHBondContact O-N 3.32Å; P962-C965 HydrophobicContact CG-CB 3.96Å; P962-Q984 HydrophobicContact CG-CB 4.21Å; P962-C1130 VanDerWaalsContact O-CB 3.25Å; P962-C1130 WeakPolarHBondContact O-CB 3.36Å; P962-C1130 PolarHBondContact O-SG 3.24Å
963	K	87.5	Confident	90.5	Very high	187 Å²	187	74 Å²	74	81%	0.813	34%	0.343	S	S	*	.	S	Bend	trans	-56.6	-33.2	177.7	-67.8	-171.6	177.2	-175.1	0	113	E1129 C1130	K963-E1129 WeakPolarHBondContact O-CA 3.44Å; K963-C1130 PolarHBondContact O-N 2.89Å
964	V	88.5	Confident	90.5	Very high	79 Å²	79	73.7 Å²	73.7	48%	0.479	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-133	124.4	178.4	-176.9	0	0	0	0	108.4	P962 D1128	P962-V964 PolarHBondContact O-N 3.32Å; V964-D1128 CarbonylContact C-O 3.52Å; V964-D1128 WeakPolarHBondContact CA-O 3.35Å; V964-D1128 HydrophobicContact CG1-CB 3.66Å
965	C	91.2	Very high	90.4	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.007	35%	0.345	C	S	.	.			trans	-133.3	98.4	177	-166.3	0	0	0	0	110.1	P962 D1128 R1135 F1185	P962-C965 HydrophobicContact CG-CB 3.96Å; C965-D1128 PolarHBondContact N-O 2.96Å; C965-R1135 PolarHBondContact O-NH2 3.42Å; C965-F1185 HydrophobicContact CB-CE1 3.94Å; C965-F1185 HydrophobicContact CB-CZ 4.06Å
966	K	90.3	Very high	90.4	Very high	130 Å²	130	69.2 Å²	69.2	57%	0.565	33%	0.334	S	S	*	.			trans	-67.6	151.3	-179.2	-62	-169.8	171.4	-178.8	0	111.6	P968 F980 D1128	K966-P968 VanDerWaalsContact O-CD 3.25Å; K966-P968 WeakPolarHBondContact O-CD 3.36Å; K966-F980 WeakPolarHBondContact O-CE1 3.05Å; K966-D1128 HydrophobicContact CG-CB 4.29Å
967	L	90.7	Very high	90.5	Very high	48 Å²	48	64 Å²	64	25%	0.251	31%	0.312	S	S	.	.			trans	-82.4	107.4	168	-67.6	145.3	0	0	0	108.9	Y981 V1183 H1188	L967-Y981 WeakPolarHBondContact CD2-OH 3.46Å; L967-V1183 HydrophobicContact CD1-CB 4.14Å; L967-V1183 HydrophobicContact CD1-CG1 4.06Å; L967-H1188 HydrophobicContact CD2-CB 3.55Å; L967-H1188 VanDerWaalsContact CD2-CG 3.44Å
968	P	92.4	Very high	90.6	Very high	17 Å²	17	64 Å²	64	11%	0.11	31%	0.312	C	S	.	.			trans	-62.7	147.9	-177.7	-20.4	33.4	0	0	0	111.6	K966 Y972 V977 F980 Y981 H1188	K966-P968 VanDerWaalsContact O-CD 3.25Å; K966-P968 WeakPolarHBondContact O-CD 3.36Å; P968-Y972 HydrophobicContact CB-CD2 4.16Å; P968-Y972 HydrophobicContact CB-CG 4.37Å; P968-V977 HydrophobicContact CB-CG2 4.04Å; P968-V977 HydrophobicContact CG-CG1 4.3Å; P968-F980 HydrophobicContact CG-CB 4.28Å; P968-F980 HydrophobicContact CG-CD1 3.41Å; P968-F980 VanDerWaalsContact CG-CD1 3.41Å; P968-F980 HydrophobicContact CG-CE1 3.83Å; P968-F980 HydrophobicContact CG-CG 3.86Å; P968-Y981 WeakPolarHBondContact CD-OH 3.36Å; P968-H1188 PolarHBondContact O-CE1 2.94Å; P968-H1188 PolarHBondContact O-NE2 3.39Å
969	R	91.4	Very high	90.7	Very high	186 Å²	186	63.3 Å²	63.3	70%	0.702	31%	0.312	S	S	*	.			trans	-64.4	157.7	178	-71.5	-174.6	169	-174.4	-2.8	111.5	D971 Y972	R969-D971 PolarHBondContact O-N 3.12Å; R969-Y972 HydrophobicContact CB-CD2 4.15Å; R969-Y972 HydrophobicContact CB-CE2 4.34Å; R969-Y972 WeakPolarHBondContact O-CD2 3.36Å; R969-Y972 PolarHBondContact O-N 3.21Å
970	Y	90.9	Very high	90.8	Very high	100 Å²	100	61.4 Å²	61.4	39%	0.392	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-59.9	-27.7	178.8	-77.4	-116.2	0	0	0	112.1	Y972 G973 R1191 V1192 V1195	Y970-Y972 PolarHBondContact O-N 2.99Å; Y970-Y972 VanDerWaalsContact O-N 3.12Å; Y970-G973 PolarHBondContact O-N 3.22Å; Y970-R1191 WeakPolarHBondContact OH-CB 3.5Å; Y970-V1192 HydrophobicContact CD1-CB 4.38Å; Y970-V1192 HydrophobicContact CD1-CG1 4.42Å; Y970-V1192 HydrophobicContact CD1-CG2 4.07Å; Y970-V1192 HydrophobicContact CD2-CG2 4.17Å; Y970-V1192 HydrophobicContact CE1-CB 4.45Å; Y970-V1192 HydrophobicContact CE1-CG2 4.07Å; Y970-V1192 HydrophobicContact CE2-CG2 4.17Å; Y970-V1192 HydrophobicContact CG-CG2 4.13Å; Y970-V1195 HydrophobicContact CD1-CB 4.01Å; Y970-V1195 HydrophobicContact CD1-CG1 4.25Å; Y970-V1195 HydrophobicContact CD1-CG2 3.92Å; Y970-V1195 HydrophobicContact CE1-CB 4.14Å; Y970-V1195 HydrophobicContact CE1-CG2 3.6Å
971	D	88.8	Confident	91	Very high	142 Å²	142	59.7 Å²	59.7	76%	0.759	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-60	-22.8	179	-50	-37	0	0	0	113.9	R969 G973	R969-D971 PolarHBondContact O-N 3.12Å; D971-G973 PolarHBondContact O-N 3.43Å
972	Y	88.8	Confident	91.2	Very high	165 Å²	165	60.9 Å²	60.9	65%	0.647	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-71.9	-16	176.7	-74.3	-93.7	0	0	0	113.1	P968 R969 Y970	P968-Y972 HydrophobicContact CB-CD2 4.16Å; P968-Y972 HydrophobicContact CB-CG 4.37Å; R969-Y972 HydrophobicContact CB-CD2 4.15Å; R969-Y972 HydrophobicContact CB-CE2 4.34Å; R969-Y972 WeakPolarHBondContact O-CD2 3.36Å; R969-Y972 PolarHBondContact O-N 3.21Å; Y970-Y972 PolarHBondContact O-N 2.99Å; Y970-Y972 VanDerWaalsContact O-N 3.12Å
973	G	90.8	Very high	91.3	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	70.7	151.5	-175.1	0	0	0	0	0	113.6	Y970 D971 P975 G976 V977 D1196	Y970-G973 PolarHBondContact O-N 3.22Å; D971-G973 PolarHBondContact O-N 3.43Å; G973-P975 VanDerWaalsContact C-CD 3.48Å; G973-G976 WeakPolarHBondContact O-CA 3.48Å; G973-G976 PolarHBondContact O-N 3.46Å; G973-V977 WeakPolarHBondContact O-CG2 3.28Å; G973-V977 PolarHBondContact O-N 2.82Å; G973-D1196 WeakPolarHBondContact CA-OD2 3.26Å
974	S	92.2	Very high	91.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.5	-37.9	-176.3	54.1	0	0	0	0	114.1	G976 V977 V978 D1196 K1198	S974-G976 PolarHBondContact O-N 3.44Å; S974-V977 PolarHBondContact O-N 3.46Å; S974-V978 WeakPolarHBondContact O-CB 3.36Å; S974-V978 WeakPolarHBondContact O-CG2 3.48Å; S974-V978 PolarHBondContact O-N 3.17Å; S974-D1196 WeakPolarHBondContact CB-OD1 3.44Å; S974-D1196 PolarHBondContact N-OD2 3.34Å; S974-D1196 PolarHBondContact OG-OD1 2.78Å; S974-D1196 PolarHBondContact OG-OD2 3.45Å; S974-K1198 PolarHBondContact OG-O 3.3Å
975	P	91.2	Very high	91.7	Very high	15 Å²	15	53.4 Å²	53.4	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-38.7	172.4	-23	35.7	0	0	0	113	G973 S979 K1198 D1200 V1202 L1208	G973-P975 VanDerWaalsContact C-CD 3.48Å; P975-S979 VanDerWaalsContact O-CB 3.27Å; P975-S979 WeakPolarHBondContact O-CB 3.46Å; P975-S979 PolarHBondContact O-N 3.09Å; P975-S979 PolarHBondContact O-OG 2.94Å; P975-K1198 HydrophobicContact CG-CB 3.96Å; P975-D1200 HydrophobicContact CB-CB 3.98Å; P975-D1200 HydrophobicContact CG-CB 3.81Å; P975-D1200 VanDerWaalsContact CG-OD2 3.23Å; P975-D1200 WeakPolarHBondContact CG-OD2 3.46Å; P975-V1202 HydrophobicContact CB-CG2 4.32Å; P975-L1208 HydrophobicContact CB-CD2 4.49Å; P975-L1208 HydrophobicContact CG-CD2 4.01Å
976	G	91.8	Very high	91.7	Very high	29 Å²	29	58.5 Å²	58.5	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-69.5	-43.2	178.1	0	0	0	0	0	112.4	G973 S974 S979 F980	G973-G976 WeakPolarHBondContact O-CA 3.48Å; G973-G976 PolarHBondContact O-N 3.46Å; S974-G976 PolarHBondContact O-N 3.44Å; G976-S979 PolarHBondContact O-N 3.28Å; G976-F980 WeakPolarHBondContact O-CB 3.26Å; G976-F980 PolarHBondContact O-N 3.28Å
977	V	93.3	Very high	91.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-44.5	176.3	177	0	0	0	0	111.3	P968 G973 S974 F980 Y981 V1189 V1192	P968-V977 HydrophobicContact CB-CG2 4.04Å; P968-V977 HydrophobicContact CG-CG1 4.3Å; G973-V977 WeakPolarHBondContact O-CG2 3.28Å; G973-V977 PolarHBondContact O-N 2.82Å; S974-V977 PolarHBondContact O-N 3.46Å; V977-F980 WeakPolarHBondContact O-CB 3.34Å; V977-F980 PolarHBondContact O-N 3.12Å; V977-Y981 HydrophobicContact CG1-CD2 4.02Å; V977-Y981 HydrophobicContact CG1-CE2 3.54Å; V977-Y981 WeakPolarHBondContact O-CD2 3.26Å; V977-Y981 PolarHBondContact O-N 2.89Å; V977-Y981 VanDerWaalsContact O-N 3.13Å; V977-V1189 HydrophobicContact CG1-CG2 4.01Å; V977-V1192 HydrophobicContact CG2-CG1 4.12Å; V977-V1192 HydrophobicContact CG2-CG2 4.31Å
978	V	92.7	Very high	91.7	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-43.2	177.6	169.3	0	0	0	0	111.7	S974 F980 Y981 Y982 V1189 V1202 I1205 L1208 M1211	S974-V978 WeakPolarHBondContact O-CB 3.36Å; S974-V978 WeakPolarHBondContact O-CG2 3.48Å; S974-V978 PolarHBondContact O-N 3.17Å; V978-F980 VanDerWaalsContact C-N 3.27Å; V978-F980 PolarHBondContact O-N 3.02Å; V978-Y981 PolarHBondContact O-N 3.09Å; V978-Y982 WeakPolarHBondContact O-CB 3.45Å; V978-Y982 PolarHBondContact O-N 2.92Å; V978-V1189 HydrophobicContact CG2-CB 3.97Å; V978-V1189 HydrophobicContact CG2-CG1 3.2Å; V978-V1189 HydrophobicContact CG2-CG2 3.48Å; V978-V1189 VanDerWaalsContact CG2-CG2 3.48Å; V978-V1202 HydrophobicContact CG1-CG1 4.34Å; V978-V1202 HydrophobicContact CG1-CG2 4.46Å; V978-I1205 HydrophobicContact CG1-CD1 3.09Å; V978-L1208 HydrophobicContact CB-CD1 4.33Å; V978-L1208 HydrophobicContact CG1-CD1 4.38Å; V978-L1208 HydrophobicContact CG2-CD1 3.67Å; V978-M1211 HydrophobicContact CG1-SD 4.01Å
979	S	92.4	Very high	91.6	Very high	49 Å²	49	57.6 Å²	57.6	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-60.2	-38.4	175.3	-62.1	0	0	0	0	111.9	P975 G976 A983 V1202	P975-S979 VanDerWaalsContact O-CB 3.27Å; P975-S979 WeakPolarHBondContact O-CB 3.46Å; P975-S979 PolarHBondContact O-N 3.09Å; P975-S979 PolarHBondContact O-OG 2.94Å; G976-S979 PolarHBondContact O-N 3.28Å; S979-A983 WeakPolarHBondContact O-CB 3.38Å; S979-A983 PolarHBondContact O-N 2.87Å; S979-V1202 WeakPolarHBondContact OG-CG1 3.27Å
980	F	93.8	Very high	91.5	Very high	67 Å²	67	55.1 Å²	55.1	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-52.4	174.2	172.4	-95.8	0	0	0	111.4	K966 P968 G976 V977 V978 Y982 A983 Q984	K966-F980 WeakPolarHBondContact O-CE1 3.05Å; P968-F980 HydrophobicContact CG-CB 4.28Å; P968-F980 HydrophobicContact CG-CD1 3.41Å; P968-F980 VanDerWaalsContact CG-CD1 3.41Å; P968-F980 HydrophobicContact CG-CE1 3.83Å; P968-F980 HydrophobicContact CG-CG 3.86Å; G976-F980 WeakPolarHBondContact O-CB 3.26Å; G976-F980 PolarHBondContact O-N 3.28Å; V977-F980 WeakPolarHBondContact O-CB 3.34Å; V977-F980 PolarHBondContact O-N 3.12Å; V978-F980 VanDerWaalsContact C-N 3.27Å; V978-F980 PolarHBondContact O-N 3.02Å; F980-Y982 VanDerWaalsContact C-N 3.35Å; F980-Y982 PolarHBondContact O-N 3.42Å; F980-A983 PolarHBondContact O-N 2.91Å; F980-Q984 HydrophobicContact CD1-CG 4.31Å; F980-Q984 HydrophobicContact CD2-CG 4.4Å; F980-Q984 HydrophobicContact CE1-CG 3.94Å; F980-Q984 HydrophobicContact CE2-CG 4.05Å; F980-Q984 HydrophobicContact CZ-CG 3.8Å; F980-Q984 VanDerWaalsContact O-CG 3.28Å; F980-Q984 WeakPolarHBondContact O-CG 3.43Å; F980-Q984 PolarHBondContact O-N 3.35Å
981	Y	94.4	Very high	91.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-39.6	179.5	-68.4	-48.6	0	0	0	112.8	L967 P968 V977 V978 A983 Q984 L985 F1142 F1185 H1188 V1189	L967-Y981 WeakPolarHBondContact CD2-OH 3.46Å; P968-Y981 WeakPolarHBondContact CD-OH 3.36Å; V977-Y981 HydrophobicContact CG1-CD2 4.02Å; V977-Y981 HydrophobicContact CG1-CE2 3.54Å; V977-Y981 WeakPolarHBondContact O-CD2 3.26Å; V977-Y981 PolarHBondContact O-N 2.89Å; V977-Y981 VanDerWaalsContact O-N 3.13Å; V978-Y981 PolarHBondContact O-N 3.09Å; Y981-A983 VanDerWaalsContact C-N 3.33Å; Y981-A983 PolarHBondContact O-N 3.31Å; Y981-Q984 PolarHBondContact O-N 3.41Å; Y981-L985 WeakPolarHBondContact O-CB 3.38Å; Y981-L985 WeakPolarHBondContact O-CG 3.47Å; Y981-L985 PolarHBondContact O-N 3.08Å; Y981-F1142 HydrophobicContact CG-CE2 4.46Å; Y981-F1185 HydrophobicContact CD1-CB 4.22Å; Y981-F1185 AromaticContact CD1-CD1 3.79Å; Y981-F1185 HydrophobicContact CD1-CD1 3.79Å; Y981-F1185 HydrophobicContact CD1-CE1 4.37Å; Y981-F1185 HydrophobicContact CD1-CG 4.11Å; Y981-F1185 HydrophobicContact CD2-CB 4.2Å; Y981-F1185 HydrophobicContact CE1-CB 4.24Å; Y981-F1185 AromaticContact CE1-CD1 3.37Å; Y981-F1185 HydrophobicContact CE1-CD1 3.37Å; Y981-F1185 AromaticContact CE1-CE1 3.99Å; Y981-F1185 HydrophobicContact CE1-CE1 3.99Å; Y981-F1185 HydrophobicContact CE1-CG 4.08Å; Y981-F1185 HydrophobicContact CE2-CB 4.17Å; Y981-F1185 HydrophobicContact CG-CB 4.22Å; Y981-F1185 AromaticContact CZ-CD1 3.84Å; Y981-H1188 PolarHBondContact OH-CD2 2.81Å; Y981-V1189 HydrophobicContact CD2-CG2 3.61Å; Y981-V1189 HydrophobicContact CE2-CG2 3.77Å
982	Y	93.1	Very high	91.2	Very high	34 Å²	34	50.7 Å²	50.7	13%	0.133	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-42.3	175.1	-177.7	-99.7	0	0	0	112.2	V978 F980 L985 K986 V989 F1142 I1205	V978-Y982 WeakPolarHBondContact O-CB 3.45Å; V978-Y982 PolarHBondContact O-N 2.92Å; F980-Y982 VanDerWaalsContact C-N 3.35Å; F980-Y982 PolarHBondContact O-N 3.42Å; Y982-L985 PolarHBondContact O-N 3.46Å; Y982-K986 WeakPolarHBondContact O-CA 3.29Å; Y982-K986 WeakPolarHBondContact O-CB 3.43Å; Y982-K986 PolarHBondContact O-N 3.09Å; Y982-V989 HydrophobicContact CE2-CG1 4.19Å; Y982-F1142 HydrophobicContact CD2-CE1 4.31Å; Y982-I1205 HydrophobicContact CD2-CD1 4.1Å; Y982-I1205 HydrophobicContact CD2-CG1 3.75Å; Y982-I1205 HydrophobicContact CE2-CG1 4.24Å; Y982-I1205 HydrophobicContact CG-CD1 4.21Å; Y982-I1205 HydrophobicContact CG-CG1 4.23Å
983	A	91.8	Very high	91.1	Very high	65 Å²	65	47 Å²	47	54%	0.537	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.4	0	0	0	0	0	112.1	S979 F980 Y981	S979-A983 WeakPolarHBondContact O-CB 3.38Å; S979-A983 PolarHBondContact O-N 2.87Å; F980-A983 PolarHBondContact O-N 2.91Å; Y981-A983 VanDerWaalsContact C-N 3.33Å; Y981-A983 PolarHBondContact O-N 3.31Å
984	Q	92.3	Very high	91	Very high	72 Å²	72	47.3 Å²	47.3	34%	0.336	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-36.3	178.7	-69.1	-60.2	-22.5	0	0	112.9	P962 F980 Y981	P962-Q984 HydrophobicContact CG-CB 4.21Å; F980-Q984 HydrophobicContact CD1-CG 4.31Å; F980-Q984 HydrophobicContact CD2-CG 4.4Å; F980-Q984 HydrophobicContact CE1-CG 3.94Å; F980-Q984 HydrophobicContact CE2-CG 4.05Å; F980-Q984 HydrophobicContact CZ-CG 3.8Å; F980-Q984 VanDerWaalsContact O-CG 3.28Å; F980-Q984 WeakPolarHBondContact O-CG 3.43Å; F980-Q984 PolarHBondContact O-N 3.35Å; Y981-Q984 PolarHBondContact O-N 3.41Å
985	L	92	Very high	90.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-101	5.3	-175.1	-60.5	178.2	0	0	0	113.6	V961 Y981 Y982 K987 L988 V989 A1139 F1142 F1185	V961-L985 HydrophobicContact CG1-CD2 4.4Å; V961-L985 HydrophobicContact CG2-CD2 4.43Å; Y981-L985 WeakPolarHBondContact O-CB 3.38Å; Y981-L985 WeakPolarHBondContact O-CG 3.47Å; Y981-L985 PolarHBondContact O-N 3.08Å; Y982-L985 PolarHBondContact O-N 3.46Å; L985-K987 VanDerWaalsContact C-N 3.25Å; L985-K987 PolarHBondContact O-N 3.04Å; L985-K987 VanDerWaalsContact O-N 3.12Å; L985-L988 WeakPolarHBondContact O-CB 3.03Å; L985-L988 PolarHBondContact O-N 2.86Å; L985-V989 PolarHBondContact O-N 3.11Å; L985-A1139 HydrophobicContact CD1-CB 4.17Å; L985-A1139 HydrophobicContact CD2-CB 3.8Å; L985-F1142 HydrophobicContact CB-CD1 4.44Å; L985-F1142 HydrophobicContact CD1-CB 3.71Å; L985-F1142 HydrophobicContact CD1-CD1 3.72Å; L985-F1142 HydrophobicContact CD1-CG 3.74Å; L985-F1185 HydrophobicContact CD1-CD2 4.05Å; L985-F1185 HydrophobicContact CD1-CE2 4.29Å
986	K	90.8	Very high	90.7	Very high	108 Å²	108	54 Å²	54	47%	0.47	28%	0.276	S	S	.	.	H	α-helix	trans	-49.8	-43.5	-175.2	-166.5	175	179.8	-179.1	0	112.9	Y982 L988 V989 F990	Y982-K986 WeakPolarHBondContact O-CA 3.29Å; Y982-K986 WeakPolarHBondContact O-CB 3.43Å; Y982-K986 PolarHBondContact O-N 3.09Å; K986-L988 VanDerWaalsContact C-N 3.32Å; K986-L988 PolarHBondContact O-N 2.8Å; K986-V989 PolarHBondContact O-N 2.84Å; K986-F990 HydrophobicContact CD-CE2 4.14Å; K986-F990 VanDerWaalsContact CE-CE2 3.49Å; K986-F990 HydrophobicContact CG-CD2 3.72Å; K986-F990 HydrophobicContact CG-CE2 3.51Å; K986-F990 WeakPolarHBondContact O-CD2 3.44Å; K986-F990 PolarHBondContact O-N 2.95Å; K986-F990 VanDerWaalsContact O-N 3.1Å
987	K	90.5	Very high	90.6	Very high	151 Å²	151	56 Å²	56	66%	0.657	28%	0.28	S	S	*	.	H	α-helix	trans	-62.1	-37.6	179.5	-66.6	-176.9	-179.8	179.6	0	113	L960 L985	L960-K987 HydrophobicContact CB-CB 4.36Å; L960-K987 HydrophobicContact CD2-CB 4.3Å; L985-K987 VanDerWaalsContact C-N 3.25Å; L985-K987 PolarHBondContact O-N 3.04Å; L985-K987 VanDerWaalsContact O-N 3.12Å
988	L	91.4	Very high	90.5	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-72.3	-42.4	176.8	-176.8	64.1	0	0	0	110.7	V957 L960 V961 L985 K986 F990 N991 L994 Q995 A1139 L1140 V1143	V957-L988 HydrophobicContact CG1-CD1 4.17Å; V957-L988 HydrophobicContact CG1-CD2 4.37Å; V957-L988 HydrophobicContact CG2-CD1 4.18Å; L960-L988 HydrophobicContact CB-CB 4.42Å; L960-L988 HydrophobicContact CD1-CD1 4.24Å; V961-L988 HydrophobicContact CG2-CD2 4.3Å; L985-L988 WeakPolarHBondContact O-CB 3.03Å; L985-L988 PolarHBondContact O-N 2.86Å; K986-L988 VanDerWaalsContact C-N 3.32Å; K986-L988 PolarHBondContact O-N 2.8Å; L988-F990 VanDerWaalsContact C-N 3.31Å; L988-F990 PolarHBondContact O-N 2.79Å; L988-N991 PolarHBondContact O-N 2.78Å; L988-L994 HydrophobicContact CD1-CD2 4.33Å; L988-Q995 PolarHBondContact O-NE2 2.92Å; L988-A1139 HydrophobicContact CD2-CB 3.86Å; L988-L1140 HydrophobicContact CD2-CD2 4.26Å; L988-V1143 HydrophobicContact CD2-CG2 4.04Å; L988-V1143 HydrophobicContact CG-CG2 4.06Å
989	V	89.3	Confident	90.6	Very high	24 Å²	24	56.3 Å²	56.3	15%	0.145	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-37.5	179.2	175.7	0	0	0	0	112.3	Y982 L985 K986 Q995 V1143 I1146	Y982-V989 HydrophobicContact CE2-CG1 4.19Å; L985-V989 PolarHBondContact O-N 3.11Å; K986-V989 PolarHBondContact O-N 2.84Å; V989-Q995 VanDerWaalsContact C-NE2 3.3Å; V989-Q995 PolarHBondContact O-NE2 3.3Å; V989-V1143 HydrophobicContact CG2-CG2 4.08Å; V989-I1146 HydrophobicContact CG1-CD1 4.01Å; V989-I1146 HydrophobicContact CG2-CD1 4.05Å
990	F	88.7	Confident	90.5	Very high	134 Å²	134	56.1 Å²	56.1	59%	0.588	28%	0.275	S	S	*	.	H	α-helix	trans	-81.1	-14.7	178.7	-78	-69.2	0	0	0	114.7	K986 L988 T992	K986-F990 HydrophobicContact CD-CE2 4.14Å; K986-F990 VanDerWaalsContact CE-CE2 3.49Å; K986-F990 HydrophobicContact CG-CD2 3.72Å; K986-F990 HydrophobicContact CG-CE2 3.51Å; K986-F990 WeakPolarHBondContact O-CD2 3.44Å; K986-F990 PolarHBondContact O-N 2.95Å; K986-F990 VanDerWaalsContact O-N 3.1Å; L988-F990 VanDerWaalsContact C-N 3.31Å; L988-F990 PolarHBondContact O-N 2.79Å; F990-T992 PolarHBondContact O-N 3.45Å; F990-T992 VanDerWaalsContact O-N 3.13Å
991	N	89	Confident	90.5	Very high	59 Å²	59	53.6 Å²	53.6	32%	0.316	27%	0.265	S	S	.	.			trans	-88.6	75.8	-178.8	-163.3	-29.2	0	0	0	111.4	L960 L988 D993 L994 Q995	L960-N991 HydrophobicContact CD1-CB 4.21Å; L988-N991 PolarHBondContact O-N 2.78Å; N991-D993 VanDerWaalsContact C-N 3.35Å; N991-D993 PolarHBondContact O-N 3.13Å; N991-L994 HydrophobicContact CB-CB 4.26Å; N991-L994 PolarHBondContact O-N 2.85Å; N991-L994 VanDerWaalsContact OD1-CB 3.23Å; N991-L994 WeakPolarHBondContact OD1-CB 3.44Å; N991-L994 PolarHBondContact OD1-N 2.98Å; N991-L994 VanDerWaalsContact OD1-N 3.12Å; N991-Q995 WeakPolarHBondContact O-CG 3.34Å; N991-Q995 PolarHBondContact O-N 2.88Å; N991-Q995 VanDerWaalsContact O-N 3.12Å
992	T	85	Confident	90.6	Very high	91 Å²	91	53.7 Å²	53.7	56%	0.558	27%	0.266	S	S	*	.	H	α-helix	trans	-67.2	-30.7	-175.5	51.6	0	0	0	0	113.7	F990 Q995 R996	F990-T992 PolarHBondContact O-N 3.45Å; F990-T992 VanDerWaalsContact O-N 3.13Å; T992-Q995 PolarHBondContact O-N 3.44Å; T992-R996 PolarHBondContact O-N 2.66Å
993	D	85.8	Confident	90.6	Very high	88 Å²	88	52.5 Å²	52.5	47%	0.471	26%	0.261	S	S	.	.	H	α-helix	trans	-67.3	-46.1	176.6	-73.1	-50.4	0	0	0	111.1	N991 Q995 R996 D997	N991-D993 VanDerWaalsContact C-N 3.35Å; N991-D993 PolarHBondContact O-N 3.13Å; D993-Q995 VanDerWaalsContact C-N 3.29Å; D993-Q995 PolarHBondContact O-N 3Å; D993-R996 WeakPolarHBondContact O-CB 3.29Å; D993-R996 PolarHBondContact O-N 3.48Å; D993-R996 VanDerWaalsContact O-N 3.16Å; D993-R996 IonicContact OD1-CZ 3.31Å; D993-R996 IonicContact OD1-NH1 2.75Å; D993-R996 IonicContact OD1-NH2 3.67Å; D993-R996 PolarHBondContact OD1-NH2 2.74Å; D993-D997 VanDerWaalsContact O-CG 3.28Å; D993-D997 PolarHBondContact O-N 2.97Å
994	L	89.2	Confident	90.7	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-39.6	175.7	-179.7	62.3	0	0	0	111.8	A953 K956 V957 L960 L988 N991 D997 I998	A953-L994 HydrophobicContact CB-CD1 4.22Å; K956-L994 HydrophobicContact CB-CD1 3.82Å; K956-L994 HydrophobicContact CB-CD2 3.97Å; K956-L994 HydrophobicContact CD-CD1 3.93Å; V957-L994 HydrophobicContact CG2-CD1 4.46Å; V957-L994 HydrophobicContact CG2-CD2 3.81Å; V957-L994 HydrophobicContact CG2-CG 4.17Å; L960-L994 HydrophobicContact CD1-CD2 3.61Å; L988-L994 HydrophobicContact CD1-CD2 4.33Å; N991-L994 HydrophobicContact CB-CB 4.26Å; N991-L994 PolarHBondContact O-N 2.85Å; N991-L994 VanDerWaalsContact OD1-CB 3.23Å; N991-L994 WeakPolarHBondContact OD1-CB 3.44Å; N991-L994 PolarHBondContact OD1-N 2.98Å; N991-L994 VanDerWaalsContact OD1-N 3.12Å; L994-D997 PolarHBondContact O-N 3.33Å; L994-I998 VanDerWaalsContact O-CG2 3.29Å; L994-I998 WeakPolarHBondContact O-CG2 3.17Å; L994-I998 PolarHBondContact O-N 3.44Å
995	Q	88.9	Confident	90.9	Very high	26 Å²	26	47.4 Å²	47.4	12%	0.121	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-46.3	173.9	-71.4	169.5	31.2	0	0	111.2	L988 V989 N991 T992 D993 I998 F999 V1143	L988-Q995 PolarHBondContact O-NE2 2.92Å; V989-Q995 VanDerWaalsContact C-NE2 3.3Å; V989-Q995 PolarHBondContact O-NE2 3.3Å; N991-Q995 WeakPolarHBondContact O-CG 3.34Å; N991-Q995 PolarHBondContact O-N 2.88Å; N991-Q995 VanDerWaalsContact O-N 3.12Å; T992-Q995 PolarHBondContact O-N 3.44Å; D993-Q995 VanDerWaalsContact C-N 3.29Å; D993-Q995 PolarHBondContact O-N 3Å; Q995-I998 WeakPolarHBondContact O-CG2 3.44Å; Q995-F999 HydrophobicContact CB-CD2 4.15Å; Q995-F999 HydrophobicContact CB-CE2 3.87Å; Q995-F999 HydrophobicContact CB-CZ 4.44Å; Q995-F999 HydrophobicContact CG-CE2 4.28Å; Q995-F999 HydrophobicContact CG-CZ 4.5Å; Q995-F999 WeakPolarHBondContact O-CB 3.38Å; Q995-F999 WeakPolarHBondContact O-CD2 3.45Å; Q995-F999 WeakPolarHBondContact O-CG 3.39Å; Q995-F999 PolarHBondContact O-N 2.77Å; Q995-V1143 HydrophobicContact CG-CG1 4.21Å
996	R	88	Confident	91.1	Very high	130 Å²	130	47.4 Å²	47.4	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-59.3	-49.8	176.5	-175.8	-175.5	62.8	-141	-15.8	110.7	T992 D993 I998 F999 Q1000	T992-R996 PolarHBondContact O-N 2.66Å; D993-R996 WeakPolarHBondContact O-CB 3.29Å; D993-R996 PolarHBondContact O-N 3.48Å; D993-R996 VanDerWaalsContact O-N 3.16Å; D993-R996 IonicContact OD1-CZ 3.31Å; D993-R996 IonicContact OD1-NH1 2.75Å; D993-R996 IonicContact OD1-NH2 3.67Å; D993-R996 PolarHBondContact OD1-NH2 2.74Å; R996-I998 PolarHBondContact O-N 3.01Å; R996-F999 PolarHBondContact O-N 3.43Å; R996-Q1000 WeakPolarHBondContact O-CB 3.48Å; R996-Q1000 PolarHBondContact O-N 2.86Å
997	D	89.3	Confident	91.4	Very high	70 Å²	70	42.3 Å²	42.3	37%	0.374	20%	0.204	S	C	.	.	H	α-helix	trans	-60.9	-45.6	-176.9	-65.8	-7.2	0	0	0	112.1	D993 L994 S1001	D993-D997 VanDerWaalsContact O-CG 3.28Å; D993-D997 PolarHBondContact O-N 2.97Å; L994-D997 PolarHBondContact O-N 3.33Å; D997-S1001 WeakPolarHBondContact O-CB 3.32Å; D997-S1001 PolarHBondContact O-N 3.02Å; D997-S1001 VanDerWaalsContact O-N 3.08Å; D997-S1001 PolarHBondContact O-OG 3.1Å
998	I	92.5	Very high	91.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-73.2	-41.9	179.8	-162.6	165.6	0	0	0	112	A953 L954 V957 L994 Q995 R996 Q1000 S1001 C1002 L1140	A953-I998 HydrophobicContact CB-CB 3.92Å; A953-I998 HydrophobicContact CB-CD1 4.16Å; A953-I998 HydrophobicContact CB-CG1 4.05Å; L954-I998 HydrophobicContact CD2-CD1 3.7Å; L954-I998 HydrophobicContact CG-CD1 4.08Å; V957-I998 HydrophobicContact CG2-CD1 3.95Å; L994-I998 VanDerWaalsContact O-CG2 3.29Å; L994-I998 WeakPolarHBondContact O-CG2 3.17Å; L994-I998 PolarHBondContact O-N 3.44Å; Q995-I998 WeakPolarHBondContact O-CG2 3.44Å; R996-I998 PolarHBondContact O-N 3.01Å; I998-Q1000 VanDerWaalsContact C-N 3.32Å; I998-Q1000 PolarHBondContact O-N 3.03Å; I998-S1001 PolarHBondContact O-N 3.39Å; I998-C1002 VanDerWaalsContact O-CB 3.25Å; I998-C1002 WeakPolarHBondContact O-CB 3.33Å; I998-C1002 PolarHBondContact O-N 3.39Å; I998-C1002 PolarHBondContact O-SG 3.45Å; I998-L1140 HydrophobicContact CD1-CD1 3.7Å; I998-L1140 HydrophobicContact CD1-CD2 4.45Å; I998-L1140 HydrophobicContact CG2-CD2 4.06Å
999	F	94	Very high	91.9	Very high	5 Å²	5	35.1 Å²	35.1	2%	0.022	17%	0.173	C	C	.	.	H	α-helix	trans	-68.4	-35.1	179.6	-64.3	-21	0	0	0	111.9	Q995 R996 R1003 L1140 V1143 F1144 I1155 Y1159 L1163	Q995-F999 HydrophobicContact CB-CD2 4.15Å; Q995-F999 HydrophobicContact CB-CE2 3.87Å; Q995-F999 HydrophobicContact CB-CZ 4.44Å; Q995-F999 HydrophobicContact CG-CE2 4.28Å; Q995-F999 HydrophobicContact CG-CZ 4.5Å; Q995-F999 WeakPolarHBondContact O-CB 3.38Å; Q995-F999 WeakPolarHBondContact O-CD2 3.45Å; Q995-F999 WeakPolarHBondContact O-CG 3.39Å; Q995-F999 PolarHBondContact O-N 2.77Å; R996-F999 PolarHBondContact O-N 3.43Å; F999-R1003 WeakPolarHBondContact O-CB 3.3Å; F999-R1003 PolarHBondContact O-N 3.12Å; F999-L1140 HydrophobicContact CE1-CB 4.26Å; F999-L1140 HydrophobicContact CE1-CD2 3.97Å; F999-L1140 HydrophobicContact CZ-CD2 4.44Å; F999-V1143 HydrophobicContact CZ-CG1 4.32Å; F999-F1144 HydrophobicContact CE1-CD1 4.31Å; F999-F1144 HydrophobicContact CZ-CD1 4.31Å; F999-I1155 HydrophobicContact CE2-CD1 4.45Å; F999-Y1159 HydrophobicContact CB-CD1 3.92Å; F999-Y1159 HydrophobicContact CB-CD2 4.25Å; F999-Y1159 HydrophobicContact CB-CE1 3.63Å; F999-Y1159 HydrophobicContact CB-CE2 3.94Å; F999-Y1159 HydrophobicContact CB-CG 4.27Å; F999-Y1159 HydrophobicContact CD2-CE2 4.2Å; F999-Y1159 WeakPolarHBondContact O-CD1 3.39Å; F999-L1163 HydrophobicContact CB-CD1 4.14Å; F999-L1163 HydrophobicContact CB-CD2 4.49Å; F999-L1163 HydrophobicContact CD1-CD1 3.68Å; F999-L1163 HydrophobicContact CD1-CD2 4.13Å; F999-L1163 HydrophobicContact CE1-CD1 4.47Å; F999-L1163 HydrophobicContact CG-CD1 4.18Å; F999-L1163 HydrophobicContact CG-CD2 4.22Å
1000	Q	91.6	Very high	92.3	Very high	46 Å²	46	34 Å²	34	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-54.5	172.2	178.7	57.4	45.5	0	0	111.1	R996 I998 C1002 R1003 E1004 Y1159	R996-Q1000 WeakPolarHBondContact O-CB 3.48Å; R996-Q1000 PolarHBondContact O-N 2.86Å; I998-Q1000 VanDerWaalsContact C-N 3.32Å; I998-Q1000 PolarHBondContact O-N 3.03Å; Q1000-C1002 VanDerWaalsContact C-N 3.3Å; Q1000-C1002 PolarHBondContact O-N 3.12Å; Q1000-R1003 WeakPolarHBondContact O-CB 3.46Å; Q1000-R1003 PolarHBondContact O-N 3.44Å; Q1000-R1003 VanDerWaalsContact O-N 3.09Å; Q1000-E1004 WeakPolarHBondContact CG-OE1 3.4Å; Q1000-E1004 PolarHBondContact NE2-OE1 2.9Å; Q1000-E1004 PolarHBondContact O-N 2.93Å; Q1000-Y1159 HydrophobicContact CB-CE1 4.37Å
1001	S	93.5	Very high	92.6	Very high	13 Å²	13	27.6 Å²	27.6	9%	0.091	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-39.8	179.4	-55.1	0	0	0	0	112	D997 I998 E1004 L1005	D997-S1001 WeakPolarHBondContact O-CB 3.32Å; D997-S1001 PolarHBondContact O-N 3.02Å; D997-S1001 VanDerWaalsContact O-N 3.08Å; D997-S1001 PolarHBondContact O-OG 3.1Å; I998-S1001 PolarHBondContact O-N 3.39Å; S1001-E1004 PolarHBondContact O-N 2.73Å; S1001-L1005 PolarHBondContact O-N 3.18Å; S1001-L1005 VanDerWaalsContact O-N 3.12Å
1002	C	94.9	Very high	92.9	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-67.5	-36.3	175.5	-73	0	0	0	0	112.2	I998 Q1000 G1006 L1163 C1166	I998-C1002 VanDerWaalsContact O-CB 3.25Å; I998-C1002 WeakPolarHBondContact O-CB 3.33Å; I998-C1002 PolarHBondContact O-N 3.39Å; I998-C1002 PolarHBondContact O-SG 3.45Å; Q1000-C1002 VanDerWaalsContact C-N 3.3Å; Q1000-C1002 PolarHBondContact O-N 3.12Å; C1002-G1006 PolarHBondContact O-N 3.26Å; C1002-L1163 HydrophobicContact CB-CD1 3.56Å; C1002-C1166 HydrophobicContact CB-CB 3.89Å; C1002-C1166 WeakPolarHBondContact O-CB 3.43Å; C1002-C1166 PolarHBondContact SG-SG 3.31Å
1003	R	93.7	Very high	93.4	Very high	8 Å²	8	20.6 Å²	20.6	3%	0.03	10%	0.098	C	C	.	.	H	α-helix	trans	-62.3	-47.9	174	179.3	-179.6	78.8	-121.2	2.9	111	L857 F999 Q1000 L1005 G1006 N1007 Y1159	L857-R1003 VanDerWaalsContact C-NH2 3.32Å; L857-R1003 PolarHBondContact O-NH2 3.45Å; F999-R1003 WeakPolarHBondContact O-CB 3.3Å; F999-R1003 PolarHBondContact O-N 3.12Å; Q1000-R1003 WeakPolarHBondContact O-CB 3.46Å; Q1000-R1003 PolarHBondContact O-N 3.44Å; Q1000-R1003 VanDerWaalsContact O-N 3.09Å; R1003-L1005 VanDerWaalsContact C-N 3.34Å; R1003-L1005 PolarHBondContact O-N 2.64Å; R1003-G1006 PolarHBondContact O-N 3.22Å; R1003-N1007 WeakPolarHBondContact O-CB 3.43Å; R1003-N1007 PolarHBondContact O-N 3.03Å; R1003-Y1159 HydrophobicContact CB-CD1 4.08Å; R1003-Y1159 WeakPolarHBondContact CD-O 3.23Å; R1003-Y1159 WeakPolarHBondContact CG-O 3.41Å; R1003-Y1159 VanDerWaalsContact NH1-CE1 3.26Å
1004	E	94.7	Very high	93.9	Very high	30 Å²	30	17.4 Å²	17.4	14%	0.14	8%	0.08	C	C	.	.	H	α-helix	trans	-58	-46.8	179.5	-71	168.7	-129.6	0	0	111.4	L856 L857 L945 Q1000 S1001 N1007 T1008	L856-E1004 HydrophobicContact CB-CB 4.4Å; L856-E1004 HydrophobicContact CB-CG 4.35Å; L856-E1004 WeakPolarHBondContact O-CG 3.33Å; L857-E1004 HydrophobicContact CD2-CG 3.94Å; L857-E1004 WeakPolarHBondContact CD2-OE1 3.21Å; L945-E1004 HydrophobicContact CD1-CB 3.81Å; L945-E1004 HydrophobicContact CD2-CB 4.49Å; Q1000-E1004 WeakPolarHBondContact CG-OE1 3.4Å; Q1000-E1004 PolarHBondContact NE2-OE1 2.9Å; Q1000-E1004 PolarHBondContact O-N 2.93Å; S1001-E1004 PolarHBondContact O-N 2.73Å; E1004-N1007 PolarHBondContact O-N 3.43Å; E1004-T1008 WeakPolarHBondContact O-CB 3.21Å; E1004-T1008 PolarHBondContact O-N 3.32Å; E1004-T1008 PolarHBondContact O-OG1 3.28Å
1005	L	96.4	Very high	94.3	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-64.7	-42.9	176.9	-176.7	63.2	0	0	0	111.8	L945 L946 I950 S1001 R1003 T1008 I1009 M1105 C1166	L945-L1005 HydrophobicContact CD1-CB 4.26Å; L946-L1005 HydrophobicContact CD1-CD2 4.4Å; L946-L1005 HydrophobicContact CD2-CD2 3.45Å; L946-L1005 VanDerWaalsContact CD2-CD2 3.45Å; L946-L1005 HydrophobicContact CG-CD2 3.86Å; I950-L1005 HydrophobicContact CD1-CB 4.16Å; I950-L1005 HydrophobicContact CD1-CD2 3.67Å; S1001-L1005 PolarHBondContact O-N 3.18Å; S1001-L1005 VanDerWaalsContact O-N 3.12Å; R1003-L1005 VanDerWaalsContact C-N 3.34Å; R1003-L1005 PolarHBondContact O-N 2.64Å; L1005-T1008 WeakPolarHBondContact O-CB 3.49Å; L1005-T1008 PolarHBondContact O-N 3.18Å; L1005-I1009 HydrophobicContact CG-CD1 4.24Å; L1005-I1009 WeakPolarHBondContact O-CG1 3.03Å; L1005-I1009 PolarHBondContact O-N 3.4Å; L1005-M1105 HydrophobicContact CD1-CE 4.22Å; L1005-C1166 HydrophobicContact CB-CB 4.44Å
1006	G	96.4	Very high	94.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63.7	-42.5	177.8	0	0	0	0	0	113.5	C1002 R1003 T1008 I1009 L1010 G1162	C1002-G1006 PolarHBondContact O-N 3.26Å; R1003-G1006 PolarHBondContact O-N 3.22Å; G1006-T1008 VanDerWaalsContact C-N 3.28Å; G1006-T1008 PolarHBondContact O-N 2.99Å; G1006-I1009 PolarHBondContact O-N 2.52Å; G1006-L1010 WeakPolarHBondContact O-CB 3.48Å; G1006-L1010 WeakPolarHBondContact O-CG 3.28Å; G1006-L1010 PolarHBondContact O-N 3.22Å; G1006-G1162 VanDerWaalsContact CA-O 3.29Å; G1006-G1162 WeakPolarHBondContact CA-O 3.49Å
1007	N	96.3	Very high	94.9	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.5	-36.3	173.8	-75.8	-10.1	0	0	0	111.2	F855 L856 Y859 R1003 E1004 L1010 F1011	F855-N1007 HydrophobicContact CE1-CB 4.28Å; L856-N1007 HydrophobicContact CD2-CB 3.74Å; L856-N1007 PolarHBondContact O-ND2 3.15Å; Y859-N1007 PolarHBondContact O-ND2 2.86Å; R1003-N1007 WeakPolarHBondContact O-CB 3.43Å; R1003-N1007 PolarHBondContact O-N 3.03Å; E1004-N1007 PolarHBondContact O-N 3.43Å; N1007-L1010 PolarHBondContact O-N 2.91Å; N1007-F1011 VanDerWaalsContact O-CB 3.26Å; N1007-F1011 WeakPolarHBondContact O-CB 3.43Å; N1007-F1011 PolarHBondContact O-N 3.13Å
1008	T	96.8	Very high	95.2	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.1	-49.8	174.6	-57.7	0	0	0	0	111	L856 L938 S942 E1004 L1005 G1006 L1010 F1011 C1012 M1105	L856-T1008 WeakPolarHBondContact CD1-OG1 3.31Å; L856-T1008 VanDerWaalsContact CD2-OG1 3.24Å; L856-T1008 WeakPolarHBondContact CD2-OG1 3.32Å; L938-T1008 HydrophobicContact CB-CG2 3.82Å; L938-T1008 HydrophobicContact CD1-CG2 4.36Å; L938-T1008 HydrophobicContact CD2-CG2 4.09Å; L938-T1008 HydrophobicContact CG-CG2 4.31Å; S942-T1008 WeakPolarHBondContact OG-CG2 3.48Å; E1004-T1008 WeakPolarHBondContact O-CB 3.21Å; E1004-T1008 PolarHBondContact O-N 3.32Å; E1004-T1008 PolarHBondContact O-OG1 3.28Å; L1005-T1008 WeakPolarHBondContact O-CB 3.49Å; L1005-T1008 PolarHBondContact O-N 3.18Å; G1006-T1008 VanDerWaalsContact C-N 3.28Å; G1006-T1008 PolarHBondContact O-N 2.99Å; T1008-L1010 VanDerWaalsContact C-N 3.34Å; T1008-L1010 PolarHBondContact O-N 3.18Å; T1008-F1011 PolarHBondContact O-N 3.26Å; T1008-C1012 PolarHBondContact O-N 3.08Å; T1008-C1012 PolarHBondContact O-SG 2.93Å; T1008-M1105 HydrophobicContact CG2-CE 4.49Å
1009	I	96	Very high	95.3	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-58.8	-47.5	177.2	-68.3	169.7	0	0	0	110.4	L1005 G1006 C1012 L1013 F1098 L1102 M1105 W1165 A1169	L1005-I1009 HydrophobicContact CG-CD1 4.24Å; L1005-I1009 WeakPolarHBondContact O-CG1 3.03Å; L1005-I1009 PolarHBondContact O-N 3.4Å; G1006-I1009 PolarHBondContact O-N 2.52Å; I1009-C1012 PolarHBondContact O-N 2.91Å; I1009-L1013 PolarHBondContact O-N 3.49Å; I1009-F1098 HydrophobicContact CG2-CE2 3.63Å; I1009-F1098 HydrophobicContact CG2-CZ 3.62Å; I1009-F1098 VanDerWaalsContact O-CE2 3.3Å; I1009-F1098 WeakPolarHBondContact O-CE2 3.25Å; I1009-L1102 HydrophobicContact CG2-CD2 4.48Å; I1009-M1105 HydrophobicContact CD1-SD 4.32Å; I1009-M1105 HydrophobicContact CG1-CE 3.85Å; I1009-M1105 HydrophobicContact CG1-SD 3.98Å; I1009-W1165 HydrophobicContact CG2-CE3 4.13Å; I1009-A1169 HydrophobicContact CD1-CB 3.61Å
1010	L	96.7	Very high	95.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-40	179.5	-77.5	164.1	0	0	0	112.8	Y861 F868 G1006 N1007 T1008 L1013 H1014 W1165	Y861-L1010 HydrophobicContact CD1-CD1 3.5Å; Y861-L1010 VanDerWaalsContact CD1-CD1 3.5Å; Y861-L1010 HydrophobicContact CD1-CD2 3.76Å; Y861-L1010 HydrophobicContact CD1-CG 4.28Å; Y861-L1010 HydrophobicContact CD2-CD1 4.37Å; Y861-L1010 HydrophobicContact CE1-CD1 4.28Å; Y861-L1010 HydrophobicContact CE1-CD2 3.66Å; Y861-L1010 HydrophobicContact CG-CD1 3.56Å; Y861-L1010 HydrophobicContact CG-CD2 4.3Å; Y861-L1010 HydrophobicContact CG-CG 4.5Å; F868-L1010 HydrophobicContact CE1-CB 4.29Å; F868-L1010 HydrophobicContact CE1-CD1 4.27Å; F868-L1010 HydrophobicContact CZ-CB 3.74Å; F868-L1010 HydrophobicContact CZ-CD1 4.36Å; G1006-L1010 WeakPolarHBondContact O-CB 3.48Å; G1006-L1010 WeakPolarHBondContact O-CG 3.28Å; G1006-L1010 PolarHBondContact O-N 3.22Å; N1007-L1010 PolarHBondContact O-N 2.91Å; T1008-L1010 VanDerWaalsContact C-N 3.34Å; T1008-L1010 PolarHBondContact O-N 3.18Å; L1010-L1013 PolarHBondContact O-N 3.18Å; L1010-H1014 PolarHBondContact O-CD2 3.22Å; L1010-H1014 PolarHBondContact O-N 2.88Å; L1010-W1165 HydrophobicContact CD1-CB 4.28Å; L1010-W1165 HydrophobicContact CD1-CD2 4.44Å; L1010-W1165 HydrophobicContact CD1-CG 3.91Å; L1010-W1165 HydrophobicContact CD2-CD2 3.62Å; L1010-W1165 VanDerWaalsContact CD2-CE2 3.42Å; L1010-W1165 HydrophobicContact CD2-CE3 4.14Å; L1010-W1165 HydrophobicContact CD2-CG 3.97Å; L1010-W1165 HydrophobicContact CD2-CH2 4.29Å; L1010-W1165 HydrophobicContact CD2-CZ2 3.8Å; L1010-W1165 HydrophobicContact CD2-CZ3 4.45Å; L1010-W1165 HydrophobicContact CG-CB 4.36Å; L1010-W1165 HydrophobicContact CG-CD2 3.92Å; L1010-W1165 HydrophobicContact CG-CE3 4.41Å; L1010-W1165 HydrophobicContact CG-CG 3.86Å
1011	F	96.7	Very high	95.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.7	-47.5	176.8	-176.2	-90.7	0	0	0	110.8	L851 F855 F919 L922 I934 L938 N1007 T1008 L1013 H1014 L1015	L851-F1011 HydrophobicContact CD1-CD1 4.24Å; L851-F1011 HydrophobicContact CD1-CE1 3.63Å; L851-F1011 HydrophobicContact CD1-CE2 4.2Å; L851-F1011 HydrophobicContact CD1-CZ 3.62Å; L851-F1011 HydrophobicContact CD2-CD1 4.43Å; L851-F1011 HydrophobicContact CD2-CD2 3.62Å; L851-F1011 HydrophobicContact CD2-CE1 4.24Å; L851-F1011 HydrophobicContact CD2-CE2 3.42Å; L851-F1011 VanDerWaalsContact CD2-CE2 3.42Å; L851-F1011 HydrophobicContact CD2-CG 4.15Å; L851-F1011 HydrophobicContact CD2-CZ 3.75Å; L851-F1011 HydrophobicContact CG-CE2 4.4Å; L851-F1011 HydrophobicContact CG-CZ 4.28Å; F855-F1011 HydrophobicContact CD1-CD2 4.34Å; F855-F1011 HydrophobicContact CE1-CB 3.99Å; F855-F1011 AromaticContact CE1-CD2 3.83Å; F855-F1011 HydrophobicContact CE1-CD2 3.83Å; F855-F1011 HydrophobicContact CE1-CG 4.29Å; F855-F1011 HydrophobicContact CZ-CD2 4.13Å; F919-F1011 HydrophobicContact CD1-CE2 4.29Å; F919-F1011 AromaticContact CE1-CD2 3.44Å; F919-F1011 HydrophobicContact CE1-CD2 3.44Å; F919-F1011 VanDerWaalsContact CE1-CD2 3.44Å; F919-F1011 AromaticContact CE1-CE2 3.5Å; F919-F1011 HydrophobicContact CE1-CE2 3.5Å; F919-F1011 HydrophobicContact CE1-CG 4.09Å; F919-F1011 HydrophobicContact CE1-CZ 4.23Å; F919-F1011 AromaticContact CZ-CD2 3.82Å; F919-F1011 HydrophobicContact CZ-CD2 3.82Å; F919-F1011 HydrophobicContact CZ-CE2 4.19Å; L922-F1011 HydrophobicContact CD1-CE2 3.87Å; L922-F1011 HydrophobicContact CD1-CZ 3.92Å; I934-F1011 HydrophobicContact CG2-CE1 4Å; L938-F1011 HydrophobicContact CD1-CD1 3.59Å; L938-F1011 HydrophobicContact CD1-CE1 4.09Å; N1007-F1011 VanDerWaalsContact O-CB 3.26Å; N1007-F1011 WeakPolarHBondContact O-CB 3.43Å; N1007-F1011 PolarHBondContact O-N 3.13Å; T1008-F1011 PolarHBondContact O-N 3.26Å; F1011-L1013 VanDerWaalsContact C-N 3.33Å; F1011-L1013 PolarHBondContact O-N 3.06Å; F1011-H1014 PolarHBondContact O-N 3.19Å; F1011-L1015 HydrophobicContact CD1-CD2 4.4Å; F1011-L1015 HydrophobicContact CE1-CB 4.36Å; F1011-L1015 HydrophobicContact CE1-CD2 3.56Å; F1011-L1015 HydrophobicContact CZ-CD2 4.04Å; F1011-L1015 VanDerWaalsContact O-CB 3.26Å; F1011-L1015 WeakPolarHBondContact O-CB 3.44Å; F1011-L1015 PolarHBondContact O-N 3.36Å
1012	C	95.7	Very high	95.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.6	-45	177.8	-60.8	0	0	0	0	111.4	M935 T1008 I1009 E1016 F1098 L1101	M935-C1012 HydrophobicContact CE-CB 4.16Å; M935-C1012 HydrophobicContact SD-CB 3.63Å; T1008-C1012 PolarHBondContact O-N 3.08Å; T1008-C1012 PolarHBondContact O-SG 2.93Å; I1009-C1012 PolarHBondContact O-N 2.91Å; C1012-E1016 PolarHBondContact O-N 3.19Å; C1012-F1098 HydrophobicContact CB-CD2 4.2Å; C1012-L1101 HydrophobicContact CB-CD1 3.92Å; C1012-L1101 WeakPolarHBondContact SG-CD1 3.46Å
1013	L	95.4	Very high	95.5	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.016	8%	0.08	C	C	.	.	H	α-helix	trans	-61.3	-45.5	177.8	177.1	62.3	0	0	0	112.6	I1009 L1010 F1011 K1017 F1098 W1165 V1228 Y1232	I1009-L1013 PolarHBondContact O-N 3.49Å; L1010-L1013 PolarHBondContact O-N 3.18Å; F1011-L1013 VanDerWaalsContact C-N 3.33Å; F1011-L1013 PolarHBondContact O-N 3.06Å; L1013-K1017 VanDerWaalsContact O-CG 3.31Å; L1013-K1017 WeakPolarHBondContact O-CG 3.4Å; L1013-K1017 PolarHBondContact O-N 3.36Å; L1013-K1017 VanDerWaalsContact O-N 3.11Å; L1013-F1098 HydrophobicContact CB-CD2 4.01Å; L1013-F1098 HydrophobicContact CB-CE1 4.47Å; L1013-F1098 HydrophobicContact CB-CE2 3.82Å; L1013-F1098 HydrophobicContact CB-CG 4.43Å; L1013-F1098 HydrophobicContact CB-CZ 4.06Å; L1013-F1098 HydrophobicContact CD1-CD1 3.88Å; L1013-F1098 HydrophobicContact CD1-CE1 4Å; L1013-F1098 HydrophobicContact CD1-CG 4.19Å; L1013-F1098 HydrophobicContact CD1-CZ 4.43Å; L1013-F1098 HydrophobicContact CD2-CZ 4.5Å; L1013-W1165 HydrophobicContact CD2-CH2 3.78Å; L1013-W1165 HydrophobicContact CD2-CZ3 4.11Å; L1013-V1228 HydrophobicContact CD2-CG1 4.33Å; L1013-Y1232 HydrophobicContact CD1-CE2 4.01Å
1014	H	96.3	Very high	95.6	Very high	20 Å²	20	19.5 Å²	19.5	9%	0.093	10%	0.098	C	C	.	.	H	α-helix	trans	-74.7	-33.9	-178.2	-76.9	-64.3	0	0	0	112.7	Y861 F919 L1010 F1011 K1017 A1018	Y861-H1014 AromaticContact CE2-NE2 3.27Å; Y861-H1014 VanDerWaalsContact CE2-NE2 3.27Å; Y861-H1014 WeakPolarHBondContact CE2-NE2 3.36Å; Y861-H1014 AromaticContact CZ-NE2 3.33Å; Y861-H1014 VanDerWaalsContact CZ-NE2 3.33Å; Y861-H1014 PolarHBondContact OH-CE1 3.39Å; Y861-H1014 VanDerWaalsContact OH-CE1 3.31Å; Y861-H1014 PolarHBondContact OH-NE2 3.28Å; F919-H1014 HydrophobicContact CD1-CB 4Å; F919-H1014 HydrophobicContact CD2-CB 3.82Å; F919-H1014 HydrophobicContact CE1-CB 3.72Å; F919-H1014 HydrophobicContact CE2-CB 3.55Å; F919-H1014 HydrophobicContact CG-CB 4.05Å; F919-H1014 HydrophobicContact CZ-CB 3.51Å; L1010-H1014 PolarHBondContact O-CD2 3.22Å; L1010-H1014 PolarHBondContact O-N 2.88Å; F1011-H1014 PolarHBondContact O-N 3.19Å; H1014-K1017 PolarHBondContact O-N 2.9Å; H1014-A1018 PolarHBondContact O-N 3.17Å
1015	L	96.1	Very high	95.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-41.8	174.7	-177.1	54	0	0	0	111.5	F919 L922 A923 I931 M935 F1011 A1018 L1019	F919-L1015 HydrophobicContact CD1-CB 4.1Å; F919-L1015 HydrophobicContact CE1-CB 4.36Å; L922-L1015 HydrophobicContact CB-CD1 4.11Å; A923-L1015 HydrophobicContact CB-CD1 4.49Å; I931-L1015 HydrophobicContact CD1-CD1 4.42Å; I931-L1015 HydrophobicContact CG1-CD1 4.34Å; I931-L1015 HydrophobicContact CG1-CD2 4.28Å; I931-L1015 HydrophobicContact CG1-CG 4.43Å; I931-L1015 HydrophobicContact CG2-CD2 4.11Å; I931-L1015 HydrophobicContact CG2-CG 4.3Å; M935-L1015 HydrophobicContact CE-CB 3.99Å; M935-L1015 HydrophobicContact CE-CD2 3.93Å; M935-L1015 HydrophobicContact CE-CG 4.03Å; F1011-L1015 HydrophobicContact CD1-CD2 4.4Å; F1011-L1015 HydrophobicContact CE1-CB 4.36Å; F1011-L1015 HydrophobicContact CE1-CD2 3.56Å; F1011-L1015 HydrophobicContact CZ-CD2 4.04Å; F1011-L1015 VanDerWaalsContact O-CB 3.26Å; F1011-L1015 WeakPolarHBondContact O-CB 3.44Å; F1011-L1015 PolarHBondContact O-N 3.36Å; L1015-A1018 PolarHBondContact O-N 3.16Å; L1015-L1019 WeakPolarHBondContact O-CB 3.31Å; L1015-L1019 PolarHBondContact O-N 3.42Å
1016	E	94.4	Very high	95.3	Very high	16 Å²	16	25.8 Å²	25.8	8%	0.075	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-44.1	172	179.7	177.6	174.5	0	0	111.7	C1012 A1018 L1019 T1020 S1096 I1097 F1098	C1012-E1016 PolarHBondContact O-N 3.19Å; E1016-A1018 VanDerWaalsContact C-N 3.31Å; E1016-A1018 PolarHBondContact O-N 2.75Å; E1016-L1019 PolarHBondContact O-N 3.06Å; E1016-T1020 WeakPolarHBondContact O-CB 3.38Å; E1016-T1020 PolarHBondContact O-N 3.28Å; E1016-T1020 PolarHBondContact O-OG1 2.95Å; E1016-T1020 VanDerWaalsContact O-OG1 3.04Å; E1016-S1096 WeakPolarHBondContact OE1-CA 3.43Å; E1016-S1096 WeakPolarHBondContact OE1-CB 3.35Å; E1016-S1096 PolarHBondContact OE1-OG 2.94Å; E1016-I1097 PolarHBondContact OE1-N 3.31Å; E1016-I1097 VanDerWaalsContact OE1-N 3.11Å; E1016-I1097 PolarHBondContact OE2-N 2.89Å; E1016-F1098 WeakPolarHBondContact OE2-CA 3.27Å; E1016-F1098 WeakPolarHBondContact OE2-CB 3.29Å; E1016-F1098 PolarHBondContact OE2-N 3.15Å
1017	K	94.6	Very high	95.1	Very high	79 Å²	79	27.1 Å²	27.1	34%	0.343	14%	0.139	S	C	.	.	H	α-helix	trans	-58	-43.9	176.3	-76.2	173.2	-179.6	175.1	0	112.3	L1013 H1014 T1020 H1021	L1013-K1017 VanDerWaalsContact O-CG 3.31Å; L1013-K1017 WeakPolarHBondContact O-CG 3.4Å; L1013-K1017 PolarHBondContact O-N 3.36Å; L1013-K1017 VanDerWaalsContact O-N 3.11Å; H1014-K1017 PolarHBondContact O-N 2.9Å; K1017-T1020 PolarHBondContact O-N 3.11Å; K1017-H1021 PolarHBondContact O-CD2 3.33Å; K1017-H1021 VanDerWaalsContact O-CG 3.29Å; K1017-H1021 PolarHBondContact O-N 3.36Å
1018	A	96.3	Very high	94.9	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.033	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-43.8	177.1	0	0	0	0	0	111.3	F919 A923 H1014 L1015 E1016 T1020 H1021 E1022	F919-A1018 HydrophobicContact CB-CB 3.73Å; F919-A1018 WeakPolarHBondContact O-CB 3.2Å; A923-A1018 HydrophobicContact CB-CB 4.39Å; H1014-A1018 PolarHBondContact O-N 3.17Å; L1015-A1018 PolarHBondContact O-N 3.16Å; E1016-A1018 VanDerWaalsContact C-N 3.31Å; E1016-A1018 PolarHBondContact O-N 2.75Å; A1018-T1020 PolarHBondContact O-N 2.82Å; A1018-H1021 WeakPolarHBondContact O-CB 3.27Å; A1018-H1021 PolarHBondContact O-N 3.44Å; A1018-E1022 WeakPolarHBondContact O-CG 3.5Å; A1018-E1022 PolarHBondContact O-N 3Å
1019	L	95.6	Very high	94.7	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-48.1	175.2	-178.4	60.6	0	0	0	111.7	Y928 I931 L1015 E1016 H1021 E1022 E1023 L1091 I1097	Y928-L1019 HydrophobicContact CD1-CD1 4.36Å; Y928-L1019 HydrophobicContact CD1-CD2 4.15Å; Y928-L1019 HydrophobicContact CE1-CD1 3.91Å; Y928-L1019 HydrophobicContact CE1-CD2 4.02Å; Y928-L1019 HydrophobicContact CE1-CG 4.34Å; I931-L1019 HydrophobicContact CD1-CB 4.48Å; I931-L1019 HydrophobicContact CD1-CD1 4Å; I931-L1019 HydrophobicContact CD1-CD2 3.99Å; I931-L1019 HydrophobicContact CD1-CG 4.4Å; L1015-L1019 WeakPolarHBondContact O-CB 3.31Å; L1015-L1019 PolarHBondContact O-N 3.42Å; E1016-L1019 PolarHBondContact O-N 3.06Å; L1019-H1021 VanDerWaalsContact C-N 3.26Å; L1019-H1021 PolarHBondContact O-N 3.34Å; L1019-E1022 PolarHBondContact O-N 3.4Å; L1019-E1022 VanDerWaalsContact O-N 3.12Å; L1019-E1023 HydrophobicContact CD1-CG 4.31Å; L1019-E1023 HydrophobicContact CG-CG 4.41Å; L1019-E1023 WeakPolarHBondContact O-CG 3.48Å; L1019-E1023 PolarHBondContact O-N 3.49Å; L1019-L1091 HydrophobicContact CD2-CD1 3.81Å; L1019-I1097 HydrophobicContact CD2-CD1 4.3Å
1020	T	95.1	Very high	94.5	Very high	44 Å²	44	38.8 Å²	38.8	27%	0.27	20%	0.202	S	C	.	.	H	α-helix	trans	-56.6	-40.6	176.1	-63.3	0	0	0	0	111.7	E1016 K1017 A1018 V1024 C1092	E1016-T1020 WeakPolarHBondContact O-CB 3.38Å; E1016-T1020 PolarHBondContact O-N 3.28Å; E1016-T1020 PolarHBondContact O-OG1 2.95Å; E1016-T1020 VanDerWaalsContact O-OG1 3.04Å; K1017-T1020 PolarHBondContact O-N 3.11Å; A1018-T1020 PolarHBondContact O-N 2.82Å; T1020-V1024 WeakPolarHBondContact O-CB 3.35Å; T1020-V1024 VanDerWaalsContact O-CG2 3.22Å; T1020-V1024 WeakPolarHBondContact O-CG2 3.31Å; T1020-V1024 PolarHBondContact O-N 3.03Å; T1020-C1092 HydrophobicContact CG2-CB 3.8Å
1021	H	94.5	Very high	94.2	Very high	105 Å²	105	40.8 Å²	40.8	49%	0.486	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-44.4	176.3	-70.7	179.7	0	0	0	112.3	H920 K1017 A1018 L1019 V1024 L1025	H920-H1021 AromaticContact CE1-ND1 3.68Å; H920-H1021 AromaticContact NE2-ND1 3.91Å; K1017-H1021 PolarHBondContact O-CD2 3.33Å; K1017-H1021 VanDerWaalsContact O-CG 3.29Å; K1017-H1021 PolarHBondContact O-N 3.36Å; A1018-H1021 WeakPolarHBondContact O-CB 3.27Å; A1018-H1021 PolarHBondContact O-N 3.44Å; L1019-H1021 VanDerWaalsContact C-N 3.26Å; L1019-H1021 PolarHBondContact O-N 3.34Å; H1021-V1024 PolarHBondContact O-N 3.28Å; H1021-L1025 WeakPolarHBondContact O-CG 3.38Å; H1021-L1025 PolarHBondContact O-N 3.48Å; H1021-L1025 VanDerWaalsContact O-N 3.17Å
1022	E	94.3	Very high	93.7	Very high	27 Å²	27	43.1 Å²	43.1	13%	0.126	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-44.4	176.8	-62.2	-59.4	132.3	0	0	111.2	H920 A923 R924 A1018 L1019 V1024 L1025 D1026	H920-E1022 IonicContact CE1-OE1 2.64Å; H920-E1022 IonicContact CG-OE1 3.03Å; H920-E1022 IonicContact ND1-OE1 2.97Å; H920-E1022 PolarHBondContact ND1-OE1 3.25Å; A923-E1022 HydrophobicContact CB-CG 4.3Å; R924-E1022 HydrophobicContact CG-CG 4.45Å; R924-E1022 IonicContact CZ-OE1 2.82Å; R924-E1022 IonicContact CZ-OE2 3.5Å; R924-E1022 IonicContact NE-OE1 3.54Å; R924-E1022 IonicContact NE-OE2 2.84Å; R924-E1022 PolarHBondContact NE-OE2 3.44Å; R924-E1022 IonicContact NH2-OE1 3.63Å; R924-E1022 PolarHBondContact NH2-OE1 2.7Å; R924-E1022 IonicContact NH2-OE2 3.4Å; R924-E1022 PolarHBondContact NH2-OE2 3.03Å; A1018-E1022 WeakPolarHBondContact O-CG 3.5Å; A1018-E1022 PolarHBondContact O-N 3Å; L1019-E1022 PolarHBondContact O-N 3.4Å; L1019-E1022 VanDerWaalsContact O-N 3.12Å; E1022-V1024 PolarHBondContact O-N 3.37Å; E1022-L1025 WeakPolarHBondContact O-CB 3.29Å; E1022-L1025 PolarHBondContact O-N 3.28Å; E1022-D1026 PolarHBondContact O-N 3.38Å
1023	E	94.4	Very high	93.5	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-40.5	177.6	-72.6	179.2	148.5	0	0	112.8	Y928 L1019 L1025 D1026 L1027 R1090 L1091 C1092	Y928-E1023 VanDerWaalsContact CE1-OE1 3.29Å; Y928-E1023 WeakPolarHBondContact CE1-OE1 3.44Å; Y928-E1023 WeakPolarHBondContact OH-CG 3.19Å; Y928-E1023 PolarHBondContact OH-OE1 3.38Å; L1019-E1023 HydrophobicContact CD1-CG 4.31Å; L1019-E1023 HydrophobicContact CG-CG 4.41Å; L1019-E1023 WeakPolarHBondContact O-CG 3.48Å; L1019-E1023 PolarHBondContact O-N 3.49Å; E1023-L1025 VanDerWaalsContact C-N 3.32Å; E1023-L1025 PolarHBondContact O-N 3.4Å; E1023-D1026 WeakPolarHBondContact O-CB 3.5Å; E1023-D1026 PolarHBondContact O-N 2.96Å; E1023-L1027 WeakPolarHBondContact O-CG 3.33Å; E1023-L1027 PolarHBondContact O-N 3.34Å; E1023-R1090 HydrophobicContact CB-CB 4.05Å; E1023-R1090 HydrophobicContact CB-CG 4.36Å; E1023-R1090 HydrophobicContact CG-CB 4.08Å; E1023-R1090 HydrophobicContact CG-CG 4.48Å; E1023-L1091 VanDerWaalsContact OE1-CB 3.31Å; E1023-L1091 WeakPolarHBondContact OE1-CB 3.41Å; E1023-L1091 WeakPolarHBondContact OE1-CG 3.44Å; E1023-L1091 PolarHBondContact OE1-N 3.3Å; E1023-L1091 PolarHBondContact OE2-N 3.29Å; E1023-C1092 HydrophobicContact CB-CB 4.29Å; E1023-C1092 VanDerWaalsContact OE2-CB 3.29Å; E1023-C1092 WeakPolarHBondContact OE2-CB 3.18Å; E1023-C1092 PolarHBondContact OE2-N 3.03Å
1024	V	94.1	Very high	93.2	Very high	67 Å²	67	48.8 Å²	48.8	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-39.3	176.9	167.8	0	0	0	0	110.8	T1020 H1021 E1022 L1027 V1028 C1092	T1020-V1024 WeakPolarHBondContact O-CB 3.35Å; T1020-V1024 VanDerWaalsContact O-CG2 3.22Å; T1020-V1024 WeakPolarHBondContact O-CG2 3.31Å; T1020-V1024 PolarHBondContact O-N 3.03Å; H1021-V1024 PolarHBondContact O-N 3.28Å; E1022-V1024 PolarHBondContact O-N 3.37Å; V1024-L1027 PolarHBondContact O-N 2.96Å; V1024-V1028 HydrophobicContact CG1-CG2 4.41Å; V1024-V1028 VanDerWaalsContact O-CG2 3.26Å; V1024-V1028 WeakPolarHBondContact O-CG2 3.47Å; V1024-V1028 PolarHBondContact O-N 3.01Å; V1024-C1092 HydrophobicContact CG2-CB 4.23Å
1025	L	93.4	Very high	92.7	Very high	94 Å²	94	49.3 Å²	49.3	49%	0.492	26%	0.263	S	S	.	.	H	α-helix	trans	-64.4	-43.4	176	-69.5	171.3	0	0	0	111.3	H1021 E1022 E1023 L1027 V1028 Q1029	H1021-L1025 WeakPolarHBondContact O-CG 3.38Å; H1021-L1025 PolarHBondContact O-N 3.48Å; H1021-L1025 VanDerWaalsContact O-N 3.17Å; E1022-L1025 WeakPolarHBondContact O-CB 3.29Å; E1022-L1025 PolarHBondContact O-N 3.28Å; E1023-L1025 VanDerWaalsContact C-N 3.32Å; E1023-L1025 PolarHBondContact O-N 3.4Å; L1025-L1027 VanDerWaalsContact C-N 3.33Å; L1025-L1027 PolarHBondContact O-N 3.37Å; L1025-V1028 PolarHBondContact O-N 3.47Å; L1025-Q1029 WeakPolarHBondContact O-CG 3.15Å; L1025-Q1029 PolarHBondContact O-N 3Å
1026	D	92.4	Very high	92.2	Very high	68 Å²	68	53.7 Å²	53.7	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-43.7	174.6	-75.4	-5.4	0	0	0	111.8	E1022 E1023 Q1029 S1030 R1090	E1022-D1026 PolarHBondContact O-N 3.38Å; E1023-D1026 WeakPolarHBondContact O-CB 3.5Å; E1023-D1026 PolarHBondContact O-N 2.96Å; D1026-Q1029 PolarHBondContact O-N 3.39Å; D1026-S1030 WeakPolarHBondContact O-CB 3.45Å; D1026-S1030 PolarHBondContact O-N 2.68Å; D1026-S1030 PolarHBondContact O-OG 2.84Å; D1026-R1090 IonicContact OD2-CZ 3.14Å; D1026-R1090 IonicContact OD2-NH2 2.83Å; D1026-R1090 PolarHBondContact OD2-NH2 2.79Å
1027	L	92.6	Very high	91.8	Very high	28 Å²	28	55 Å²	55	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-42.5	177.7	-74.6	174.4	0	0	0	111.8	E1023 V1024 L1025 Q1029 S1030 N1031 T1087 R1090 C1092	E1023-L1027 WeakPolarHBondContact O-CG 3.33Å; E1023-L1027 PolarHBondContact O-N 3.34Å; V1024-L1027 PolarHBondContact O-N 2.96Å; L1025-L1027 VanDerWaalsContact C-N 3.33Å; L1025-L1027 PolarHBondContact O-N 3.37Å; L1027-Q1029 VanDerWaalsContact C-N 3.31Å; L1027-Q1029 PolarHBondContact O-N 2.71Å; L1027-S1030 VanDerWaalsContact CA-OG 3.31Å; L1027-S1030 WeakPolarHBondContact CA-OG 3.42Å; L1027-S1030 PolarHBondContact O-N 3.04Å; L1027-S1030 PolarHBondContact O-OG 3.2Å; L1027-N1031 WeakPolarHBondContact O-CB 3.41Å; L1027-N1031 PolarHBondContact O-N 2.88Å; L1027-N1031 PolarHBondContact O-ND2 3.02Å; L1027-N1031 PolarHBondContact O-OD1 3.3Å; L1027-T1087 VanDerWaalsContact CD2-O 3.27Å; L1027-T1087 WeakPolarHBondContact CD2-O 3.39Å; L1027-R1090 HydrophobicContact CD1-CB 4.27Å; L1027-R1090 HydrophobicContact CD1-CG 4.08Å; L1027-R1090 HydrophobicContact CD2-CG 3.95Å; L1027-R1090 HydrophobicContact CG-CG 3.91Å; L1027-C1092 VanDerWaalsContact CD1-SG 3.58Å
1028	V	92.6	Very high	91.5	Very high	94 Å²	94	56.5 Å²	56.5	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-41.4	177.9	169.5	0	0	0	0	111.1	V1024 L1025	V1024-V1028 HydrophobicContact CG1-CG2 4.41Å; V1024-V1028 VanDerWaalsContact O-CG2 3.26Å; V1024-V1028 WeakPolarHBondContact O-CG2 3.47Å; V1024-V1028 PolarHBondContact O-N 3.01Å; L1025-V1028 PolarHBondContact O-N 3.47Å
1029	Q	91.1	Very high	91	Very high	139 Å²	139	66.8 Å²	66.8	65%	0.65	35%	0.349	S	S	*	.	H	α-helix	trans	-71.3	-34.9	177.8	-68.7	-178.1	6	0	0	112.8	L1025 D1026 L1027	L1025-Q1029 WeakPolarHBondContact O-CG 3.15Å; L1025-Q1029 PolarHBondContact O-N 3Å; D1026-Q1029 PolarHBondContact O-N 3.39Å; L1027-Q1029 VanDerWaalsContact C-N 3.31Å; L1027-Q1029 PolarHBondContact O-N 2.71Å
1030	S	91.8	Very high	90.4	Very high	14 Å²	14	67.5 Å²	67.5	10%	0.098	35%	0.354	C	S	.	.	H	α-helix	trans	-83	-22.5	-177.7	54.1	0	0	0	0	114.4	D1026 L1027 V1032 F1033 I1034 T1087	D1026-S1030 WeakPolarHBondContact O-CB 3.45Å; D1026-S1030 PolarHBondContact O-N 2.68Å; D1026-S1030 PolarHBondContact O-OG 2.84Å; L1027-S1030 VanDerWaalsContact CA-OG 3.31Å; L1027-S1030 WeakPolarHBondContact CA-OG 3.42Å; L1027-S1030 PolarHBondContact O-N 3.04Å; L1027-S1030 PolarHBondContact O-OG 3.2Å; S1030-V1032 VanDerWaalsContact C-N 3.27Å; S1030-V1032 PolarHBondContact O-N 3.37Å; S1030-F1033 PolarHBondContact O-N 3.03Å; S1030-I1034 PolarHBondContact O-N 3.49Å; S1030-T1087 WeakPolarHBondContact OG-CG2 3.41Å
1031	N	89.9	Confident	90	Very high	42 Å²	42	73.2 Å²	73.2	23%	0.225	38%	0.376	C	S	.	.	H	α-helix	trans	-46.1	-42.8	-175.4	-88.5	-23.6	0	0	0	114.7	L1027 F1033 G1035 N1036	L1027-N1031 WeakPolarHBondContact O-CB 3.41Å; L1027-N1031 PolarHBondContact O-N 2.88Å; L1027-N1031 PolarHBondContact O-ND2 3.02Å; L1027-N1031 PolarHBondContact O-OD1 3.3Å; N1031-F1033 VanDerWaalsContact C-N 3.29Å; N1031-F1033 PolarHBondContact O-N 3.12Å; N1031-G1035 PolarHBondContact O-N 3.46Å; N1031-G1035 VanDerWaalsContact O-N 3.15Å; N1031-N1036 CarbonylContact C-O 3.54Å; N1031-N1036 HydrophobicContact CB-CB 4.27Å; N1031-N1036 WeakPolarHBondContact CB-O 3.39Å; N1031-N1036 PolarHBondContact O-N 2.95Å; N1031-N1036 WeakPolarHBondContact OD1-CB 3.42Å; N1031-N1036 PolarHBondContact OD1-ND2 3.2Å
1032	V	86.7	Confident	89.4	Confident	49 Å²	49	69.9 Å²	69.9	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-30.3	-179.9	72.8	0	0	0	0	113	S1030 L1062	S1030-V1032 VanDerWaalsContact C-N 3.27Å; S1030-V1032 PolarHBondContact O-N 3.37Å; V1032-L1062 HydrophobicContact CG2-CD1 3.75Å
1033	F	91.6	Very high	88.8	Confident	98 Å²	98	75.2 Å²	75.2	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-89.7	-20.3	-176	-55.8	-69.6	0	0	0	113.2	S1030 N1031 Q1063 V1064	S1030-F1033 PolarHBondContact O-N 3.03Å; N1031-F1033 VanDerWaalsContact C-N 3.29Å; N1031-F1033 PolarHBondContact O-N 3.12Å; F1033-Q1063 VanDerWaalsContact O-CA 3.28Å; F1033-Q1063 WeakPolarHBondContact O-CA 3.42Å; F1033-V1064 HydrophobicContact CB-CG2 4.04Å; F1033-V1064 HydrophobicContact CD1-CG2 4.37Å; F1033-V1064 PolarHBondContact O-N 2.9Å
1034	I	90.1	Very high	88.1	Confident	24 Å²	24	80.3 Å²	80.3	12%	0.123	43%	0.429	C	S	.	.	H	α-helix	trans	-97.7	-1.5	173.8	65.7	179	0	0	0	112.6	S1030 N1036 Q1063 E1084	S1030-I1034 PolarHBondContact O-N 3.49Å; I1034-N1036 HydrophobicContact CD1-CB 4.32Å; I1034-N1036 HydrophobicContact CG1-CB 4.09Å; I1034-Q1063 PolarHBondContact O-NE2 3.08Å; I1034-Q1063 VanDerWaalsContact O-NE2 3.13Å; I1034-E1084 HydrophobicContact CB-CG 4.38Å; I1034-E1084 HydrophobicContact CG2-CG 3.94Å
1035	G	84.9	Confident	87.6	Confident	31 Å²	31	84.8 Å²	84.8	32%	0.32	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	15.9	177.2	0	0	0	0	0	114.6	N1031 L1037	N1031-G1035 PolarHBondContact O-N 3.46Å; N1031-G1035 VanDerWaalsContact O-N 3.15Å; G1035-L1037 PolarHBondContact O-N 3.18Å
1036	N	86.7	Confident	87	Confident	91 Å²	91	84 Å²	84	49%	0.487	45%	0.445	S	S	.	.			trans	-88.2	102.1	175.6	-171.3	18.6	0	0	0	110.2	N1031 I1034	N1031-N1036 CarbonylContact C-O 3.54Å; N1031-N1036 HydrophobicContact CB-CB 4.27Å; N1031-N1036 WeakPolarHBondContact CB-O 3.39Å; N1031-N1036 PolarHBondContact O-N 2.95Å; N1031-N1036 WeakPolarHBondContact OD1-CB 3.42Å; N1031-N1036 PolarHBondContact OD1-ND2 3.2Å; I1034-N1036 HydrophobicContact CD1-CB 4.32Å; I1034-N1036 HydrophobicContact CG1-CB 4.09Å
1037	L	85.9	Confident	86.5	Confident	44 Å²	44	84.5 Å²	84.5	23%	0.23	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-100.8	142.7	-174.7	-65.9	171.6	0	0	0	112.1	G1035 L1055 E1056 Y1059	G1035-L1037 PolarHBondContact O-N 3.18Å; L1037-L1055 HydrophobicContact CD1-CB 3.95Å; L1037-E1056 HydrophobicContact CD1-CB 4.49Å; L1037-E1056 HydrophobicContact CD1-CG 3.99Å; L1037-Y1059 HydrophobicContact CD1-CD2 4.23Å; L1037-Y1059 HydrophobicContact CD2-CD2 3.84Å; L1037-Y1059 HydrophobicContact CD2-CE2 4.49Å; L1037-Y1059 HydrophobicContact CD2-CG 4.4Å
1038	P	87.7	Confident	86	Confident	110 Å²	110	85.8 Å²	85.8	71%	0.714	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-66.3	151.1	174.9	29.2	-34.7	0	0	0	110.8	P1040	P1038-P1040 WeakPolarHBondContact O-CD 3.4Å
1039	R	85.5	Confident	85.7	Confident	221 Å²	221	87.5 Å²	87.5	83%	0.834	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-63.4	119.2	179.5	-147.8	176.1	-167.7	-170.4	3.2	109.8
1040	P	83.2	Confident	85.4	Confident	25 Å²	25	85.2 Å²	85.2	16%	0.162	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-76.2	145.4	-174.7	30.2	-35	0	0	0	111.5	P1038 C1042 K1051 I1052 L1055	P1038-P1040 WeakPolarHBondContact O-CD 3.4Å; P1040-C1042 PolarHBondContact O-N 3.17Å; P1040-C1042 PolarHBondContact O-SG 2.85Å; P1040-K1051 HydrophobicContact CB-CD 4.18Å; P1040-K1051 HydrophobicContact CB-CG 4.25Å; P1040-K1051 HydrophobicContact CG-CB 4.22Å; P1040-K1051 HydrophobicContact CG-CD 4.32Å; P1040-K1051 HydrophobicContact CG-CG 4.11Å; P1040-I1052 VanDerWaalsContact CD-CG1 3.46Å; P1040-I1052 HydrophobicContact CG-CG1 3.73Å; P1040-L1055 HydrophobicContact CB-CD1 3.53Å; P1040-L1055 HydrophobicContact CG-CD1 3.78Å
1041	F	86.1	Confident	85.2	Confident	164 Å²	164	87.4 Å²	87.4	72%	0.719	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-60.2	125.4	168.2	174.9	-101.2	0	0	0	109.8	K1043 K1051	F1041-K1043 HydrophobicContact CE1-CG 3.99Å; F1041-K1051 WeakPolarHBondContact O-CE 3.42Å; F1041-K1051 PolarHBondContact O-NZ 3.37Å
1042	C	82.4	Confident	85	Confident	36 Å²	36	87.9 Å²	87.9	24%	0.243	46%	0.46	C	S	.	.			trans	-114.8	127	178.8	-62	0	0	0	0	109.3	P1040 E1046 P1048	P1040-C1042 PolarHBondContact O-N 3.17Å; P1040-C1042 PolarHBondContact O-SG 2.85Å; C1042-E1046 HydrophobicContact CB-CB 4.37Å; C1042-P1048 WeakPolarHBondContact SG-CA 2.91Å
1043	K	82.6	Confident	85.1	Confident	138 Å²	138	91.8 Å²	91.8	60%	0.6	47%	0.473	S	S	*	.			trans	-66.8	159.8	170.3	-65.9	-179.2	179.4	-179.9	0	109.1	F1041 N1045 E1046	F1041-K1043 HydrophobicContact CE1-CG 3.99Å; K1043-N1045 PolarHBondContact O-N 3.26Å; K1043-E1046 HydrophobicContact CB-CG 4.26Å; K1043-E1046 PolarHBondContact N-OE2 3.08Å; K1043-E1046 PolarHBondContact O-N 3.14Å
1044	A	79.9	Confident	84.9	Confident	109 Å²	109	95.5 Å²	95.5	90%	0.901	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-25.7	-176.5	0	0	0	0	0	114.7
1045	N	81.8	Confident	84.7	Confident	161 Å²	161	96.5 Å²	96.5	86%	0.861	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	4.4	-177.3	-53.6	-0.6	0	0	0	113.3	K1043	K1043-N1045 PolarHBondContact O-N 3.26Å
1046	E	81.5	Confident	84.9	Confident	78 Å²	78	99.6 Å²	99.6	36%	0.364	50%	0.496	S	S	.	.	S	Bend	trans	-106.7	128.3	-177.1	-68.7	-179.6	155	0	0	111	C1042 K1043 P1048 K1051	C1042-E1046 HydrophobicContact CB-CB 4.37Å; K1043-E1046 HydrophobicContact CB-CG 4.26Å; K1043-E1046 PolarHBondContact N-OE2 3.08Å; K1043-E1046 PolarHBondContact O-N 3.14Å; E1046-P1048 WeakPolarHBondContact O-CD 3.48Å; E1046-K1051 IonicContact OE1-NZ 2.75Å; E1046-K1051 IonicContact OE2-NZ 2.93Å; E1046-K1051 PolarHBondContact OE2-NZ 3.35Å
1047	N	82.7	Confident	84.9	Confident	78 Å²	78	102.4 Å²	102.4	42%	0.417	51%	0.506	S	S	.	.			trans	-74.1	121.8	172	-176.2	-27.5	0	0	0	109.9	E1049 I1050 K1051	N1047-E1049 VanDerWaalsContact C-N 3.29Å; N1047-E1049 PolarHBondContact O-N 3.03Å; N1047-E1049 WeakPolarHBondContact OD1-CB 3.46Å; N1047-E1049 PolarHBondContact OD1-N 3.05Å; N1047-I1050 HydrophobicContact CB-CB 4.37Å; N1047-I1050 HydrophobicContact CB-CD1 3.91Å; N1047-I1050 HydrophobicContact CB-CG1 4Å; N1047-I1050 PolarHBondContact O-N 2.94Å; N1047-K1051 PolarHBondContact O-N 3.11Å
1048	P	82.3	Confident	85.1	Confident	55 Å²	55	107.2 Å²	107.2	36%	0.357	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-34.4	-179	23.7	-33.7	0	0	0	113.8	C1042 E1046 K1051 I1052	C1042-P1048 WeakPolarHBondContact SG-CA 2.91Å; E1046-P1048 WeakPolarHBondContact O-CD 3.48Å; P1048-K1051 PolarHBondContact O-N 3.36Å; P1048-I1052 WeakPolarHBondContact O-CG1 3.47Å; P1048-I1052 PolarHBondContact O-N 2.8Å
1049	E	84.9	Confident	85.2	Confident	131 Å²	131	105.9 Å²	105.9	61%	0.612	51%	0.507	S	S	*	.	H	α-helix	trans	-67.5	-40.9	-179.7	-63.9	-177.9	173	0	0	111.9	N1047 K1051 I1052 K1053	N1047-E1049 VanDerWaalsContact C-N 3.29Å; N1047-E1049 PolarHBondContact O-N 3.03Å; N1047-E1049 WeakPolarHBondContact OD1-CB 3.46Å; N1047-E1049 PolarHBondContact OD1-N 3.05Å; E1049-K1051 VanDerWaalsContact C-N 3.27Å; E1049-K1051 PolarHBondContact O-N 3.02Å; E1049-I1052 PolarHBondContact O-N 3.5Å; E1049-K1053 WeakPolarHBondContact O-CG 3.3Å; E1049-K1053 PolarHBondContact O-N 3.46Å
1050	I	85.6	Confident	85.2	Confident	91 Å²	91	95.9 Å²	95.9	47%	0.467	47%	0.471	S	S	.	.	H	α-helix	trans	-64.4	-39.6	176.7	-60.1	180	0	0	0	109.5	N1047 K1053 R1054	N1047-I1050 HydrophobicContact CB-CB 4.37Å; N1047-I1050 HydrophobicContact CB-CD1 3.91Å; N1047-I1050 HydrophobicContact CB-CG1 4Å; N1047-I1050 PolarHBondContact O-N 2.94Å; I1050-K1053 PolarHBondContact O-N 3.26Å; I1050-R1054 WeakPolarHBondContact O-CG 3.39Å; I1050-R1054 PolarHBondContact O-N 2.91Å
1051	K	86.6	Confident	85.5	Confident	59 Å²	59	100.4 Å²	100.4	26%	0.257	49%	0.494	S	S	.	.	H	α-helix	trans	-68.5	-41	179.6	-159.7	167.9	-168.6	168.3	0	112.1	P1040 F1041 E1046 N1047 P1048 E1049 R1054 L1055	P1040-K1051 HydrophobicContact CB-CD 4.18Å; P1040-K1051 HydrophobicContact CB-CG 4.25Å; P1040-K1051 HydrophobicContact CG-CB 4.22Å; P1040-K1051 HydrophobicContact CG-CD 4.32Å; P1040-K1051 HydrophobicContact CG-CG 4.11Å; F1041-K1051 WeakPolarHBondContact O-CE 3.42Å; F1041-K1051 PolarHBondContact O-NZ 3.37Å; E1046-K1051 IonicContact OE1-NZ 2.75Å; E1046-K1051 IonicContact OE2-NZ 2.93Å; E1046-K1051 PolarHBondContact OE2-NZ 3.35Å; N1047-K1051 PolarHBondContact O-N 3.11Å; P1048-K1051 PolarHBondContact O-N 3.36Å; E1049-K1051 VanDerWaalsContact C-N 3.27Å; E1049-K1051 PolarHBondContact O-N 3.02Å; K1051-R1054 PolarHBondContact O-N 2.99Å; K1051-L1055 WeakPolarHBondContact O-CG 3.49Å; K1051-L1055 PolarHBondContact O-N 2.97Å
1052	I	86.7	Confident	85.6	Confident	52 Å²	52	96.3 Å²	96.3	27%	0.267	48%	0.479	S	S	.	.	H	α-helix	trans	-61.1	-50.1	173.2	-72	169	0	0	0	110.2	P1040 P1048 E1049 R1054 L1055 E1056	P1040-I1052 VanDerWaalsContact CD-CG1 3.46Å; P1040-I1052 HydrophobicContact CG-CG1 3.73Å; P1048-I1052 WeakPolarHBondContact O-CG1 3.47Å; P1048-I1052 PolarHBondContact O-N 2.8Å; E1049-I1052 PolarHBondContact O-N 3.5Å; I1052-R1054 VanDerWaalsContact C-N 3.28Å; I1052-R1054 PolarHBondContact O-N 3.18Å; I1052-L1055 CarbonylContact O-C 3.59Å; I1052-L1055 WeakPolarHBondContact O-CA 3.49Å; I1052-L1055 WeakPolarHBondContact O-CB 3.35Å; I1052-L1055 PolarHBondContact O-N 3.02Å; I1052-E1056 HydrophobicContact CG2-CG 4.24Å; I1052-E1056 WeakPolarHBondContact O-CG 3.39Å; I1052-E1056 PolarHBondContact O-N 3.31Å
1053	K	87.2	Confident	86	Confident	131 Å²	131	96.9 Å²	96.9	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-58.3	-38.3	177.7	-76	-178.1	178.7	177.4	0	113	E1049 I1050 L1055 E1056 Q1057	E1049-K1053 WeakPolarHBondContact O-CG 3.3Å; E1049-K1053 PolarHBondContact O-N 3.46Å; I1050-K1053 PolarHBondContact O-N 3.26Å; K1053-L1055 VanDerWaalsContact C-N 3.35Å; K1053-E1056 PolarHBondContact O-N 3.04Å; K1053-Q1057 WeakPolarHBondContact O-CB 3.06Å; K1053-Q1057 WeakPolarHBondContact O-CG 3.29Å; K1053-Q1057 PolarHBondContact O-N 3.33Å
1054	R	87.8	Confident	86.4	Confident	176 Å²	176	93.5 Å²	93.5	66%	0.664	47%	0.469	S	S	*	.	H	α-helix	trans	-64	-39.4	173.7	-77	180	-178.3	178.5	1.5	112.1	I1050 K1051 I1052 K1058	I1050-R1054 WeakPolarHBondContact O-CG 3.39Å; I1050-R1054 PolarHBondContact O-N 2.91Å; K1051-R1054 PolarHBondContact O-N 2.99Å; I1052-R1054 VanDerWaalsContact C-N 3.28Å; I1052-R1054 PolarHBondContact O-N 3.18Å; R1054-K1058 WeakPolarHBondContact O-CB 3.33Å; R1054-K1058 PolarHBondContact O-N 3.19Å
1055	L	87.4	Confident	86.8	Confident	45 Å²	45	89.2 Å²	89.2	24%	0.236	43%	0.432	C	S	.	.	H	α-helix	trans	-70.3	-41.3	176.5	-74.2	160.1	0	0	0	111.8	L1037 P1040 K1051 I1052 K1053 Q1057 K1058 Y1059	L1037-L1055 HydrophobicContact CD1-CB 3.95Å; P1040-L1055 HydrophobicContact CB-CD1 3.53Å; P1040-L1055 HydrophobicContact CG-CD1 3.78Å; K1051-L1055 WeakPolarHBondContact O-CG 3.49Å; K1051-L1055 PolarHBondContact O-N 2.97Å; I1052-L1055 CarbonylContact O-C 3.59Å; I1052-L1055 WeakPolarHBondContact O-CA 3.49Å; I1052-L1055 WeakPolarHBondContact O-CB 3.35Å; I1052-L1055 PolarHBondContact O-N 3.02Å; K1053-L1055 VanDerWaalsContact C-N 3.35Å; L1055-Q1057 VanDerWaalsContact C-N 3.31Å; L1055-Q1057 PolarHBondContact O-N 3.26Å; L1055-K1058 WeakPolarHBondContact O-CB 3.4Å; L1055-K1058 PolarHBondContact O-N 3.42Å; L1055-K1058 VanDerWaalsContact O-N 3.14Å; L1055-Y1059 HydrophobicContact CD2-CD2 4.48Å; L1055-Y1059 HydrophobicContact CD2-CE2 3.82Å; L1055-Y1059 VanDerWaalsContact O-CD2 3.23Å; L1055-Y1059 WeakPolarHBondContact O-CD2 3.31Å; L1055-Y1059 PolarHBondContact O-N 3.02Å
1056	E	87.7	Confident	87.1	Confident	96 Å²	96	87 Å²	87	45%	0.449	41%	0.412	S	S	.	.	H	α-helix	trans	-57.8	-44.5	172.8	-71.9	173.2	172.8	0	0	111.1	L1037 I1052 K1053 Y1059 A1060	L1037-E1056 HydrophobicContact CD1-CB 4.49Å; L1037-E1056 HydrophobicContact CD1-CG 3.99Å; I1052-E1056 HydrophobicContact CG2-CG 4.24Å; I1052-E1056 WeakPolarHBondContact O-CG 3.39Å; I1052-E1056 PolarHBondContact O-N 3.31Å; K1053-E1056 PolarHBondContact O-N 3.04Å; E1056-Y1059 PolarHBondContact O-N 3.37Å; E1056-A1060 WeakPolarHBondContact O-CA 3.25Å; E1056-A1060 WeakPolarHBondContact O-CB 3.36Å; E1056-A1060 PolarHBondContact O-N 3.23Å
1057	Q	87.6	Confident	87.5	Confident	150 Å²	150	85.4 Å²	85.4	70%	0.701	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-42.3	174.2	-75.6	178.1	-5.3	0	0	112.2	K1053 L1055 Y1059 A1060	K1053-Q1057 WeakPolarHBondContact O-CB 3.06Å; K1053-Q1057 WeakPolarHBondContact O-CG 3.29Å; K1053-Q1057 PolarHBondContact O-N 3.33Å; L1055-Q1057 VanDerWaalsContact C-N 3.31Å; L1055-Q1057 PolarHBondContact O-N 3.26Å; Q1057-Y1059 VanDerWaalsContact C-N 3.32Å; Q1057-Y1059 PolarHBondContact O-N 3.42Å; Q1057-A1060 WeakPolarHBondContact O-CB 3.47Å; Q1057-A1060 PolarHBondContact O-N 3.2Å
1058	K	89.4	Confident	88	Confident	146 Å²	146	84 Å²	84	64%	0.635	40%	0.4	S	S	*	.	H	α-helix	trans	-60.6	-40.3	178.8	-176.1	-176.2	177.9	-170.4	0	112.3	R1054 L1055	R1054-K1058 WeakPolarHBondContact O-CB 3.33Å; R1054-K1058 PolarHBondContact O-N 3.19Å; L1055-K1058 WeakPolarHBondContact O-CB 3.4Å; L1055-K1058 PolarHBondContact O-N 3.42Å; L1055-K1058 VanDerWaalsContact O-N 3.14Å
1059	Y	90	Very high	88.4	Confident	82 Å²	82	83.7 Å²	83.7	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-100.1	3.8	-176.5	-63.2	-65.4	0	0	0	114	L1037 L1055 E1056 Q1057 N1061 L1062	L1037-Y1059 HydrophobicContact CD1-CD2 4.23Å; L1037-Y1059 HydrophobicContact CD2-CD2 3.84Å; L1037-Y1059 HydrophobicContact CD2-CE2 4.49Å; L1037-Y1059 HydrophobicContact CD2-CG 4.4Å; L1055-Y1059 HydrophobicContact CD2-CD2 4.48Å; L1055-Y1059 HydrophobicContact CD2-CE2 3.82Å; L1055-Y1059 VanDerWaalsContact O-CD2 3.23Å; L1055-Y1059 WeakPolarHBondContact O-CD2 3.31Å; L1055-Y1059 PolarHBondContact O-N 3.02Å; E1056-Y1059 PolarHBondContact O-N 3.37Å; Q1057-Y1059 VanDerWaalsContact C-N 3.32Å; Q1057-Y1059 PolarHBondContact O-N 3.42Å; Y1059-N1061 PolarHBondContact O-N 3.33Å; Y1059-N1061 VanDerWaalsContact O-N 3.07Å; Y1059-L1062 HydrophobicContact CD1-CD1 3.65Å; Y1059-L1062 HydrophobicContact CE1-CD1 4.42Å; Y1059-L1062 HydrophobicContact CG-CD1 4.5Å; Y1059-L1062 WeakPolarHBondContact O-CB 3.27Å; Y1059-L1062 PolarHBondContact O-N 3.49Å
1060	A	86.4	Confident	88.7	Confident	11 Å²	11	84 Å²	84	9%	0.091	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-54.2	-33.3	-176.5	0	0	0	0	0	114.1	E1056 Q1057 L1062 Q1063	E1056-A1060 WeakPolarHBondContact O-CA 3.25Å; E1056-A1060 WeakPolarHBondContact O-CB 3.36Å; E1056-A1060 PolarHBondContact O-N 3.23Å; Q1057-A1060 WeakPolarHBondContact O-CB 3.47Å; Q1057-A1060 PolarHBondContact O-N 3.2Å; A1060-L1062 VanDerWaalsContact C-N 3.28Å; A1060-L1062 PolarHBondContact O-N 3.4Å; A1060-Q1063 PolarHBondContact O-N 3.46Å
1061	N	87.9	Confident	89	Confident	120 Å²	120	88.4 Å²	88.4	64%	0.642	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-75	-16.9	-179.9	-65.8	-17.3	0	0	0	113.4	Y1059 Q1063 T1067	Y1059-N1061 PolarHBondContact O-N 3.33Å; Y1059-N1061 VanDerWaalsContact O-N 3.07Å; N1061-Q1063 VanDerWaalsContact C-N 3.33Å; N1061-T1067 PolarHBondContact O-OG1 3.37Å; N1061-T1067 VanDerWaalsContact O-OG1 3.08Å
1062	L	90	Very high	89.2	Confident	78 Å²	78	86.8 Å²	86.8	41%	0.408	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-82.1	-15.6	175.1	-57.2	-176.3	0	0	0	112.2	V1032 Y1059 A1060 V1064	V1032-L1062 HydrophobicContact CG2-CD1 3.75Å; Y1059-L1062 HydrophobicContact CD1-CD1 3.65Å; Y1059-L1062 HydrophobicContact CE1-CD1 4.42Å; Y1059-L1062 HydrophobicContact CG-CD1 4.5Å; Y1059-L1062 WeakPolarHBondContact O-CB 3.27Å; Y1059-L1062 PolarHBondContact O-N 3.49Å; A1060-L1062 VanDerWaalsContact C-N 3.28Å; A1060-L1062 PolarHBondContact O-N 3.4Å; L1062-V1064 PolarHBondContact O-N 3.14Å
1063	Q	90.5	Very high	89.5	Confident	48 Å²	48	88.7 Å²	88.7	22%	0.224	43%	0.427	C	S	.	.			trans	-75.1	110.7	-177.3	-160.9	-178.6	19.9	0	0	110.4	F1033 I1034 A1060 N1061 S1065 R1066 T1067	F1033-Q1063 VanDerWaalsContact O-CA 3.28Å; F1033-Q1063 WeakPolarHBondContact O-CA 3.42Å; I1034-Q1063 PolarHBondContact O-NE2 3.08Å; I1034-Q1063 VanDerWaalsContact O-NE2 3.13Å; A1060-Q1063 PolarHBondContact O-N 3.46Å; N1061-Q1063 VanDerWaalsContact C-N 3.33Å; Q1063-S1065 PolarHBondContact O-N 2.9Å; Q1063-R1066 HydrophobicContact CB-CB 4.06Å; Q1063-R1066 HydrophobicContact CG-CB 4.28Å; Q1063-R1066 PolarHBondContact O-N 2.94Å; Q1063-T1067 PolarHBondContact O-N 3.05Å; Q1063-T1067 PolarHBondContact O-OG1 3.33Å
1064	V	90.1	Very high	89.8	Confident	66 Å²	66	90.9 Å²	90.9	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-62.1	-52.4	-165.7	172	0	0	0	0	111.6	F1033 L1062 R1066 T1067 I1068	F1033-V1064 HydrophobicContact CB-CG2 4.04Å; F1033-V1064 HydrophobicContact CD1-CG2 4.37Å; F1033-V1064 PolarHBondContact O-N 2.9Å; L1062-V1064 PolarHBondContact O-N 3.14Å; V1064-R1066 VanDerWaalsContact C-N 3.26Å; V1064-R1066 PolarHBondContact O-N 2.89Å; V1064-T1067 PolarHBondContact O-N 3.28Å; V1064-I1068 HydrophobicContact CG1-CD1 3.61Å; V1064-I1068 HydrophobicContact CG1-CG1 4.33Å; V1064-I1068 WeakPolarHBondContact O-CG1 3.05Å; V1064-I1068 PolarHBondContact O-N 3.18Å
1065	S	88.5	Confident	90.1	Very high	19 Å²	19	90 Å²	90	13%	0.133	44%	0.441	C	S	.	.	H	α-helix	trans	-63.3	-32.2	-178.8	-52.4	0	0	0	0	112.9	Q1063 G1069 A1080 E1084	Q1063-S1065 PolarHBondContact O-N 2.9Å; S1065-G1069 WeakPolarHBondContact O-CA 3.13Å; S1065-G1069 PolarHBondContact O-N 2.93Å; S1065-A1080 PolarHBondContact OG-O 3.38Å; S1065-E1084 WeakPolarHBondContact CB-OE2 3.48Å; S1065-E1084 PolarHBondContact OG-OE2 3.26Å
1066	R	88	Confident	90.4	Very high	116 Å²	116	92.9 Å²	92.9	44%	0.438	45%	0.453	S	S	.	.	H	α-helix	trans	-71.7	-41.5	176.5	-169.9	177.9	-174.4	171.7	3	111.7	Q1063 V1064 R1070	Q1063-R1066 HydrophobicContact CB-CB 4.06Å; Q1063-R1066 HydrophobicContact CG-CB 4.28Å; Q1063-R1066 PolarHBondContact O-N 2.94Å; V1064-R1066 VanDerWaalsContact C-N 3.26Å; V1064-R1066 PolarHBondContact O-N 2.89Å; R1066-R1070 WeakPolarHBondContact O-CG 3.44Å; R1066-R1070 PolarHBondContact O-N 3.4Å
1067	T	90.5	Very high	90.6	Very high	44 Å²	44	89.8 Å²	89.8	27%	0.27	44%	0.44	S	S	.	.	H	α-helix	trans	-68.7	-45	177.8	-62.3	0	0	0	0	110.8	N1061 Q1063 V1064 R1070 Y1071	N1061-T1067 PolarHBondContact O-OG1 3.37Å; N1061-T1067 VanDerWaalsContact O-OG1 3.08Å; Q1063-T1067 PolarHBondContact O-N 3.05Å; Q1063-T1067 PolarHBondContact O-OG1 3.33Å; V1064-T1067 PolarHBondContact O-N 3.28Å; T1067-R1070 PolarHBondContact O-N 2.83Å; T1067-R1070 VanDerWaalsContact O-N 3.15Å; T1067-Y1071 HydrophobicContact CG2-CD2 3.93Å; T1067-Y1071 HydrophobicContact CG2-CE2 4.2Å; T1067-Y1071 VanDerWaalsContact O-CD2 3.26Å; T1067-Y1071 WeakPolarHBondContact O-CD2 3.21Å; T1067-Y1071 PolarHBondContact O-N 3.19Å; T1067-Y1071 VanDerWaalsContact O-N 3.16Å
1068	I	92.1	Very high	90.9	Very high	49 Å²	49	85.3 Å²	85.3	25%	0.251	43%	0.426	S	S	.	.	H	α-helix	trans	-66.8	-37.5	175.3	-64.5	176.1	0	0	0	110.8	V1064 R1070 Y1071 G1072 Q1076 V1077 A1080	V1064-I1068 HydrophobicContact CG1-CD1 3.61Å; V1064-I1068 HydrophobicContact CG1-CG1 4.33Å; V1064-I1068 WeakPolarHBondContact O-CG1 3.05Å; V1064-I1068 PolarHBondContact O-N 3.18Å; I1068-R1070 PolarHBondContact O-N 2.79Å; I1068-R1070 VanDerWaalsContact O-N 3.15Å; I1068-Y1071 PolarHBondContact O-N 2.78Å; I1068-G1072 VanDerWaalsContact O-CA 3.23Å; I1068-G1072 WeakPolarHBondContact O-CA 3.44Å; I1068-G1072 PolarHBondContact O-N 3.02Å; I1068-Q1076 HydrophobicContact CG2-CB 3.81Å; I1068-V1077 HydrophobicContact CG2-CG2 4.11Å; I1068-A1080 HydrophobicContact CB-CB 4.22Å; I1068-A1080 HydrophobicContact CD1-CB 3.72Å; I1068-A1080 HydrophobicContact CG2-CB 4.12Å
1069	G	91.3	Very high	91.1	Very high	47 Å²	47	83 Å²	83	49%	0.485	42%	0.42	S	S	.	.	H	α-helix	trans	-60.1	-23.2	173.2	0	0	0	0	0	114.2	S1065	S1065-G1069 WeakPolarHBondContact O-CA 3.13Å; S1065-G1069 PolarHBondContact O-N 2.93Å
1070	R	91	Very high	91.3	Very high	137 Å²	137	79.8 Å²	79.8	52%	0.517	41%	0.41	S	S	.	.	H	α-helix	trans	-89.8	-35.6	177.6	-75.6	176.8	174	179.4	-3.3	113.9	R1066 T1067 I1068	R1066-R1070 WeakPolarHBondContact O-CG 3.44Å; R1066-R1070 PolarHBondContact O-N 3.4Å; T1067-R1070 PolarHBondContact O-N 2.83Å; T1067-R1070 VanDerWaalsContact O-N 3.15Å; I1068-R1070 PolarHBondContact O-N 2.79Å; I1068-R1070 VanDerWaalsContact O-N 3.15Å
1071	Y	91.8	Very high	91.5	Very high	185 Å²	185	84.9 Å²	84.9	73%	0.725	43%	0.432	S	S	*	.	H	α-helix	trans	-123.7	-13.9	-168.1	-54.3	-63.2	0	0	0	114.4	T1067 I1068	T1067-Y1071 HydrophobicContact CG2-CD2 3.93Å; T1067-Y1071 HydrophobicContact CG2-CE2 4.2Å; T1067-Y1071 VanDerWaalsContact O-CD2 3.26Å; T1067-Y1071 WeakPolarHBondContact O-CD2 3.21Å; T1067-Y1071 PolarHBondContact O-N 3.19Å; T1067-Y1071 VanDerWaalsContact O-N 3.16Å; I1068-Y1071 PolarHBondContact O-N 2.78Å
1072	G	90.4	Very high	91.8	Very high	25 Å²	25	84.3 Å²	84.3	26%	0.258	43%	0.425	S	S	.	.	S	Bend	trans	-88.7	161	-175.8	0	0	0	0	0	113	I1068 Q1076	I1068-G1072 VanDerWaalsContact O-CA 3.23Å; I1068-G1072 WeakPolarHBondContact O-CA 3.44Å; I1068-G1072 PolarHBondContact O-N 3.02Å; G1072-Q1076 VanDerWaalsContact CA-OE1 3.28Å
1073	V	93	Very high	91.9	Very high	92 Å²	92	82 Å²	82	56%	0.558	42%	0.421	S	S	*	.			trans	-76.5	158.2	170.7	-64.1	0	0	0	0	110.9	K1075 Q1076 V1077	V1073-K1075 VanDerWaalsContact C-N 3.25Å; V1073-K1075 PolarHBondContact O-N 3.41Å; V1073-K1075 VanDerWaalsContact O-N 3.1Å; V1073-Q1076 HydrophobicContact CG2-CB 4.14Å; V1073-Q1076 HydrophobicContact CG2-CG 3.65Å; V1073-Q1076 VanDerWaalsContact N-OE1 3.07Å; V1073-Q1076 WeakPolarHBondContact O-CA 3.41Å; V1073-Q1076 WeakPolarHBondContact O-CB 3.4Å; V1073-Q1076 PolarHBondContact O-N 3.22Å; V1073-V1077 PolarHBondContact O-N 3.42Å
1074	E	93.5	Very high	91.9	Very high	176 Å²	176	82 Å²	82	82%	0.822	42%	0.421	S	S	*	.	H	α-helix	trans	-50.7	-41.7	-175.6	-169.1	173.4	-168.1	0	0	113.5	Q1076 V1077 S1078	E1074-Q1076 PolarHBondContact O-N 3.46Å; E1074-V1077 WeakPolarHBondContact O-CB 3.46Å; E1074-V1077 PolarHBondContact O-N 3.44Å; E1074-S1078 PolarHBondContact O-N 3.13Å
1075	K	94.1	Very high	92	Very high	159 Å²	159	82.5 Å²	82.5	69%	0.691	42%	0.421	S	S	*	.	H	α-helix	trans	-60.6	-41.6	174.7	-173.4	176.2	-178.3	178.8	0	112.9	V1073 V1077 L1079	V1073-K1075 VanDerWaalsContact C-N 3.25Å; V1073-K1075 PolarHBondContact O-N 3.41Å; V1073-K1075 VanDerWaalsContact O-N 3.1Å; K1075-V1077 VanDerWaalsContact C-N 3.33Å; K1075-L1079 HydrophobicContact CG-CD1 4.18Å; K1075-L1079 WeakPolarHBondContact O-CB 3.5Å; K1075-L1079 VanDerWaalsContact O-CG 3.28Å; K1075-L1079 WeakPolarHBondContact O-CG 3.36Å; K1075-L1079 PolarHBondContact O-N 3.44Å; K1075-L1079 VanDerWaalsContact O-N 3.08Å
1076	Q	93.9	Very high	92.2	Very high	104 Å²	104	87.4 Å²	87.4	49%	0.486	45%	0.445	S	S	.	.	H	α-helix	trans	-67.9	-37.3	177.1	-69.5	172	-28.9	0	0	110.9	I1068 G1072 V1073 E1074 L1079 A1080	I1068-Q1076 HydrophobicContact CG2-CB 3.81Å; G1072-Q1076 VanDerWaalsContact CA-OE1 3.28Å; V1073-Q1076 HydrophobicContact CG2-CB 4.14Å; V1073-Q1076 HydrophobicContact CG2-CG 3.65Å; V1073-Q1076 VanDerWaalsContact N-OE1 3.07Å; V1073-Q1076 WeakPolarHBondContact O-CA 3.41Å; V1073-Q1076 WeakPolarHBondContact O-CB 3.4Å; V1073-Q1076 PolarHBondContact O-N 3.22Å; E1074-Q1076 PolarHBondContact O-N 3.46Å; Q1076-L1079 PolarHBondContact O-N 2.92Å; Q1076-A1080 VanDerWaalsContact O-CB 3.24Å; Q1076-A1080 WeakPolarHBondContact O-CB 3.42Å; Q1076-A1080 PolarHBondContact O-N 3.1Å
1077	V	93	Very high	92.4	Very high	31 Å²	31	84 Å²	84	19%	0.188	44%	0.437	C	S	.	.	H	α-helix	trans	-62.7	-48.3	176.2	179.9	0	0	0	0	110.7	I1068 V1073 E1074 K1075 L1079 A1080 Q1081	I1068-V1077 HydrophobicContact CG2-CG2 4.11Å; V1073-V1077 PolarHBondContact O-N 3.42Å; E1074-V1077 WeakPolarHBondContact O-CB 3.46Å; E1074-V1077 PolarHBondContact O-N 3.44Å; K1075-V1077 VanDerWaalsContact C-N 3.33Å; V1077-L1079 PolarHBondContact O-N 2.89Å; V1077-A1080 PolarHBondContact O-N 2.75Å; V1077-Q1081 WeakPolarHBondContact O-CG 3.28Å; V1077-Q1081 PolarHBondContact O-N 2.96Å
1078	S	93.8	Very high	92.3	Very high	57 Å²	57	88.6 Å²	88.6	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-57.4	-49.3	176.6	-167.9	0	0	0	0	111.6	E1074 A1080 Q1081 E1082	E1074-S1078 PolarHBondContact O-N 3.13Å; S1078-A1080 VanDerWaalsContact C-N 3.33Å; S1078-A1080 PolarHBondContact O-N 3.47Å; S1078-Q1081 PolarHBondContact O-N 2.91Å; S1078-E1082 WeakPolarHBondContact O-CG 3.37Å; S1078-E1082 PolarHBondContact O-N 3.07Å
1079	L	94.2	Very high	92.2	Very high	98 Å²	98	91.8 Å²	91.8	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-64.4	-36.5	179.4	-70.7	171.6	0	0	0	112.6	K1075 Q1076 V1077 G1083	K1075-L1079 HydrophobicContact CG-CD1 4.18Å; K1075-L1079 WeakPolarHBondContact O-CB 3.5Å; K1075-L1079 VanDerWaalsContact O-CG 3.28Å; K1075-L1079 WeakPolarHBondContact O-CG 3.36Å; K1075-L1079 PolarHBondContact O-N 3.44Å; K1075-L1079 VanDerWaalsContact O-N 3.08Å; Q1076-L1079 PolarHBondContact O-N 2.92Å; V1077-L1079 PolarHBondContact O-N 2.89Å; L1079-G1083 PolarHBondContact O-N 3.15Å
1080	A	92.4	Very high	92.3	Very high	14 Å²	14	92.1 Å²	92.1	12%	0.116	45%	0.45	C	S	.	.	H	α-helix	trans	-66.2	-41.6	176.4	0	0	0	0	0	111.6	S1065 I1068 Q1076 V1077 S1078 G1083 E1084	S1065-A1080 PolarHBondContact OG-O 3.38Å; I1068-A1080 HydrophobicContact CB-CB 4.22Å; I1068-A1080 HydrophobicContact CD1-CB 3.72Å; I1068-A1080 HydrophobicContact CG2-CB 4.12Å; Q1076-A1080 VanDerWaalsContact O-CB 3.24Å; Q1076-A1080 WeakPolarHBondContact O-CB 3.42Å; Q1076-A1080 PolarHBondContact O-N 3.1Å; V1077-A1080 PolarHBondContact O-N 2.75Å; S1078-A1080 VanDerWaalsContact C-N 3.33Å; S1078-A1080 PolarHBondContact O-N 3.47Å; A1080-G1083 PolarHBondContact O-N 3.11Å; A1080-E1084 WeakPolarHBondContact O-CB 3.43Å; A1080-E1084 PolarHBondContact O-N 2.86Å
1081	Q	91.5	Very high	92.2	Very high	117 Å²	117	87.7 Å²	87.7	55%	0.547	44%	0.437	S	S	.	.	H	α-helix	trans	-65.5	-43.6	176.6	-71.9	175.4	-3.1	0	0	111.9	V1077 S1078 E1084 L1085	V1077-Q1081 WeakPolarHBondContact O-CG 3.28Å; V1077-Q1081 PolarHBondContact O-N 2.96Å; S1078-Q1081 PolarHBondContact O-N 2.91Å; Q1081-E1084 PolarHBondContact O-N 2.89Å; Q1081-L1085 WeakPolarHBondContact O-CB 3.34Å; Q1081-L1085 PolarHBondContact O-N 3.42Å
1082	E	93.4	Very high	92.2	Very high	108 Å²	108	80.8 Å²	80.8	51%	0.505	42%	0.415	S	S	.	.	H	α-helix	trans	-61.9	-44.2	173.3	-73.5	174.9	-165.6	0	0	111.7	S1078 E1084 L1085 L1086	S1078-E1082 WeakPolarHBondContact O-CG 3.37Å; S1078-E1082 PolarHBondContact O-N 3.07Å; E1082-E1084 PolarHBondContact O-N 2.95Å; E1082-L1085 WeakPolarHBondContact O-CB 3.22Å; E1082-L1085 PolarHBondContact O-N 2.86Å; E1082-L1086 WeakPolarHBondContact O-CG 3.26Å; E1082-L1086 PolarHBondContact O-N 2.91Å
1083	G	92.5	Very high	92.1	Very high	31 Å²	31	83.6 Å²	83.6	32%	0.32	43%	0.43	S	S	.	.	H	α-helix	trans	-63.5	-40.5	177.8	0	0	0	0	0	112.9	L1079 A1080 T1087	L1079-G1083 PolarHBondContact O-N 3.15Å; A1080-G1083 PolarHBondContact O-N 3.11Å; G1083-T1087 WeakPolarHBondContact O-CB 3.15Å; G1083-T1087 PolarHBondContact O-N 2.82Å; G1083-T1087 PolarHBondContact O-OG1 3.46Å
1084	E	91.5	Very high	91.7	Very high	48 Å²	48	82.6 Å²	82.6	22%	0.224	44%	0.438	C	S	.	.	H	α-helix	trans	-63	-42.7	173.8	179.2	171	-162.6	0	0	111.3	I1034 S1065 A1080 Q1081 E1082 T1087 R1088	I1034-E1084 HydrophobicContact CB-CG 4.38Å; I1034-E1084 HydrophobicContact CG2-CG 3.94Å; S1065-E1084 WeakPolarHBondContact CB-OE2 3.48Å; S1065-E1084 PolarHBondContact OG-OE2 3.26Å; A1080-E1084 WeakPolarHBondContact O-CB 3.43Å; A1080-E1084 PolarHBondContact O-N 2.86Å; Q1081-E1084 PolarHBondContact O-N 2.89Å; E1082-E1084 PolarHBondContact O-N 2.95Å; E1084-T1087 PolarHBondContact O-N 2.94Å; E1084-R1088 WeakPolarHBondContact O-CB 3.27Å; E1084-R1088 PolarHBondContact O-N 3.22Å
1085	L	91.8	Very high	91.5	Very high	76 Å²	76	80.1 Å²	80.1	40%	0.398	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-51	177.1	-171.9	69.1	0	0	0	111.4	Q1081 E1082 T1087 R1088 E1089	Q1081-L1085 WeakPolarHBondContact O-CB 3.34Å; Q1081-L1085 PolarHBondContact O-N 3.42Å; E1082-L1085 WeakPolarHBondContact O-CB 3.22Å; E1082-L1085 PolarHBondContact O-N 2.86Å; L1085-T1087 PolarHBondContact O-N 2.93Å; L1085-R1088 PolarHBondContact O-N 3.26Å; L1085-E1089 HydrophobicContact CD1-CG 4.18Å; L1085-E1089 WeakPolarHBondContact CD1-OE1 3.35Å; L1085-E1089 WeakPolarHBondContact O-CB 3.24Å; L1085-E1089 PolarHBondContact O-N 2.97Å
1086	L	92	Very high	91.2	Very high	121 Å²	121	73.9 Å²	73.9	63%	0.634	41%	0.406	S	S	*	.	H	α-helix	trans	-63.1	-29.5	178.8	-68.9	174	0	0	0	113.2	E1082 R1090	E1082-L1086 WeakPolarHBondContact O-CG 3.26Å; E1082-L1086 PolarHBondContact O-N 2.91Å; L1086-R1090 PolarHBondContact O-NH1 3.41Å
1087	T	92.2	Very high	91	Very high	44 Å²	44	71.1 Å²	71.1	27%	0.27	39%	0.394	S	S	.	.	H	α-helix	trans	-75.6	-39.5	177.1	-56.6	0	0	0	0	111.1	L1027 S1030 G1083 E1084 L1085	L1027-T1087 VanDerWaalsContact CD2-O 3.27Å; L1027-T1087 WeakPolarHBondContact CD2-O 3.39Å; S1030-T1087 WeakPolarHBondContact OG-CG2 3.41Å; G1083-T1087 WeakPolarHBondContact O-CB 3.15Å; G1083-T1087 PolarHBondContact O-N 2.82Å; G1083-T1087 PolarHBondContact O-OG1 3.46Å; E1084-T1087 PolarHBondContact O-N 2.94Å; L1085-T1087 PolarHBondContact O-N 2.93Å
1088	R	89.1	Confident	90.9	Very high	141 Å²	141	69.6 Å²	69.6	53%	0.532	39%	0.385	S	S	.	.	H	α-helix	trans	-75.1	-38.9	-179	-168.6	-178.3	72.8	178	1.6	112.7	E1084 L1085 R1090	E1084-R1088 WeakPolarHBondContact O-CB 3.27Å; E1084-R1088 PolarHBondContact O-N 3.22Å; L1085-R1088 PolarHBondContact O-N 3.26Å; R1088-R1090 PolarHBondContact O-N 3.47Å
1089	E	90.1	Very high	90.7	Very high	117 Å²	117	69.1 Å²	69.1	55%	0.547	38%	0.377	S	S	.	.			trans	-89.3	91.7	-174.4	-64.9	-173.3	173.1	0	0	110.7	L1085	L1085-E1089 HydrophobicContact CD1-CG 4.18Å; L1085-E1089 WeakPolarHBondContact CD1-OE1 3.35Å; L1085-E1089 WeakPolarHBondContact O-CB 3.24Å; L1085-E1089 PolarHBondContact O-N 2.97Å
1090	R	92.2	Very high	90.5	Very high	53 Å²	53	68.4 Å²	68.4	20%	0.2	38%	0.376	C	S	.	.			trans	-113.7	158.8	174.1	-54.2	-53.2	-138	-162	8.1	110.7	E1023 D1026 L1027 L1086 R1088 C1092 C1093	E1023-R1090 HydrophobicContact CB-CB 4.05Å; E1023-R1090 HydrophobicContact CB-CG 4.36Å; E1023-R1090 HydrophobicContact CG-CB 4.08Å; E1023-R1090 HydrophobicContact CG-CG 4.48Å; D1026-R1090 IonicContact OD2-CZ 3.14Å; D1026-R1090 IonicContact OD2-NH2 2.83Å; D1026-R1090 PolarHBondContact OD2-NH2 2.79Å; L1027-R1090 HydrophobicContact CD1-CB 4.27Å; L1027-R1090 HydrophobicContact CD1-CG 4.08Å; L1027-R1090 HydrophobicContact CD2-CG 3.95Å; L1027-R1090 HydrophobicContact CG-CG 3.91Å; L1086-R1090 PolarHBondContact O-NH1 3.41Å; R1088-R1090 PolarHBondContact O-N 3.47Å; R1090-C1092 VanDerWaalsContact C-N 3.3Å; R1090-C1092 PolarHBondContact O-N 2.47Å; R1090-C1093 WeakPolarHBondContact O-CB 3.29Å; R1090-C1093 PolarHBondContact O-N 3.48Å
1091	L	90.8	Very high	90.4	Very high	45 Å²	45	68.2 Å²	68.2	24%	0.236	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-63.9	-37.6	-178.4	-62.2	177.2	0	0	0	111.7	Y928 L1019 E1023 C1093 G1094 L1095 I1097	Y928-L1091 HydrophobicContact CD1-CD1 4.3Å; Y928-L1091 HydrophobicContact CE1-CD1 4.06Å; Y928-L1091 HydrophobicContact CE1-CG 4.28Å; L1019-L1091 HydrophobicContact CD2-CD1 3.81Å; E1023-L1091 VanDerWaalsContact OE1-CB 3.31Å; E1023-L1091 WeakPolarHBondContact OE1-CB 3.41Å; E1023-L1091 WeakPolarHBondContact OE1-CG 3.44Å; E1023-L1091 PolarHBondContact OE1-N 3.3Å; E1023-L1091 PolarHBondContact OE2-N 3.29Å; L1091-C1093 PolarHBondContact O-N 3.42Å; L1091-G1094 PolarHBondContact O-N 3.36Å; L1091-G1094 VanDerWaalsContact O-N 3.11Å; L1091-L1095 HydrophobicContact CB-CB 4.5Å; L1091-L1095 HydrophobicContact CD2-CB 4.12Å; L1091-L1095 HydrophobicContact CD2-CD1 3.81Å; L1091-L1095 PolarHBondContact O-N 3.32Å; L1091-I1097 HydrophobicContact CD1-CD1 3.73Å; L1091-I1097 HydrophobicContact CD1-CG1 4.23Å
1092	C	90.5	Very high	90.4	Very high	40 Å²	40	62.6 Å²	62.6	27%	0.27	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-57.9	-14.3	177.9	70.7	0	0	0	0	114.8	T1020 E1023 V1024 L1027 R1090 G1094	T1020-C1092 HydrophobicContact CG2-CB 3.8Å; E1023-C1092 HydrophobicContact CB-CB 4.29Å; E1023-C1092 VanDerWaalsContact OE2-CB 3.29Å; E1023-C1092 WeakPolarHBondContact OE2-CB 3.18Å; E1023-C1092 PolarHBondContact OE2-N 3.03Å; V1024-C1092 HydrophobicContact CG2-CB 4.23Å; L1027-C1092 VanDerWaalsContact CD1-SG 3.58Å; R1090-C1092 VanDerWaalsContact C-N 3.3Å; R1090-C1092 PolarHBondContact O-N 2.47Å; C1092-G1094 VanDerWaalsContact C-N 3.27Å; C1092-G1094 PolarHBondContact O-N 2.86Å
1093	C	88	Confident	90.2	Very high	84 Å²	84	60.7 Å²	60.7	57%	0.568	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-74	-12.3	177	-62.2	0	0	0	0	114.1	R1090 L1091	R1090-C1093 WeakPolarHBondContact O-CB 3.29Å; R1090-C1093 PolarHBondContact O-N 3.48Å; L1091-C1093 PolarHBondContact O-N 3.42Å
1094	G	86	Confident	90.2	Very high	71 Å²	71	64.9 Å²	64.9	73%	0.732	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	161.3	11.7	176.2	0	0	0	0	0	116.9	L1091 C1092	L1091-G1094 PolarHBondContact O-N 3.36Å; L1091-G1094 VanDerWaalsContact O-N 3.11Å; C1092-G1094 VanDerWaalsContact C-N 3.27Å; C1092-G1094 PolarHBondContact O-N 2.86Å
1095	L	88.4	Confident	90.3	Very high	123 Å²	123	62.6 Å²	62.6	64%	0.644	34%	0.341	S	S	*	.			trans	-114.8	146.1	180	-61.2	174.4	0	0	0	110.1	L1091	L1091-L1095 HydrophobicContact CB-CB 4.5Å; L1091-L1095 HydrophobicContact CD2-CB 4.12Å; L1091-L1095 HydrophobicContact CD2-CD1 3.81Å; L1091-L1095 PolarHBondContact O-N 3.32Å
1096	S	88.3	Confident	90.3	Very high	29 Å²	29	63.6 Å²	63.6	20%	0.203	34%	0.342	C	S	.	.			trans	-131.7	127.3	174.1	-178.5	0	0	0	0	111.6	E1016	E1016-S1096 WeakPolarHBondContact OE1-CA 3.43Å; E1016-S1096 WeakPolarHBondContact OE1-CB 3.35Å; E1016-S1096 PolarHBondContact OE1-OG 2.94Å
1097	I	89.6	Confident	90.3	Very high	45 Å²	45	63.2 Å²	63.2	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-76.2	-43.4	179.8	-63.4	168.4	0	0	0	110.2	M935 E1016 L1019 L1091 E1099 V1100 L1101	M935-I1097 HydrophobicContact CE-CG2 4.39Å; M935-I1097 HydrophobicContact CG-CG2 4.36Å; M935-I1097 HydrophobicContact SD-CG2 4.37Å; E1016-I1097 PolarHBondContact OE1-N 3.31Å; E1016-I1097 VanDerWaalsContact OE1-N 3.11Å; E1016-I1097 PolarHBondContact OE2-N 2.89Å; L1019-I1097 HydrophobicContact CD2-CD1 4.3Å; L1091-I1097 HydrophobicContact CD1-CD1 3.73Å; L1091-I1097 HydrophobicContact CD1-CG1 4.23Å; I1097-E1099 VanDerWaalsContact C-N 3.31Å; I1097-E1099 PolarHBondContact O-N 3.01Å; I1097-V1100 PolarHBondContact O-N 3.5Å; I1097-L1101 PolarHBondContact O-N 2.87Å
1098	F	90.5	Very high	90.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-35.4	-174.5	-176	-113.9	0	0	0	112.4	I1009 C1012 L1013 E1016 L1101 L1102 L1229 Y1232	I1009-F1098 HydrophobicContact CG2-CE2 3.63Å; I1009-F1098 HydrophobicContact CG2-CZ 3.62Å; I1009-F1098 VanDerWaalsContact O-CE2 3.3Å; I1009-F1098 WeakPolarHBondContact O-CE2 3.25Å; C1012-F1098 HydrophobicContact CB-CD2 4.2Å; L1013-F1098 HydrophobicContact CB-CD2 4.01Å; L1013-F1098 HydrophobicContact CB-CE1 4.47Å; L1013-F1098 HydrophobicContact CB-CE2 3.82Å; L1013-F1098 HydrophobicContact CB-CG 4.43Å; L1013-F1098 HydrophobicContact CB-CZ 4.06Å; L1013-F1098 HydrophobicContact CD1-CD1 3.88Å; L1013-F1098 HydrophobicContact CD1-CE1 4Å; L1013-F1098 HydrophobicContact CD1-CG 4.19Å; L1013-F1098 HydrophobicContact CD1-CZ 4.43Å; L1013-F1098 HydrophobicContact CD2-CZ 4.5Å; E1016-F1098 WeakPolarHBondContact OE2-CA 3.27Å; E1016-F1098 WeakPolarHBondContact OE2-CB 3.29Å; E1016-F1098 PolarHBondContact OE2-N 3.15Å; F1098-L1101 PolarHBondContact O-N 3.5Å; F1098-L1102 HydrophobicContact CD1-CD1 4.04Å; F1098-L1102 HydrophobicContact CD1-CG 4.49Å; F1098-L1102 HydrophobicContact CE1-CD1 3.6Å; F1098-L1102 HydrophobicContact CE1-CG 4.2Å; F1098-L1102 HydrophobicContact CE2-CD2 4.39Å; F1098-L1102 HydrophobicContact CE2-CG 4.35Å; F1098-L1102 HydrophobicContact CZ-CD1 3.92Å; F1098-L1102 HydrophobicContact CZ-CD2 4.17Å; F1098-L1102 HydrophobicContact CZ-CG 4.12Å; F1098-L1102 WeakPolarHBondContact O-CG 3.42Å; F1098-L1102 PolarHBondContact O-N 2.91Å; F1098-L1229 HydrophobicContact CE1-CD2 4.41Å; F1098-L1229 HydrophobicContact CZ-CD2 4.29Å; F1098-Y1232 AromaticContact CD1-CD1 3.96Å; F1098-Y1232 HydrophobicContact CD1-CD1 3.96Å; F1098-Y1232 AromaticContact CD1-CD2 3.81Å; F1098-Y1232 HydrophobicContact CD1-CD2 3.81Å; F1098-Y1232 HydrophobicContact CD1-CE1 4.25Å; F1098-Y1232 HydrophobicContact CD1-CE2 4.11Å; F1098-Y1232 AromaticContact CD1-CG 3.74Å; F1098-Y1232 HydrophobicContact CD1-CG 3.74Å; F1098-Y1232 AromaticContact CE1-CD2 3.97Å; F1098-Y1232 HydrophobicContact CE1-CD2 3.97Å; F1098-Y1232 HydrophobicContact CE1-CE2 4.37Å; F1098-Y1232 HydrophobicContact CE1-CG 4.24Å
1099	E	89.1	Confident	90.5	Very high	47 Å²	47	57 Å²	57	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-50.3	172.6	179	177.6	173	0	0	111.8	I1097 L1101 L1102 S1103 Y1232 G1236	I1097-E1099 VanDerWaalsContact C-N 3.31Å; I1097-E1099 PolarHBondContact O-N 3.01Å; E1099-L1101 VanDerWaalsContact C-N 3.27Å; E1099-L1101 PolarHBondContact O-N 3.49Å; E1099-L1102 PolarHBondContact O-N 2.99Å; E1099-S1103 WeakPolarHBondContact O-CB 3.48Å; E1099-S1103 PolarHBondContact O-N 3.04Å; E1099-Y1232 WeakPolarHBondContact CG-O 3.39Å; E1099-G1236 VanDerWaalsContact OE1-CA 3.28Å; E1099-G1236 WeakPolarHBondContact OE1-CA 3.21Å; E1099-G1236 PolarHBondContact OE1-N 3.21Å
1100	V	89.9	Confident	90.5	Very high	83 Å²	83	56.7 Å²	56.7	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-40.7	178	177.3	0	0	0	0	110.4	I1097 S1103 R1104	I1097-V1100 PolarHBondContact O-N 3.5Å; V1100-S1103 WeakPolarHBondContact O-CB 3.42Å; V1100-S1103 PolarHBondContact O-N 2.97Å; V1100-R1104 HydrophobicContact CG1-CG 4.44Å; V1100-R1104 WeakPolarHBondContact O-CG 3.41Å; V1100-R1104 PolarHBondContact O-N 3.36Å
1101	L	90.7	Very high	90.4	Very high	9 Å²	9	55.7 Å²	55.7	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-46.4	-179.9	-169.8	148.3	0	0	0	112	M935 L939 C1012 I1097 F1098 E1099 S1103 R1104 M1105	M935-L1101 HydrophobicContact SD-CD1 4.06Å; L939-L1101 HydrophobicContact CD1-CG 4.39Å; C1012-L1101 HydrophobicContact CB-CD1 3.92Å; C1012-L1101 WeakPolarHBondContact SG-CD1 3.46Å; I1097-L1101 PolarHBondContact O-N 2.87Å; F1098-L1101 PolarHBondContact O-N 3.5Å; E1099-L1101 VanDerWaalsContact C-N 3.27Å; E1099-L1101 PolarHBondContact O-N 3.49Å; L1101-S1103 VanDerWaalsContact C-N 3.34Å; L1101-S1103 PolarHBondContact O-N 3.32Å; L1101-R1104 PolarHBondContact O-N 2.87Å; L1101-M1105 HydrophobicContact CD2-CE 3.34Å; L1101-M1105 HydrophobicContact CD2-CG 4.21Å; L1101-M1105 HydrophobicContact CD2-SD 3.61Å; L1101-M1105 HydrophobicContact CG-CE 4.49Å; L1101-M1105 WeakPolarHBondContact O-CG 3.46Å; L1101-M1105 PolarHBondContact O-N 2.94Å
1102	L	91.6	Very high	90.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-41.1	174.3	-70.3	179	0	0	0	111.9	I1009 F1098 E1099 R1104 M1105 K1106 M1173 L1229 L1233	I1009-L1102 HydrophobicContact CG2-CD2 4.48Å; F1098-L1102 HydrophobicContact CD1-CD1 4.04Å; F1098-L1102 HydrophobicContact CD1-CG 4.49Å; F1098-L1102 HydrophobicContact CE1-CD1 3.6Å; F1098-L1102 HydrophobicContact CE1-CG 4.2Å; F1098-L1102 HydrophobicContact CE2-CD2 4.39Å; F1098-L1102 HydrophobicContact CE2-CG 4.35Å; F1098-L1102 HydrophobicContact CZ-CD1 3.92Å; F1098-L1102 HydrophobicContact CZ-CD2 4.17Å; F1098-L1102 HydrophobicContact CZ-CG 4.12Å; F1098-L1102 WeakPolarHBondContact O-CG 3.42Å; F1098-L1102 PolarHBondContact O-N 2.91Å; E1099-L1102 PolarHBondContact O-N 2.99Å; L1102-R1104 VanDerWaalsContact C-N 3.35Å; L1102-R1104 PolarHBondContact O-N 2.83Å; L1102-M1105 HydrophobicContact CD2-SD 4.37Å; L1102-M1105 PolarHBondContact O-N 3.22Å; L1102-K1106 PolarHBondContact O-N 2.98Å; L1102-M1173 HydrophobicContact CD2-SD 4.41Å; L1102-L1229 HydrophobicContact CD1-CD2 3.98Å; L1102-L1229 HydrophobicContact CD2-CD2 4.43Å; L1102-L1233 HydrophobicContact CB-CD2 4.04Å; L1102-L1233 HydrophobicContact CD1-CD2 4.31Å; L1102-L1233 HydrophobicContact CD1-CG 4.28Å
1103	S	89.7	Confident	90.3	Very high	68 Å²	68	56 Å²	56	48%	0.476	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-43.2	175.8	-172.9	0	0	0	0	111.8	E1099 V1100 L1101 K1106	E1099-S1103 WeakPolarHBondContact O-CB 3.48Å; E1099-S1103 PolarHBondContact O-N 3.04Å; V1100-S1103 WeakPolarHBondContact O-CB 3.42Å; V1100-S1103 PolarHBondContact O-N 2.97Å; L1101-S1103 VanDerWaalsContact C-N 3.34Å; L1101-S1103 PolarHBondContact O-N 3.32Å; S1103-K1106 WeakPolarHBondContact O-CB 3.07Å; S1103-K1106 PolarHBondContact O-N 3.39Å
1104	R	92.6	Very high	90.5	Very high	118 Å²	118	52.2 Å²	52.2	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-68.6	-38.2	176.1	-70.1	-178.8	72.9	-172.6	-1.5	112.6	L939 V1100 L1101 L1102 K1106 N1107	L939-R1104 HydrophobicContact CD1-CB 4.02Å; L939-R1104 HydrophobicContact CD2-CB 3.82Å; L939-R1104 HydrophobicContact CD2-CG 4.4Å; V1100-R1104 HydrophobicContact CG1-CG 4.44Å; V1100-R1104 WeakPolarHBondContact O-CG 3.41Å; V1100-R1104 PolarHBondContact O-N 3.36Å; L1101-R1104 PolarHBondContact O-N 2.87Å; L1102-R1104 VanDerWaalsContact C-N 3.35Å; L1102-R1104 PolarHBondContact O-N 2.83Å; R1104-K1106 VanDerWaalsContact C-N 3.29Å; R1104-K1106 PolarHBondContact O-N 3.1Å; R1104-N1107 WeakPolarHBondContact O-CB 3.28Å; R1104-N1107 PolarHBondContact O-N 2.94Å
1105	M	93.7	Very high	90.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-38.5	174.3	-77.3	176.8	167.4	0	0	112.2	L939 S942 L1005 T1008 I1009 L1101 L1102 N1107 F1108 M1173	L939-M1105 HydrophobicContact CD1-CG 3.7Å; S942-M1105 VanDerWaalsContact CB-CE 3.47Å; S942-M1105 WeakPolarHBondContact OG-CE 3.33Å; L1005-M1105 HydrophobicContact CD1-CE 4.22Å; T1008-M1105 HydrophobicContact CG2-CE 4.49Å; I1009-M1105 HydrophobicContact CD1-SD 4.32Å; I1009-M1105 HydrophobicContact CG1-CE 3.85Å; I1009-M1105 HydrophobicContact CG1-SD 3.98Å; L1101-M1105 HydrophobicContact CD2-CE 3.34Å; L1101-M1105 HydrophobicContact CD2-CG 4.21Å; L1101-M1105 HydrophobicContact CD2-SD 3.61Å; L1101-M1105 HydrophobicContact CG-CE 4.49Å; L1101-M1105 WeakPolarHBondContact O-CG 3.46Å; L1101-M1105 PolarHBondContact O-N 2.94Å; L1102-M1105 HydrophobicContact CD2-SD 4.37Å; L1102-M1105 PolarHBondContact O-N 3.22Å; M1105-N1107 PolarHBondContact O-N 2.82Å; M1105-F1108 WeakPolarHBondContact O-CB 3.42Å; M1105-F1108 PolarHBondContact O-N 2.93Å; M1105-M1173 HydrophobicContact CB-CE 4.39Å; M1105-M1173 HydrophobicContact CB-SD 3.94Å
1106	K	91	Very high	90.4	Very high	98 Å²	98	48.3 Å²	48.3	43%	0.426	26%	0.257	S	S	.	.	H	α-helix	trans	-57.1	-34.3	176.1	-178.2	176.2	176.1	158.6	0	112.3	L1102 S1103 R1104 F1108 L1109 M1173	L1102-K1106 PolarHBondContact O-N 2.98Å; S1103-K1106 WeakPolarHBondContact O-CB 3.07Å; S1103-K1106 PolarHBondContact O-N 3.39Å; R1104-K1106 VanDerWaalsContact C-N 3.29Å; R1104-K1106 PolarHBondContact O-N 3.1Å; K1106-F1108 PolarHBondContact O-N 3.18Å; K1106-L1109 WeakPolarHBondContact O-CB 3.36Å; K1106-L1109 PolarHBondContact O-N 2.76Å; K1106-M1173 HydrophobicContact CB-CB 4.31Å; K1106-M1173 HydrophobicContact CB-CG 4.47Å; K1106-M1173 HydrophobicContact CB-SD 4.17Å; K1106-M1173 WeakPolarHBondContact CD-O 3.45Å; K1106-M1173 WeakPolarHBondContact CE-O 3.49Å; K1106-M1173 HydrophobicContact CG-CB 4.35Å; K1106-M1173 PolarHBondContact NZ-O 3.44Å
1107	N	92.4	Very high	90	Very high	112 Å²	112	52.3 Å²	52.3	60%	0.599	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.2	178.6	-62.9	-21.8	0	0	0	113.4	R1104 M1105 V1110	R1104-N1107 WeakPolarHBondContact O-CB 3.28Å; R1104-N1107 PolarHBondContact O-N 2.94Å; M1105-N1107 PolarHBondContact O-N 2.82Å; N1107-V1110 WeakPolarHBondContact O-CG1 3.42Å
1108	F	93.6	Very high	89.5	Confident	51 Å²	51	53.3 Å²	53.3	22%	0.224	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-15.5	173.6	-56.2	-43.2	0	0	0	113.2	L939 G943 L946 Q947 M1105 K1106 V1110	L939-F1108 HydrophobicContact CD1-CE2 3.79Å; L939-F1108 HydrophobicContact CD1-CZ 4.35Å; L939-F1108 HydrophobicContact CG-CE2 4.09Å; L939-F1108 HydrophobicContact CG-CZ 4.22Å; G943-F1108 VanDerWaalsContact CA-CD2 3.49Å; L946-F1108 HydrophobicContact CD1-CB 4.2Å; L946-F1108 HydrophobicContact CD1-CD2 4.24Å; Q947-F1108 HydrophobicContact CG-CB 4.37Å; M1105-F1108 WeakPolarHBondContact O-CB 3.42Å; M1105-F1108 PolarHBondContact O-N 2.93Å; K1106-F1108 PolarHBondContact O-N 3.18Å; F1108-V1110 VanDerWaalsContact C-N 3.35Å; F1108-V1110 PolarHBondContact O-N 3.48Å; F1108-V1110 VanDerWaalsContact O-N 3.1Å
1109	L	92	Very high	88.9	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	33%	0.329	C	S	.	.			trans	-87.7	67	-176.4	-52.1	178	0	0	0	111.3	L946 K1106 W1114 F1115 L1170 M1173 L1174	L946-L1109 HydrophobicContact CD1-CD2 4.13Å; L946-L1109 HydrophobicContact CD2-CD2 3.91Å; L946-L1109 HydrophobicContact CG-CD2 4.46Å; K1106-L1109 WeakPolarHBondContact O-CB 3.36Å; K1106-L1109 PolarHBondContact O-N 2.76Å; L1109-W1114 HydrophobicContact CB-CG 4.25Å; L1109-W1114 HydrophobicContact CD2-CD2 4.14Å; L1109-W1114 HydrophobicContact CD2-CE3 4.44Å; L1109-W1114 HydrophobicContact CD2-CH2 4.22Å; L1109-W1114 HydrophobicContact CD2-CZ2 3.91Å; L1109-W1114 HydrophobicContact CD2-CZ3 4.47Å; L1109-F1115 WeakPolarHBondContact O-CE2 3.26Å; L1109-F1115 WeakPolarHBondContact O-CZ 3.38Å; L1109-L1170 HydrophobicContact CD1-CD2 3.78Å; L1109-L1170 HydrophobicContact CD2-CD2 3.62Å; L1109-L1170 HydrophobicContact CG-CD2 4.34Å; L1109-M1173 HydrophobicContact CD1-CB 4.26Å; L1109-M1173 HydrophobicContact CD1-CE 4.3Å; L1109-L1174 HydrophobicContact CB-CD2 4.14Å; L1109-L1174 HydrophobicContact CD1-CD2 3.87Å; L1109-L1174 HydrophobicContact CD1-CG 4.01Å
1110	V	89.5	Confident	88.7	Confident	109 Å²	109	57.3 Å²	57.3	66%	0.661	33%	0.326	S	S	*	.			trans	-102.1	-19.8	-175.4	-65.4	0	0	0	0	114.6	N1107 F1108	N1107-V1110 WeakPolarHBondContact O-CG1 3.42Å; F1108-V1110 VanDerWaalsContact C-N 3.35Å; F1108-V1110 PolarHBondContact O-N 3.48Å; F1108-V1110 VanDerWaalsContact O-N 3.1Å
1111	D	91.7	Very high	88.3	Confident	33 Å²	33	59 Å²	59	18%	0.176	34%	0.337	C	S	.	.	S	Bend	trans	-66.3	139.6	-176.9	-170.8	-69	0	0	0	111.8	L951 R955 I1113 W1114	L951-D1111 HydrophobicContact CD1-CB 3.95Å; L951-D1111 HydrophobicContact CD2-CB 4.17Å; R955-D1111 IonicContact CZ-OD2 2.76Å; R955-D1111 IonicContact NE-OD2 3.42Å; R955-D1111 IonicContact NH2-OD2 3.17Å; R955-D1111 PolarHBondContact NH2-OD2 3.01Å; D1111-I1113 HydrophobicContact CB-CG2 4.2Å; D1111-I1113 PolarHBondContact O-N 3.2Å; D1111-I1113 WeakPolarHBondContact OD1-CB 3.38Å; D1111-I1113 WeakPolarHBondContact OD1-CG2 3.46Å; D1111-I1113 PolarHBondContact OD1-N 3.19Å; D1111-W1114 PolarHBondContact O-N 3.05Å; D1111-W1114 VanDerWaalsContact O-N 3.08Å
1112	P	88.9	Confident	88.1	Confident	76 Å²	76	61.7 Å²	61.7	49%	0.494	35%	0.351	S	S	.	.	H	α-helix	trans	-55.3	-23	178.6	-27.2	34.9	0	0	0	115	W1114 F1115 G1116	P1112-W1114 PolarHBondContact O-N 3.34Å; P1112-W1114 VanDerWaalsContact O-N 3.14Å; P1112-F1115 PolarHBondContact O-N 3.25Å; P1112-G1116 CarbonylContact O-C 3.51Å; P1112-G1116 WeakPolarHBondContact O-CA 3.44Å; P1112-G1116 PolarHBondContact O-N 3.37Å
1113	I	90.1	Very high	87.6	Confident	16 Å²	16	65.2 Å²	65.2	8%	0.082	38%	0.376	C	S	.	.	H	α-helix	trans	-58.8	-24.7	177.1	-157.2	166.6	0	0	0	113	L951 L954 R955 I958 D1111 L1136	L951-I1113 HydrophobicContact CD1-CG2 3.48Å; L951-I1113 VanDerWaalsContact CD1-CG2 3.48Å; L954-I1113 HydrophobicContact CB-CD1 3.95Å; R955-I1113 HydrophobicContact CG-CD1 4.12Å; I958-I1113 HydrophobicContact CB-CD1 4.4Å; I958-I1113 HydrophobicContact CD1-CD1 4.32Å; I958-I1113 HydrophobicContact CD1-CG1 4.03Å; I958-I1113 HydrophobicContact CG2-CD1 4.14Å; D1111-I1113 HydrophobicContact CB-CG2 4.2Å; D1111-I1113 PolarHBondContact O-N 3.2Å; D1111-I1113 WeakPolarHBondContact OD1-CB 3.38Å; D1111-I1113 WeakPolarHBondContact OD1-CG2 3.46Å; D1111-I1113 PolarHBondContact OD1-N 3.19Å; I1113-L1136 HydrophobicContact CD1-CD1 4.48Å; I1113-L1136 HydrophobicContact CG1-CD1 4.25Å
1114	W	91.5	Very high	87.4	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.015	38%	0.377	C	S	.	.	H	α-helix	trans	-75.4	-39.8	-178.7	-57.5	116.4	0	0	0	112	I950 L951 L954 L1109 D1111 P1112 F1133 L1170 L1174 Q1176	I950-W1114 HydrophobicContact CG2-CH2 3.99Å; L951-W1114 HydrophobicContact CD1-CZ2 4.42Å; L954-W1114 HydrophobicContact CD1-CE3 4.31Å; L954-W1114 HydrophobicContact CD1-CH2 3.41Å; L954-W1114 VanDerWaalsContact CD1-CH2 3.41Å; L954-W1114 HydrophobicContact CD1-CZ2 4.27Å; L954-W1114 HydrophobicContact CD1-CZ3 3.44Å; L954-W1114 VanDerWaalsContact CD1-CZ3 3.44Å; L1109-W1114 HydrophobicContact CB-CG 4.25Å; L1109-W1114 HydrophobicContact CD2-CD2 4.14Å; L1109-W1114 HydrophobicContact CD2-CE3 4.44Å; L1109-W1114 HydrophobicContact CD2-CH2 4.22Å; L1109-W1114 HydrophobicContact CD2-CZ2 3.91Å; L1109-W1114 HydrophobicContact CD2-CZ3 4.47Å; D1111-W1114 PolarHBondContact O-N 3.05Å; D1111-W1114 VanDerWaalsContact O-N 3.08Å; P1112-W1114 PolarHBondContact O-N 3.34Å; P1112-W1114 VanDerWaalsContact O-N 3.14Å; W1114-F1133 HydrophobicContact CE3-CB 4.01Å; W1114-F1133 AromaticContact CE3-CD2 3.72Å; W1114-F1133 HydrophobicContact CE3-CD2 3.72Å; W1114-F1133 HydrophobicContact CE3-CE2 4.43Å; W1114-F1133 AromaticContact CE3-CG 3.9Å; W1114-F1133 HydrophobicContact CE3-CG 3.9Å; W1114-F1133 AromaticContact CZ3-CD2 3.47Å; W1114-F1133 HydrophobicContact CZ3-CD2 3.47Å; W1114-F1133 VanDerWaalsContact CZ3-CD2 3.47Å; W1114-F1133 AromaticContact CZ3-CE2 3.75Å; W1114-F1133 HydrophobicContact CZ3-CE2 3.75Å; W1114-F1133 HydrophobicContact CZ3-CG 4.04Å; W1114-F1133 PolarHBondContact O-N 3.45Å; W1114-L1170 HydrophobicContact CH2-CD1 4.42Å; W1114-L1170 HydrophobicContact CZ3-CD1 4.13Å; W1114-L1170 HydrophobicContact CZ3-CD2 4.46Å; W1114-L1174 HydrophobicContact CB-CD1 4.02Å; W1114-L1174 HydrophobicContact CB-CD2 3.88Å; W1114-L1174 HydrophobicContact CE3-CD1 4.09Å; W1114-Q1176 PolarHBondContact O-NE2 3.39Å
1115	F	88.3	Confident	87.1	Confident	97 Å²	97	63 Å²	63	43%	0.425	37%	0.369	S	S	.	.	H	α-helix	trans	-108.3	-15.6	-171.6	-50.4	-81.6	0	0	0	114.4	L1109 P1112 L1174	L1109-F1115 WeakPolarHBondContact O-CE2 3.26Å; L1109-F1115 WeakPolarHBondContact O-CZ 3.38Å; P1112-F1115 PolarHBondContact O-N 3.25Å; F1115-L1174 HydrophobicContact CD1-CD2 4.05Å; F1115-L1174 HydrophobicContact CE1-CD2 3.36Å; F1115-L1174 HydrophobicContact CE2-CD2 4.38Å; F1115-L1174 HydrophobicContact CZ-CD2 3.56Å
1116	G	83.9	Confident	86.8	Confident	15 Å²	15	63.4 Å²	63.4	16%	0.155	37%	0.371	C	S	.	.			trans	96.5	138.7	-169.6	0	0	0	0	0	112.2	P1112 S1118 A1131	P1112-G1116 CarbonylContact O-C 3.51Å; P1112-G1116 WeakPolarHBondContact O-CA 3.44Å; P1112-G1116 PolarHBondContact O-N 3.37Å; G1116-S1118 VanDerWaalsContact C-N 3.32Å; G1116-S1118 PolarHBondContact O-N 3.06Å; G1116-A1131 VanDerWaalsContact CA-O 3.27Å; G1116-A1131 WeakPolarHBondContact CA-O 3.37Å; G1116-A1131 PolarHBondContact N-O 3.1Å
1117	S	79.1	Confident	86.6	Confident	113 Å²	113	62.2 Å²	62.2	79%	0.79	37%	0.369	S	S	*	.	S	Bend	trans	-78.3	-12.8	-175.9	53.5	0	0	0	0	114.7
1118	S	79.3	Confident	86.4	Confident	65 Å²	65	59.2 Å²	59.2	46%	0.455	35%	0.353	S	S	.	.	S	Bend	trans	-125.1	168.7	179.2	46	0	0	0	0	110.3	G1116 Y1126	G1116-S1118 VanDerWaalsContact C-N 3.32Å; G1116-S1118 PolarHBondContact O-N 3.06Å; S1118-Y1126 PolarHBondContact O-OH 3.4Å; S1118-Y1126 PolarHBondContact OG-OH 3.25Å
1119	P	79.4	Confident	86.2	Confident	106 Å²	106	58.6 Å²	58.6	69%	0.688	35%	0.35	S	S	*	.			trans	-74.8	154.8	159.3	28.6	-31.6	0	0	0	110.8	Y1126	P1119-Y1126 PolarHBondContact O-OH 3.27Å
1120	P	83.4	Confident	86	Confident	26 Å²	26	58.7 Å²	58.7	17%	0.169	35%	0.351	C	S	.	.			trans	-64	143.9	177.9	27.5	-34.5	0	0	0	111.4	N1122 S1123 M1125 Y1126	P1120-N1122 PolarHBondContact O-N 3.29Å; P1120-S1123 WeakPolarHBondContact O-CA 3.18Å; P1120-S1123 PolarHBondContact O-N 3.12Å; P1120-M1125 VanDerWaalsContact CB-C 3.44Å; P1120-Y1126 HydrophobicContact CB-CD1 3.99Å; P1120-Y1126 HydrophobicContact CB-CD2 4.25Å; P1120-Y1126 HydrophobicContact CB-CE1 4.09Å; P1120-Y1126 HydrophobicContact CB-CE2 4.31Å; P1120-Y1126 HydrophobicContact CB-CG 4.13Å
1121	T	82.6	Confident	85.9	Confident	117 Å²	117	54.5 Å²	54.5	72%	0.718	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.4	-176.7	49.1	0	0	0	0	113	S1123 E1129	T1121-S1123 VanDerWaalsContact C-N 3.35Å; T1121-E1129 PolarHBondContact OG1-OE1 3.06Å
1122	N	85.8	Confident	85.9	Confident	66 Å²	66	53.5 Å²	53.5	35%	0.353	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	1.7	176.1	63.2	16	0	0	0	114	P1120 V1124 M1125	P1120-N1122 PolarHBondContact O-N 3.29Å; N1122-V1124 PolarHBondContact O-N 2.87Å; N1122-V1124 VanDerWaalsContact O-N 3.1Å; N1122-V1124 PolarHBondContact OD1-N 3.44Å; N1122-M1125 VanDerWaalsContact CG-O 3.31Å; N1122-M1125 PolarHBondContact ND2-O 3.47Å; N1122-M1125 PolarHBondContact OD1-N 3.4Å; N1122-M1125 PolarHBondContact OD1-O 3.38Å
1123	S	80.8	Confident	86.1	Confident	75 Å²	75	50.1 Å²	50.1	52%	0.524	30%	0.3	S	S	.	.	S	Bend	trans	58.3	13.6	-174.2	-55.1	0	0	0	0	115.8	P1120 T1121	P1120-S1123 WeakPolarHBondContact O-CA 3.18Å; P1120-S1123 PolarHBondContact O-N 3.12Å; T1121-S1123 VanDerWaalsContact C-N 3.35Å
1124	V	85.5	Confident	86.3	Confident	82 Å²	82	49.4 Å²	49.4	50%	0.497	30%	0.296	S	S	.	.	S	Bend	trans	-116.8	-62.2	179.5	-177.2	0	0	0	0	110.6	N1122 F1250	N1122-V1124 PolarHBondContact O-N 2.87Å; N1122-V1124 VanDerWaalsContact O-N 3.1Å; N1122-V1124 PolarHBondContact OD1-N 3.44Å; V1124-F1250 HydrophobicContact CB-CZ 4.31Å; V1124-F1250 HydrophobicContact CG1-CZ 4.22Å; V1124-F1250 HydrophobicContact CG2-CE1 3.88Å; V1124-F1250 HydrophobicContact CG2-CE2 4.43Å; V1124-F1250 HydrophobicContact CG2-CZ 3.71Å
1125	M	87.3	Confident	86.5	Confident	56 Å²	56	49.3 Å²	49.3	28%	0.276	30%	0.296	S	S	.	.			trans	-162.6	152.4	-177.4	61	176.8	-80.3	0	0	111.2	P1120 N1122 I1127 R1179	P1120-M1125 VanDerWaalsContact CB-C 3.44Å; N1122-M1125 VanDerWaalsContact CG-O 3.31Å; N1122-M1125 PolarHBondContact ND2-O 3.47Å; N1122-M1125 PolarHBondContact OD1-N 3.4Å; N1122-M1125 PolarHBondContact OD1-O 3.38Å; M1125-I1127 HydrophobicContact CE-CG1 4.47Å; M1125-I1127 HydrophobicContact CG-CG1 4.3Å; M1125-R1179 HydrophobicContact CE-CB 4.39Å; M1125-R1179 HydrophobicContact CE-CG 3.86Å
1126	Y	86.5	Confident	86.7	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.039	28%	0.276	C	S	.	.			trans	-66.3	132.9	168.4	-68.3	-68.6	0	0	0	111	S1118 P1119 P1120 E1129 A1131 E1132	S1118-Y1126 PolarHBondContact O-OH 3.4Å; S1118-Y1126 PolarHBondContact OG-OH 3.25Å; P1119-Y1126 PolarHBondContact O-OH 3.27Å; P1120-Y1126 HydrophobicContact CB-CD1 3.99Å; P1120-Y1126 HydrophobicContact CB-CD2 4.25Å; P1120-Y1126 HydrophobicContact CB-CE1 4.09Å; P1120-Y1126 HydrophobicContact CB-CE2 4.31Å; P1120-Y1126 HydrophobicContact CB-CG 4.13Å; Y1126-E1129 HydrophobicContact CD1-CB 3.68Å; Y1126-E1129 HydrophobicContact CD1-CG 4.04Å; Y1126-E1129 HydrophobicContact CE1-CB 4.24Å; Y1126-E1129 HydrophobicContact CE1-CG 4.43Å; Y1126-A1131 HydrophobicContact CD1-CB 4.3Å; Y1126-A1131 HydrophobicContact CE1-CB 4.06Å; Y1126-A1131 HydrophobicContact CE2-CB 4.39Å; Y1126-A1131 HydrophobicContact CG-CB 4.49Å; Y1126-E1132 HydrophobicContact CD2-CG 3.74Å; Y1126-E1132 HydrophobicContact CE2-CG 4.36Å
1127	I	86.6	Confident	87.3	Confident	73 Å²	73	44 Å²	44	37%	0.374	27%	0.269	S	S	.	.	S	Bend	trans	-117.3	-64.5	179.8	-59.6	176.8	0	0	0	109.5	M1125 E1129	M1125-I1127 HydrophobicContact CE-CG1 4.47Å; M1125-I1127 HydrophobicContact CG-CG1 4.3Å; I1127-E1129 PolarHBondContact N-OE2 3.32Å
1128	D	88.2	Confident	88.1	Confident	49 Å²	49	38.7 Å²	38.7	26%	0.262	23%	0.231	S	C	.	.	S	Bend	trans	-92.5	-26.4	-177.4	-67.4	-30.5	0	0	0	111.4	V964 C965 K966 R1135	V964-D1128 CarbonylContact C-O 3.52Å; V964-D1128 WeakPolarHBondContact CA-O 3.35Å; V964-D1128 HydrophobicContact CG1-CB 3.66Å; C965-D1128 PolarHBondContact N-O 2.96Å; K966-D1128 HydrophobicContact CG-CB 4.29Å; D1128-R1135 PolarHBondContact O-NH2 2.95Å
1129	E	89.1	Confident	88.8	Confident	37 Å²	37	35.6 Å²	35.6	17%	0.173	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-69	130.2	-178	-55.1	89.4	159.1	0	0	111.7	K963 T1121 Y1126 I1127 A1131	K963-E1129 WeakPolarHBondContact O-CA 3.44Å; T1121-E1129 PolarHBondContact OG1-OE1 3.06Å; Y1126-E1129 HydrophobicContact CD1-CB 3.68Å; Y1126-E1129 HydrophobicContact CD1-CG 4.04Å; Y1126-E1129 HydrophobicContact CE1-CB 4.24Å; Y1126-E1129 HydrophobicContact CE1-CG 4.43Å; I1127-E1129 PolarHBondContact N-OE2 3.32Å; E1129-A1131 HydrophobicContact CB-CB 4.42Å; E1129-A1131 PolarHBondContact O-N 2.79Å; E1129-A1131 VanDerWaalsContact O-N 3.15Å
1130	C	89.6	Confident	89.5	Confident	7 Å²	7	30.6 Å²	30.6	5%	0.047	18%	0.177	C	C	.	.			trans	-89.2	53.8	175.7	-61.1	0	0	0	0	111	V961 P962 K963 R1135	V961-C1130 HydrophobicContact CG1-CB 3.89Å; P962-C1130 VanDerWaalsContact O-CB 3.25Å; P962-C1130 WeakPolarHBondContact O-CB 3.36Å; P962-C1130 PolarHBondContact O-SG 3.24Å; K963-C1130 PolarHBondContact O-N 2.89Å; C1130-R1135 HydrophobicContact CB-CB 4.22Å
1131	A	86.5	Confident	90.1	Very high	21 Å²	21	29.4 Å²	29.4	17%	0.174	17%	0.169	C	C	.	.			trans	-98.7	-19.5	-172.5	0	0	0	0	0	114.4	G1116 Y1126 E1129	G1116-A1131 VanDerWaalsContact CA-O 3.27Å; G1116-A1131 WeakPolarHBondContact CA-O 3.37Å; G1116-A1131 PolarHBondContact N-O 3.1Å; Y1126-A1131 HydrophobicContact CD1-CB 4.3Å; Y1126-A1131 HydrophobicContact CE1-CB 4.06Å; Y1126-A1131 HydrophobicContact CE2-CB 4.39Å; Y1126-A1131 HydrophobicContact CG-CB 4.49Å; E1129-A1131 HydrophobicContact CB-CB 4.42Å; E1129-A1131 PolarHBondContact O-N 2.79Å; E1129-A1131 VanDerWaalsContact O-N 3.15Å
1132	E	91.5	Very high	90.7	Very high	13 Å²	13	23.8 Å²	23.8	6%	0.061	14%	0.135	C	C	.	.	S	Bend	trans	-102	154.4	-179.1	-65.4	-168	150.5	0	0	112.3	Y1126 H1134 R1135 L1136 R1179	Y1126-E1132 HydrophobicContact CD2-CG 3.74Å; Y1126-E1132 HydrophobicContact CE2-CG 4.36Å; E1132-H1134 VanDerWaalsContact C-N 3.28Å; E1132-H1134 PolarHBondContact O-N 3.47Å; E1132-H1134 IonicContact OE2-CD2 3.94Å; E1132-H1134 PolarHBondContact OE2-CD2 2.97Å; E1132-H1134 IonicContact OE2-NE2 3.73Å; E1132-H1134 PolarHBondContact OE2-NE2 3.21Å; E1132-R1135 WeakPolarHBondContact O-CB 3.49Å; E1132-R1135 PolarHBondContact O-N 2.93Å; E1132-L1136 PolarHBondContact O-N 3.41Å; E1132-R1179 IonicContact OE1-CZ 2.68Å; E1132-R1179 IonicContact OE1-NE 2.76Å; E1132-R1179 PolarHBondContact OE1-NE 3.26Å; E1132-R1179 IonicContact OE1-NH2 2.65Å; E1132-R1179 PolarHBondContact OE1-NH2 2.97Å; E1132-R1179 IonicContact OE2-CZ 2.65Å; E1132-R1179 IonicContact OE2-NE 3.6Å; E1132-R1179 PolarHBondContact OE2-NE 3.17Å; E1132-R1179 IonicContact OE2-NH2 2.99Å; E1132-R1179 PolarHBondContact OE2-NH2 2.95Å; E1132-R1179 VanDerWaalsContact OE2-NH2 3.17Å
1133	F	94.5	Very high	91	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-52.5	-42.6	179.3	172.4	-103.3	0	0	0	113.1	L954 W1114 R1135 L1136 W1137 L1170 V1171 L1174	L954-F1133 HydrophobicContact CD1-CD2 3.89Å; L954-F1133 HydrophobicContact CD1-CE2 3.83Å; L954-F1133 HydrophobicContact CD2-CD2 4.35Å; L954-F1133 HydrophobicContact CD2-CE2 4.12Å; W1114-F1133 HydrophobicContact CE3-CB 4.01Å; W1114-F1133 AromaticContact CE3-CD2 3.72Å; W1114-F1133 HydrophobicContact CE3-CD2 3.72Å; W1114-F1133 HydrophobicContact CE3-CE2 4.43Å; W1114-F1133 AromaticContact CE3-CG 3.9Å; W1114-F1133 HydrophobicContact CE3-CG 3.9Å; W1114-F1133 AromaticContact CZ3-CD2 3.47Å; W1114-F1133 HydrophobicContact CZ3-CD2 3.47Å; W1114-F1133 VanDerWaalsContact CZ3-CD2 3.47Å; W1114-F1133 AromaticContact CZ3-CE2 3.75Å; W1114-F1133 HydrophobicContact CZ3-CE2 3.75Å; W1114-F1133 HydrophobicContact CZ3-CG 4.04Å; W1114-F1133 PolarHBondContact O-N 3.45Å; F1133-R1135 PolarHBondContact O-N 2.75Å; F1133-R1135 VanDerWaalsContact O-N 3.1Å; F1133-L1136 CarbonylContact O-C 3.57Å; F1133-L1136 WeakPolarHBondContact O-CA 3.38Å; F1133-L1136 WeakPolarHBondContact O-CB 3.23Å; F1133-L1136 PolarHBondContact O-N 3.14Å; F1133-W1137 HydrophobicContact CE1-CB 4.18Å; F1133-W1137 HydrophobicContact CZ-CB 4.27Å; F1133-W1137 HydrophobicContact CZ-CE3 4.17Å; F1133-W1137 PolarHBondContact O-N 2.95Å; F1133-L1170 HydrophobicContact CD1-CB 3.96Å; F1133-L1170 HydrophobicContact CE1-CB 3.35Å; F1133-L1170 HydrophobicContact CE1-CD1 4.11Å; F1133-L1170 HydrophobicContact CE1-CG 4.37Å; F1133-L1170 HydrophobicContact CE2-CD1 4.12Å; F1133-L1170 HydrophobicContact CZ-CB 3.78Å; F1133-L1170 HydrophobicContact CZ-CD1 3.6Å; F1133-L1170 HydrophobicContact CZ-CG 4.34Å; F1133-V1171 HydrophobicContact CD1-CG2 3.94Å; F1133-V1171 HydrophobicContact CE1-CG2 3.82Å; F1133-L1174 HydrophobicContact CB-CD1 3.76Å; F1133-L1174 HydrophobicContact CD1-CD1 4.04Å; F1133-L1174 HydrophobicContact CG-CD1 4.12Å
1134	H	94.2	Very high	91.6	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-61.1	-24.6	-178.3	80.9	81.5	0	0	0	113.7	E1132 S1138 V1171 Q1176 F1180 V1183	E1132-H1134 VanDerWaalsContact C-N 3.28Å; E1132-H1134 PolarHBondContact O-N 3.47Å; E1132-H1134 IonicContact OE2-CD2 3.94Å; E1132-H1134 PolarHBondContact OE2-CD2 2.97Å; E1132-H1134 IonicContact OE2-NE2 3.73Å; E1132-H1134 PolarHBondContact OE2-NE2 3.21Å; H1134-S1138 PolarHBondContact O-N 3.43Å; H1134-S1138 PolarHBondContact O-OG 3.43Å; H1134-S1138 VanDerWaalsContact O-OG 3.05Å; H1134-V1171 HydrophobicContact CB-CG1 4.45Å; H1134-V1171 HydrophobicContact CB-CG2 3.97Å; H1134-Q1176 HydrophobicContact CB-CB 3.97Å; H1134-F1180 HydrophobicContact CB-CB 3.9Å; H1134-F1180 HydrophobicContact CB-CD2 4.08Å; H1134-F1180 HydrophobicContact CB-CG 4.39Å; H1134-V1183 WeakPolarHBondContact CE1-CG2 3.46Å
1135	R	93.8	Very high	91.9	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-75.5	-38	174.1	-65.9	-71.5	-72.6	173.8	-10	111.6	C965 D1128 C1130 E1132 F1133 W1137 S1138 A1139 V1183	C965-R1135 PolarHBondContact O-NH2 3.42Å; D1128-R1135 PolarHBondContact O-NH2 2.95Å; C1130-R1135 HydrophobicContact CB-CB 4.22Å; E1132-R1135 WeakPolarHBondContact O-CB 3.49Å; E1132-R1135 PolarHBondContact O-N 2.93Å; F1133-R1135 PolarHBondContact O-N 2.75Å; F1133-R1135 VanDerWaalsContact O-N 3.1Å; R1135-W1137 VanDerWaalsContact C-N 3.3Å; R1135-S1138 WeakPolarHBondContact O-CB 3.44Å; R1135-S1138 PolarHBondContact O-N 3.46Å; R1135-A1139 PolarHBondContact O-N 3.48Å; R1135-V1183 PolarHBondContact NH1-O 2.82Å
1136	L	94	Very high	92.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-64	-40.9	170.8	-54.6	-179	0	0	0	110.2	L954 V957 I958 V961 I1113 E1132 F1133 A1139 L1140	L954-L1136 HydrophobicContact CD2-CB 4.34Å; L954-L1136 HydrophobicContact CD2-CD1 4.12Å; V957-L1136 HydrophobicContact CG1-CD2 4.5Å; I958-L1136 HydrophobicContact CB-CD1 4.39Å; I958-L1136 HydrophobicContact CB-CD2 4.18Å; I958-L1136 HydrophobicContact CG1-CD2 4.17Å; V961-L1136 HydrophobicContact CB-CD2 4.35Å; V961-L1136 HydrophobicContact CG1-CD2 4.46Å; V961-L1136 HydrophobicContact CG2-CD2 4.27Å; I1113-L1136 HydrophobicContact CD1-CD1 4.48Å; I1113-L1136 HydrophobicContact CG1-CD1 4.25Å; E1132-L1136 PolarHBondContact O-N 3.41Å; F1133-L1136 CarbonylContact O-C 3.57Å; F1133-L1136 WeakPolarHBondContact O-CA 3.38Å; F1133-L1136 WeakPolarHBondContact O-CB 3.23Å; F1133-L1136 PolarHBondContact O-N 3.14Å; L1136-A1139 WeakPolarHBondContact O-CB 3.08Å; L1136-A1139 PolarHBondContact O-N 3.02Å; L1136-L1140 WeakPolarHBondContact O-CG 3.2Å; L1136-L1140 PolarHBondContact O-N 3.2Å
1137	W	95.5	Very high	92.2	Very high	1 Å²	1	13 Å²	13	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-63.8	-40.5	173.4	-169.3	-109.6	0	0	0	112.3	F1133 R1135 A1139 L1140 Q1141 F1144 L1163 F1180	F1133-W1137 HydrophobicContact CE1-CB 4.18Å; F1133-W1137 HydrophobicContact CZ-CB 4.27Å; F1133-W1137 HydrophobicContact CZ-CE3 4.17Å; F1133-W1137 PolarHBondContact O-N 2.95Å; R1135-W1137 VanDerWaalsContact C-N 3.3Å; W1137-A1139 VanDerWaalsContact C-N 3.28Å; W1137-A1139 PolarHBondContact O-N 3.45Å; W1137-L1140 HydrophobicContact CE3-CB 4.37Å; W1137-L1140 HydrophobicContact CE3-CD1 3.9Å; W1137-L1140 HydrophobicContact CZ3-CD1 4.16Å; W1137-L1140 PolarHBondContact O-N 3.02Å; W1137-Q1141 WeakPolarHBondContact O-CB 3.43Å; W1137-Q1141 PolarHBondContact O-N 3.17Å; W1137-F1144 HydrophobicContact CH2-CE1 4.11Å; W1137-F1144 AromaticContact CZ2-CE1 3.83Å; W1137-F1144 HydrophobicContact CZ2-CE1 3.83Å; W1137-F1144 HydrophobicContact CZ2-CZ 4.04Å; W1137-L1163 HydrophobicContact CH2-CD1 3.85Å; W1137-L1163 HydrophobicContact CH2-CG 4.15Å; W1137-L1163 WeakPolarHBondContact CH2-O 3.48Å; W1137-L1163 HydrophobicContact CZ3-CD1 4.41Å; W1137-F1180 AromaticContact CD1-CE2 3.73Å; W1137-F1180 AromaticContact CD1-CZ 3.89Å
1138	S	95.4	Very high	92.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59	-37.9	172	-69.6	0	0	0	0	112.9	H1134 R1135 Q1141 F1142 F1180 D1184	H1134-S1138 PolarHBondContact O-N 3.43Å; H1134-S1138 PolarHBondContact O-OG 3.43Å; H1134-S1138 VanDerWaalsContact O-OG 3.05Å; R1135-S1138 WeakPolarHBondContact O-CB 3.44Å; R1135-S1138 PolarHBondContact O-N 3.46Å; S1138-Q1141 PolarHBondContact O-N 3.39Å; S1138-F1142 PolarHBondContact O-N 2.96Å; S1138-F1180 WeakPolarHBondContact OG-CE2 3.49Å; S1138-D1184 VanDerWaalsContact CA-OD2 3.28Å; S1138-D1184 WeakPolarHBondContact CA-OD2 3.34Å; S1138-D1184 WeakPolarHBondContact CB-OD2 3.38Å; S1138-D1184 WeakPolarHBondContact OG-CA 3.25Å; S1138-D1184 PolarHBondContact OG-OD2 3.18Å
1139	A	94.4	Very high	91.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-43.1	175	0	0	0	0	0	111.8	V961 L985 L988 R1135 L1136 W1137 F1142 V1143 F1185	V961-A1139 HydrophobicContact CG1-CB 4.49Å; V961-A1139 HydrophobicContact CG2-CB 3.78Å; L985-A1139 HydrophobicContact CD1-CB 4.17Å; L985-A1139 HydrophobicContact CD2-CB 3.8Å; L988-A1139 HydrophobicContact CD2-CB 3.86Å; R1135-A1139 PolarHBondContact O-N 3.48Å; L1136-A1139 WeakPolarHBondContact O-CB 3.08Å; L1136-A1139 PolarHBondContact O-N 3.02Å; W1137-A1139 VanDerWaalsContact C-N 3.28Å; W1137-A1139 PolarHBondContact O-N 3.45Å; A1139-F1142 WeakPolarHBondContact O-CB 3.42Å; A1139-F1142 PolarHBondContact O-N 3.48Å; A1139-V1143 PolarHBondContact O-N 2.97Å; A1139-F1185 HydrophobicContact CB-CE2 4.13Å
1140	L	94.9	Very high	90.7	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-65.9	-39	175.1	-66.8	169	0	0	0	111.9	L988 I998 F999 L1136 W1137 F1142 V1143 F1144	L988-L1140 HydrophobicContact CD2-CD2 4.26Å; I998-L1140 HydrophobicContact CD1-CD1 3.7Å; I998-L1140 HydrophobicContact CD1-CD2 4.45Å; I998-L1140 HydrophobicContact CG2-CD2 4.06Å; F999-L1140 HydrophobicContact CE1-CB 4.26Å; F999-L1140 HydrophobicContact CE1-CD2 3.97Å; F999-L1140 HydrophobicContact CZ-CD2 4.44Å; L1136-L1140 WeakPolarHBondContact O-CG 3.2Å; L1136-L1140 PolarHBondContact O-N 3.2Å; W1137-L1140 HydrophobicContact CE3-CB 4.37Å; W1137-L1140 HydrophobicContact CE3-CD1 3.9Å; W1137-L1140 HydrophobicContact CZ3-CD1 4.16Å; W1137-L1140 PolarHBondContact O-N 3.02Å; L1140-F1142 VanDerWaalsContact C-N 3.31Å; L1140-F1142 PolarHBondContact O-N 3.26Å; L1140-V1143 WeakPolarHBondContact O-CB 3.17Å; L1140-V1143 PolarHBondContact O-N 3.39Å; L1140-V1143 VanDerWaalsContact O-N 3.1Å; L1140-F1144 WeakPolarHBondContact O-CD1 3.39Å; L1140-F1144 PolarHBondContact O-N 2.84Å
1141	Q	95.4	Very high	89.9	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-40.9	173.8	176.9	163.4	-78.6	0	0	112.1	W1137 S1138 V1143 F1144 C1145 D1184 C1186 N1222	W1137-Q1141 WeakPolarHBondContact O-CB 3.43Å; W1137-Q1141 PolarHBondContact O-N 3.17Å; S1138-Q1141 PolarHBondContact O-N 3.39Å; Q1141-V1143 VanDerWaalsContact C-N 3.29Å; Q1141-V1143 PolarHBondContact O-N 2.94Å; Q1141-F1144 HydrophobicContact CB-CE1 3.99Å; Q1141-F1144 HydrophobicContact CB-CE2 4Å; Q1141-F1144 HydrophobicContact CB-CZ 3.58Å; Q1141-F1144 HydrophobicContact CG-CE2 3.71Å; Q1141-F1144 HydrophobicContact CG-CZ 3.75Å; Q1141-F1144 PolarHBondContact O-N 3.44Å; Q1141-C1145 VanDerWaalsContact O-CB 3.3Å; Q1141-C1145 WeakPolarHBondContact O-CB 3.04Å; Q1141-C1145 PolarHBondContact O-N 3.4Å; Q1141-C1145 PolarHBondContact O-SG 3.33Å; Q1141-D1184 PolarHBondContact NE2-OD1 3.42Å; Q1141-D1184 PolarHBondContact NE2-OD2 3.1Å; Q1141-D1184 VanDerWaalsContact NE2-OD2 3.11Å; Q1141-C1186 HydrophobicContact CG-CB 4.33Å; Q1141-N1222 PolarHBondContact OE1-ND2 3.44Å
1142	F	94.8	Very high	89.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.2	-44.1	172.5	-171.6	-91.6	0	0	0	111.9	Y981 Y982 L985 S1138 A1139 L1140 C1145 I1146 C1186 I1205 M1211	Y981-F1142 HydrophobicContact CG-CE2 4.46Å; Y982-F1142 HydrophobicContact CD2-CE1 4.31Å; L985-F1142 HydrophobicContact CB-CD1 4.44Å; L985-F1142 HydrophobicContact CD1-CB 3.71Å; L985-F1142 HydrophobicContact CD1-CD1 3.72Å; L985-F1142 HydrophobicContact CD1-CG 3.74Å; S1138-F1142 PolarHBondContact O-N 2.96Å; A1139-F1142 WeakPolarHBondContact O-CB 3.42Å; A1139-F1142 PolarHBondContact O-N 3.48Å; L1140-F1142 VanDerWaalsContact C-N 3.31Å; L1140-F1142 PolarHBondContact O-N 3.26Å; F1142-C1145 PolarHBondContact O-N 2.76Å; F1142-I1146 HydrophobicContact CE1-CD1 4.49Å; F1142-I1146 WeakPolarHBondContact O-CG1 3.39Å; F1142-C1186 WeakPolarHBondContact CA-SG 3.34Å; F1142-I1205 HydrophobicContact CZ-CD1 4.23Å; F1142-M1211 HydrophobicContact CD2-CE 3.82Å; F1142-M1211 HydrophobicContact CE1-CE 4.48Å; F1142-M1211 HydrophobicContact CE2-CE 3.49Å; F1142-M1211 VanDerWaalsContact CE2-CE 3.49Å; F1142-M1211 HydrophobicContact CG-CE 4.45Å; F1142-M1211 HydrophobicContact CZ-CE 3.86Å
1143	V	92.9	Very high	89	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.055	19%	0.194	C	C	.	.	H	α-helix	trans	-60.4	-50.7	177.1	177.5	0	0	0	0	111.2	L988 V989 Q995 F999 A1139 L1140 Q1141 C1145 I1146	L988-V1143 HydrophobicContact CD2-CG2 4.04Å; L988-V1143 HydrophobicContact CG-CG2 4.06Å; V989-V1143 HydrophobicContact CG2-CG2 4.08Å; Q995-V1143 HydrophobicContact CG-CG1 4.21Å; F999-V1143 HydrophobicContact CZ-CG1 4.32Å; A1139-V1143 PolarHBondContact O-N 2.97Å; L1140-V1143 WeakPolarHBondContact O-CB 3.17Å; L1140-V1143 PolarHBondContact O-N 3.39Å; L1140-V1143 VanDerWaalsContact O-N 3.1Å; Q1141-V1143 VanDerWaalsContact C-N 3.29Å; Q1141-V1143 PolarHBondContact O-N 2.94Å; V1143-C1145 VanDerWaalsContact C-N 3.3Å; V1143-C1145 PolarHBondContact O-N 2.92Å; V1143-I1146 WeakPolarHBondContact O-CB 3.47Å; V1143-I1146 PolarHBondContact O-N 3.13Å
1144	F	92.3	Very high	88.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-78.9	-10.7	-175.1	64.1	-118.7	0	0	0	115.5	F999 W1137 L1140 Q1141 I1155 L1163 R1214 F1218	F999-F1144 HydrophobicContact CE1-CD1 4.31Å; F999-F1144 HydrophobicContact CZ-CD1 4.31Å; W1137-F1144 HydrophobicContact CH2-CE1 4.11Å; W1137-F1144 AromaticContact CZ2-CE1 3.83Å; W1137-F1144 HydrophobicContact CZ2-CE1 3.83Å; W1137-F1144 HydrophobicContact CZ2-CZ 4.04Å; L1140-F1144 WeakPolarHBondContact O-CD1 3.39Å; L1140-F1144 PolarHBondContact O-N 2.84Å; Q1141-F1144 HydrophobicContact CB-CE1 3.99Å; Q1141-F1144 HydrophobicContact CB-CE2 4Å; Q1141-F1144 HydrophobicContact CB-CZ 3.58Å; Q1141-F1144 HydrophobicContact CG-CE2 3.71Å; Q1141-F1144 HydrophobicContact CG-CZ 3.75Å; Q1141-F1144 PolarHBondContact O-N 3.44Å; F1144-I1155 HydrophobicContact CB-CB 4.4Å; F1144-I1155 HydrophobicContact CB-CD1 3.29Å; F1144-I1155 HydrophobicContact CB-CG1 4.41Å; F1144-I1155 HydrophobicContact CB-CG2 4.02Å; F1144-L1163 HydrophobicContact CD1-CD2 4.26Å; F1144-R1214 PolarHBondContact O-NH2 3.23Å; F1144-F1218 HydrophobicContact CD2-CD1 4.17Å; F1144-F1218 HydrophobicContact CD2-CD2 4.11Å; F1144-F1218 HydrophobicContact CD2-CE1 4.05Å; F1144-F1218 AromaticContact CD2-CE2 3.98Å; F1144-F1218 HydrophobicContact CD2-CE2 3.98Å; F1144-F1218 HydrophobicContact CD2-CG 4.22Å; F1144-F1218 AromaticContact CD2-CZ 3.96Å; F1144-F1218 HydrophobicContact CD2-CZ 3.96Å; F1144-F1218 HydrophobicContact CE2-CB 4.37Å; F1144-F1218 AromaticContact CE2-CD1 3.77Å; F1144-F1218 HydrophobicContact CE2-CD1 3.77Å; F1144-F1218 HydrophobicContact CE2-CD2 4.17Å; F1144-F1218 HydrophobicContact CE2-CE1 4.06Å; F1144-F1218 HydrophobicContact CE2-CE2 4.43Å; F1144-F1218 AromaticContact CE2-CG 3.84Å; F1144-F1218 HydrophobicContact CE2-CG 3.84Å; F1144-F1218 HydrophobicContact CE2-CZ 4.39Å
1145	C	93.5	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-81.9	-13.9	170	-70.8	0	0	0	0	113.3	Q1141 F1142 V1143 P1147 M1211 I1215	Q1141-C1145 VanDerWaalsContact O-CB 3.3Å; Q1141-C1145 WeakPolarHBondContact O-CB 3.04Å; Q1141-C1145 PolarHBondContact O-N 3.4Å; Q1141-C1145 PolarHBondContact O-SG 3.33Å; F1142-C1145 PolarHBondContact O-N 2.76Å; V1143-C1145 VanDerWaalsContact C-N 3.3Å; V1143-C1145 PolarHBondContact O-N 2.92Å; C1145-P1147 WeakPolarHBondContact O-CD 3.35Å; C1145-M1211 HydrophobicContact CB-CE 4.4Å; C1145-I1215 HydrophobicContact CB-CG1 3.76Å
1146	I	91.7	Very high	88.2	Confident	32 Å²	32	44.5 Å²	44.5	16%	0.164	22%	0.223	C	C	.	.	S	Bend	trans	-62.2	126.7	174.9	-62.7	172.7	0	0	0	108.7	V989 F1142 V1143 A1148	V989-I1146 HydrophobicContact CG1-CD1 4.01Å; V989-I1146 HydrophobicContact CG2-CD1 4.05Å; F1142-I1146 HydrophobicContact CE1-CD1 4.49Å; F1142-I1146 WeakPolarHBondContact O-CG1 3.39Å; V1143-I1146 WeakPolarHBondContact O-CB 3.47Å; V1143-I1146 PolarHBondContact O-N 3.13Å; I1146-A1148 PolarHBondContact O-N 3.37Å
1147	P	88	Confident	87.9	Confident	22 Å²	22	48.2 Å²	48.2	14%	0.143	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-58.6	132.4	177.2	-24.6	34.4	0	0	0	112.2	C1145 R1210 M1211	C1145-P1147 WeakPolarHBondContact O-CD 3.35Å; P1147-R1210 HydrophobicContact CB-CB 4.32Å; P1147-R1210 HydrophobicContact CG-CB 3.86Å; P1147-M1211 HydrophobicContact CG-CB 4.11Å
1148	A	83	Confident	87.6	Confident	45 Å²	45	49.1 Å²	49.1	37%	0.372	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-66.3	151.5	171.8	0	0	0	0	0	110.8	I1146 Q1152	I1146-A1148 PolarHBondContact O-N 3.37Å; A1148-Q1152 HydrophobicContact CB-CB 4.33Å
1149	R	79.5	Confident	87.4	Confident	194 Å²	194	50.2 Å²	50.2	73%	0.732	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-72.1	154.7	172.7	-62.1	-177.8	-178.8	-176.1	0.9	110.2	N1151 Q1152	R1149-N1151 PolarHBondContact O-N 2.92Å; R1149-Q1152 HydrophobicContact CB-CG 4.28Å; R1149-Q1152 PolarHBondContact O-N 3.07Å
1150	E	69.3	Low	87.4	Confident	155 Å²	155	50.4 Å²	50.4	72%	0.724	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	125.3	171.7	-70.2	175.1	-175.6	0	0	108.9
1151	N	73.7	Confident	87.4	Confident	171 Å²	171	52.2 Å²	52.2	91%	0.914	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	5.2	-172.6	-48.7	-33.8	0	0	0	118.1	R1149	R1149-N1151 PolarHBondContact O-N 2.92Å
1152	Q	78.3	Confident	87.4	Confident	113 Å²	113	52.1 Å²	52.1	53%	0.528	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-97	133.4	169.9	-70.8	-175.9	-25.8	0	0	111.2	A1148 R1149 S1154	A1148-Q1152 HydrophobicContact CB-CB 4.33Å; R1149-Q1152 HydrophobicContact CB-CG 4.28Å; R1149-Q1152 PolarHBondContact O-N 3.07Å; Q1152-S1154 PolarHBondContact O-N 3.1Å
1153	V	80.7	Confident	87.4	Confident	65 Å²	65	52.2 Å²	52.2	39%	0.394	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63.8	130.6	175.5	-174.1	0	0	0	0	108.7	V873 E1157	V873-V1153 HydrophobicContact CG2-CB 3.78Å; V873-V1153 HydrophobicContact CG2-CG1 3.55Å; V873-V1153 HydrophobicContact CG2-CG2 3.96Å; V1153-E1157 HydrophobicContact CG1-CB 3.44Å; V1153-E1157 VanDerWaalsContact CG1-CB 3.44Å; V1153-E1157 HydrophobicContact CG1-CG 4.44Å; V1153-E1157 WeakPolarHBondContact CG1-OE2 3.47Å
1154	S	87.2	Confident	87.6	Confident	17 Å²	17	52 Å²	52	12%	0.119	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-74.2	165.7	-178.3	69.9	0	0	0	0	111.8	Q1152 E1156 E1157 T1158	Q1152-S1154 PolarHBondContact O-N 3.1Å; S1154-E1156 VanDerWaalsContact C-N 3.31Å; S1154-E1156 VanDerWaalsContact CB-CD 3.41Å; S1154-E1156 WeakPolarHBondContact CB-OE1 3.5Å; S1154-E1156 PolarHBondContact O-N 3.09Å; S1154-E1156 VanDerWaalsContact OG-CG 3.26Å; S1154-E1156 WeakPolarHBondContact OG-CG 3.4Å; S1154-E1156 PolarHBondContact OG-OE1 2.88Å; S1154-E1157 PolarHBondContact N-OE2 3.33Å; S1154-E1157 PolarHBondContact O-N 2.84Å; S1154-E1157 WeakPolarHBondContact OG-CG 3.45Å; S1154-E1157 PolarHBondContact OG-N 3.37Å; S1154-T1158 PolarHBondContact O-N 3.11Å; S1154-T1158 PolarHBondContact O-OG1 2.91Å
1155	I	89.1	Confident	87.8	Confident	37 Å²	37	52.7 Å²	52.7	19%	0.19	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-37.2	-178.4	-71.1	167.7	0	0	0	110.5	F999 F1144 T1158 Y1159 L1163	F999-I1155 HydrophobicContact CE2-CD1 4.45Å; F1144-I1155 HydrophobicContact CB-CB 4.4Å; F1144-I1155 HydrophobicContact CB-CD1 3.29Å; F1144-I1155 HydrophobicContact CB-CG1 4.41Å; F1144-I1155 HydrophobicContact CB-CG2 4.02Å; I1155-T1158 PolarHBondContact O-N 2.84Å; I1155-Y1159 HydrophobicContact CG2-CD2 3.96Å; I1155-Y1159 PolarHBondContact O-N 3.03Å; I1155-L1163 HydrophobicContact CG2-CD2 3.65Å
1156	E	89.4	Confident	87.9	Confident	71 Å²	71	52.7 Å²	52.7	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-65.3	-34	173.5	57	-81.9	-169.9	0	0	113.1	S1154 T1158 G1160 R1214	S1154-E1156 VanDerWaalsContact C-N 3.31Å; S1154-E1156 VanDerWaalsContact CB-CD 3.41Å; S1154-E1156 WeakPolarHBondContact CB-OE1 3.5Å; S1154-E1156 PolarHBondContact O-N 3.09Å; S1154-E1156 VanDerWaalsContact OG-CG 3.26Å; S1154-E1156 WeakPolarHBondContact OG-CG 3.4Å; S1154-E1156 PolarHBondContact OG-OE1 2.88Å; E1156-T1158 VanDerWaalsContact C-N 3.33Å; E1156-G1160 WeakPolarHBondContact O-CA 3.1Å; E1156-G1160 PolarHBondContact O-N 2.94Å; E1156-R1214 IonicContact OE1-CZ 3.66Å; E1156-R1214 IonicContact OE1-NH1 3.78Å; E1156-R1214 PolarHBondContact OE1-NH1 3.36Å; E1156-R1214 IonicContact OE1-NH2 2.92Å; E1156-R1214 IonicContact OE2-CZ 3.33Å; E1156-R1214 IonicContact OE2-NH1 2.95Å; E1156-R1214 PolarHBondContact OE2-NH1 3.18Å; E1156-R1214 IonicContact OE2-NH2 2.56Å; E1156-R1214 PolarHBondContact OE2-NH2 2.73Å
1157	E	87.4	Confident	88.1	Confident	78 Å²	78	51.1 Å²	51.1	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-72.6	-28.3	172.1	-73.3	-172.9	126.9	0	0	112.6	K872 V1153 S1154	K872-E1157 IonicContact NZ-OE1 3.09Å; K872-E1157 PolarHBondContact NZ-OE1 3.3Å; V1153-E1157 HydrophobicContact CG1-CB 3.44Å; V1153-E1157 VanDerWaalsContact CG1-CB 3.44Å; V1153-E1157 HydrophobicContact CG1-CG 4.44Å; V1153-E1157 WeakPolarHBondContact CG1-OE2 3.47Å; S1154-E1157 PolarHBondContact N-OE2 3.33Å; S1154-E1157 PolarHBondContact O-N 2.84Å; S1154-E1157 WeakPolarHBondContact OG-CG 3.45Å; S1154-E1157 PolarHBondContact OG-N 3.37Å
1158	T	89.4	Confident	88.5	Confident	20 Å²	20	50.1 Å²	50.1	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-86.1	-42.1	-176.9	-54.6	0	0	0	0	113	C860 S871 V873 S1154 I1155 E1156	C860-T1158 VanDerWaalsContact SG-C 3.56Å; C860-T1158 PolarHBondContact SG-O 3.49Å; S871-T1158 WeakPolarHBondContact CB-O 3.39Å; S871-T1158 PolarHBondContact OG-O 2.93Å; V873-T1158 HydrophobicContact CB-CG2 4Å; V873-T1158 HydrophobicContact CG2-CG2 4.01Å; V873-T1158 WeakPolarHBondContact CG2-OG1 3.24Å; S1154-T1158 PolarHBondContact O-N 3.11Å; S1154-T1158 PolarHBondContact O-OG1 2.91Å; I1155-T1158 PolarHBondContact O-N 2.84Å; E1156-T1158 VanDerWaalsContact C-N 3.33Å
1159	Y	91.4	Very high	89.1	Confident	23 Å²	23	48 Å²	48	9%	0.09	23%	0.23	C	C	.	.	H	α-helix	trans	-118.9	-10.9	-173	-57.9	-87.7	0	0	0	114.2	F999 Q1000 R1003 I1155	F999-Y1159 HydrophobicContact CB-CD1 3.92Å; F999-Y1159 HydrophobicContact CB-CD2 4.25Å; F999-Y1159 HydrophobicContact CB-CE1 3.63Å; F999-Y1159 HydrophobicContact CB-CE2 3.94Å; F999-Y1159 HydrophobicContact CB-CG 4.27Å; F999-Y1159 HydrophobicContact CD2-CE2 4.2Å; F999-Y1159 WeakPolarHBondContact O-CD1 3.39Å; Q1000-Y1159 HydrophobicContact CB-CE1 4.37Å; R1003-Y1159 HydrophobicContact CB-CD1 4.08Å; R1003-Y1159 WeakPolarHBondContact CD-O 3.23Å; R1003-Y1159 WeakPolarHBondContact CG-O 3.41Å; R1003-Y1159 VanDerWaalsContact NH1-CE1 3.26Å; I1155-Y1159 HydrophobicContact CG2-CD2 3.96Å; I1155-Y1159 PolarHBondContact O-N 3.03Å
1160	G	93.6	Very high	89.8	Confident	5 Å²	5	38.8 Å²	38.8	5%	0.052	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	-162.6	-174.5	0	0	0	0	0	113.2	E1156 G1162	E1156-G1160 WeakPolarHBondContact O-CA 3.1Å; E1156-G1160 PolarHBondContact O-N 2.94Å; G1160-G1162 VanDerWaalsContact C-N 3.27Å; G1160-G1162 PolarHBondContact O-N 3.25Å
1161	E	95.3	Very high	91	Very high	38 Å²	38	31.4 Å²	31.4	18%	0.178	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-12.2	175.7	-65.6	176.3	-155.9	0	0	113	Y861 G863 L1163 N1164 W1165 L1221	Y861-E1161 HydrophobicContact CD1-CB 4.04Å; Y861-E1161 PolarHBondContact O-N 3.34Å; G863-E1161 WeakPolarHBondContact CA-OE2 3.32Å; G863-E1161 PolarHBondContact N-OE1 3.41Å; G863-E1161 PolarHBondContact N-OE2 2.74Å; E1161-L1163 PolarHBondContact O-N 3.05Å; E1161-N1164 PolarHBondContact O-N 2.63Å; E1161-W1165 VanDerWaalsContact O-CD1 3.31Å; E1161-W1165 PolarHBondContact O-N 3.44Å; E1161-L1221 HydrophobicContact CG-CD1 4.05Å; E1161-L1221 HydrophobicContact CG-CD2 3.96Å
1162	G	95.2	Very high	91.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-53.2	-40.8	177.9	0	0	0	0	0	112.2	G1006 G1160 N1164 W1165 C1166	G1006-G1162 VanDerWaalsContact CA-O 3.29Å; G1006-G1162 WeakPolarHBondContact CA-O 3.49Å; G1160-G1162 VanDerWaalsContact C-N 3.27Å; G1160-G1162 PolarHBondContact O-N 3.25Å; G1162-N1164 VanDerWaalsContact C-N 3.33Å; G1162-N1164 PolarHBondContact O-N 2.82Å; G1162-W1165 PolarHBondContact O-N 2.83Å; G1162-C1166 PolarHBondContact O-N 3.47Å
1163	L	95.3	Very high	92.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-52.1	-49.2	172.6	174.3	60.3	0	0	0	112.6	F999 C1002 W1137 F1144 I1155 E1161 C1166 G1167	F999-L1163 HydrophobicContact CB-CD1 4.14Å; F999-L1163 HydrophobicContact CB-CD2 4.49Å; F999-L1163 HydrophobicContact CD1-CD1 3.68Å; F999-L1163 HydrophobicContact CD1-CD2 4.13Å; F999-L1163 HydrophobicContact CE1-CD1 4.47Å; F999-L1163 HydrophobicContact CG-CD1 4.18Å; F999-L1163 HydrophobicContact CG-CD2 4.22Å; C1002-L1163 HydrophobicContact CB-CD1 3.56Å; W1137-L1163 HydrophobicContact CH2-CD1 3.85Å; W1137-L1163 HydrophobicContact CH2-CG 4.15Å; W1137-L1163 WeakPolarHBondContact CH2-O 3.48Å; W1137-L1163 HydrophobicContact CZ3-CD1 4.41Å; F1144-L1163 HydrophobicContact CD1-CD2 4.26Å; I1155-L1163 HydrophobicContact CG2-CD2 3.65Å; E1161-L1163 PolarHBondContact O-N 3.05Å; L1163-C1166 PolarHBondContact O-N 3.34Å; L1163-G1167 PolarHBondContact O-N 2.95Å
1164	N	96	Very high	93.1	Very high	4 Å²	4	16 Å²	16	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-71.4	-36.3	-178.7	-58.8	-62.8	0	0	0	111.5	E1161 G1162 C1166 G1167 C1168 L1221 I1225	E1161-N1164 PolarHBondContact O-N 2.63Å; G1162-N1164 VanDerWaalsContact C-N 3.33Å; G1162-N1164 PolarHBondContact O-N 2.82Å; N1164-C1166 VanDerWaalsContact C-N 3.31Å; N1164-C1166 PolarHBondContact O-N 3.1Å; N1164-G1167 PolarHBondContact O-N 3.34Å; N1164-C1168 VanDerWaalsContact O-CB 3.29Å; N1164-C1168 WeakPolarHBondContact O-CB 3.37Å; N1164-C1168 PolarHBondContact O-N 2.97Å; N1164-L1221 HydrophobicContact CB-CD2 3.98Å; N1164-L1221 HydrophobicContact CB-CG 4.47Å; N1164-L1221 VanDerWaalsContact ND2-CD2 3.28Å; N1164-L1221 WeakPolarHBondContact ND2-CD2 3.35Å; N1164-I1225 HydrophobicContact CB-CD1 3.75Å
1165	W	96.9	Very high	93.2	Very high	15 Å²	15	20.3 Å²	20.3	6%	0.057	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-40.5	174.3	-86.6	86.6	0	0	0	112.2	I1009 L1010 L1013 E1161 G1162 A1169 I1225 V1228 L1229	I1009-W1165 HydrophobicContact CG2-CE3 4.13Å; L1010-W1165 HydrophobicContact CD1-CB 4.28Å; L1010-W1165 HydrophobicContact CD1-CD2 4.44Å; L1010-W1165 HydrophobicContact CD1-CG 3.91Å; L1010-W1165 HydrophobicContact CD2-CD2 3.62Å; L1010-W1165 VanDerWaalsContact CD2-CE2 3.42Å; L1010-W1165 HydrophobicContact CD2-CE3 4.14Å; L1010-W1165 HydrophobicContact CD2-CG 3.97Å; L1010-W1165 HydrophobicContact CD2-CH2 4.29Å; L1010-W1165 HydrophobicContact CD2-CZ2 3.8Å; L1010-W1165 HydrophobicContact CD2-CZ3 4.45Å; L1010-W1165 HydrophobicContact CG-CB 4.36Å; L1010-W1165 HydrophobicContact CG-CD2 3.92Å; L1010-W1165 HydrophobicContact CG-CE3 4.41Å; L1010-W1165 HydrophobicContact CG-CG 3.86Å; L1013-W1165 HydrophobicContact CD2-CH2 3.78Å; L1013-W1165 HydrophobicContact CD2-CZ3 4.11Å; E1161-W1165 VanDerWaalsContact O-CD1 3.31Å; E1161-W1165 PolarHBondContact O-N 3.44Å; G1162-W1165 PolarHBondContact O-N 2.83Å; W1165-A1169 WeakPolarHBondContact O-CB 3.28Å; W1165-A1169 PolarHBondContact O-N 2.9Å; W1165-I1225 HydrophobicContact CD2-CD1 4.42Å; W1165-I1225 HydrophobicContact CD2-CG1 4.23Å; W1165-I1225 HydrophobicContact CD2-CG2 3.78Å; W1165-I1225 HydrophobicContact CE3-CG2 3.83Å; W1165-I1225 HydrophobicContact CG-CD1 4.07Å; W1165-I1225 HydrophobicContact CG-CG1 4.39Å; W1165-I1225 HydrophobicContact CG-CG2 4.25Å; W1165-I1225 HydrophobicContact CH2-CG2 4.43Å; W1165-I1225 HydrophobicContact CZ2-CG1 4.2Å; W1165-I1225 HydrophobicContact CZ2-CG2 4.37Å; W1165-I1225 HydrophobicContact CZ3-CG2 4.17Å; W1165-V1228 HydrophobicContact CH2-CB 4.08Å; W1165-V1228 HydrophobicContact CH2-CG1 3.96Å; W1165-L1229 HydrophobicContact CE3-CD2 4.37Å; W1165-L1229 HydrophobicContact CZ3-CD2 4.01Å; W1165-L1229 HydrophobicContact CZ3-CG 4.23Å
1166	C	96.6	Very high	93.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.8	-54.5	173.2	169.4	0	0	0	0	112.2	C1002 L1005 G1162 L1163 N1164 C1168 A1169 L1170	C1002-C1166 HydrophobicContact CB-CB 3.89Å; C1002-C1166 WeakPolarHBondContact O-CB 3.43Å; C1002-C1166 PolarHBondContact SG-SG 3.31Å; L1005-C1166 HydrophobicContact CB-CB 4.44Å; G1162-C1166 PolarHBondContact O-N 3.47Å; L1163-C1166 PolarHBondContact O-N 3.34Å; N1164-C1166 VanDerWaalsContact C-N 3.31Å; N1164-C1166 PolarHBondContact O-N 3.1Å; C1166-C1168 PolarHBondContact O-N 2.75Å; C1166-A1169 PolarHBondContact O-N 2.83Å; C1166-L1170 WeakPolarHBondContact O-CG 3.47Å; C1166-L1170 PolarHBondContact O-N 3.04Å
1167	G	94.8	Very high	93.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-47.9	-178.5	0	0	0	0	0	113	L1163 N1164 A1169 L1170 V1171	L1163-G1167 PolarHBondContact O-N 2.95Å; N1164-G1167 PolarHBondContact O-N 3.34Å; G1167-A1169 PolarHBondContact O-N 3.11Å; G1167-L1170 PolarHBondContact O-N 3.45Å; G1167-V1171 WeakPolarHBondContact O-CG2 3.3Å; G1167-V1171 PolarHBondContact O-N 2.98Å
1168	C	96.4	Very high	93.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.7	-38.3	176.7	-74	0	0	0	0	112.7	N1164 C1166 V1171 A1172 N1222 I1225 F1226 L1229	N1164-C1168 VanDerWaalsContact O-CB 3.29Å; N1164-C1168 WeakPolarHBondContact O-CB 3.37Å; N1164-C1168 PolarHBondContact O-N 2.97Å; C1166-C1168 PolarHBondContact O-N 2.75Å; C1168-V1171 PolarHBondContact O-N 3.25Å; C1168-A1172 WeakPolarHBondContact O-CB 3.22Å; C1168-A1172 PolarHBondContact O-N 3.4Å; C1168-N1222 PolarHBondContact SG-OD1 3.09Å; C1168-I1225 HydrophobicContact CB-CB 4.13Å; C1168-I1225 HydrophobicContact CB-CG2 3.49Å; C1168-I1225 VanDerWaalsContact CB-CG2 3.49Å; C1168-F1226 HydrophobicContact CB-CD1 4.11Å; C1168-F1226 HydrophobicContact CB-CE1 3.78Å; C1168-F1226 HydrophobicContact CB-CZ 4.06Å; C1168-F1226 VanDerWaalsContact O-CE1 3.27Å; C1168-F1226 WeakPolarHBondContact O-CE1 3.28Å; C1168-L1229 HydrophobicContact CB-CD1 4.15Å
1169	A	95.5	Very high	93.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-45.6	175.4	0	0	0	0	0	111.6	I1009 W1165 C1166 G1167 A1172 M1173 L1229	I1009-A1169 HydrophobicContact CD1-CB 3.61Å; W1165-A1169 WeakPolarHBondContact O-CB 3.28Å; W1165-A1169 PolarHBondContact O-N 2.9Å; C1166-A1169 PolarHBondContact O-N 2.83Å; G1167-A1169 PolarHBondContact O-N 3.11Å; A1169-A1172 PolarHBondContact O-N 2.99Å; A1169-M1173 HydrophobicContact CB-CE 4.22Å; A1169-M1173 WeakPolarHBondContact O-CB 3.37Å; A1169-M1173 WeakPolarHBondContact O-CE 3.49Å; A1169-M1173 VanDerWaalsContact O-CG 3.29Å; A1169-M1173 WeakPolarHBondContact O-CG 3.46Å; A1169-M1173 PolarHBondContact O-N 3.24Å; A1169-L1229 HydrophobicContact CB-CD1 4.14Å; A1169-L1229 HydrophobicContact CB-CD2 4.44Å
1170	L	95	Very high	93.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-65.5	-46.7	178.2	-67.4	170.8	0	0	0	112.1	L946 L1109 W1114 F1133 C1166 G1167 A1172 M1173 L1174	L946-L1170 HydrophobicContact CD2-CD1 4.31Å; L946-L1170 HydrophobicContact CD2-CD2 3.63Å; L1109-L1170 HydrophobicContact CD1-CD2 3.78Å; L1109-L1170 HydrophobicContact CD2-CD2 3.62Å; L1109-L1170 HydrophobicContact CG-CD2 4.34Å; W1114-L1170 HydrophobicContact CH2-CD1 4.42Å; W1114-L1170 HydrophobicContact CZ3-CD1 4.13Å; W1114-L1170 HydrophobicContact CZ3-CD2 4.46Å; F1133-L1170 HydrophobicContact CD1-CB 3.96Å; F1133-L1170 HydrophobicContact CE1-CB 3.35Å; F1133-L1170 HydrophobicContact CE1-CD1 4.11Å; F1133-L1170 HydrophobicContact CE1-CG 4.37Å; F1133-L1170 HydrophobicContact CE2-CD1 4.12Å; F1133-L1170 HydrophobicContact CZ-CB 3.78Å; F1133-L1170 HydrophobicContact CZ-CD1 3.6Å; F1133-L1170 HydrophobicContact CZ-CG 4.34Å; C1166-L1170 WeakPolarHBondContact O-CG 3.47Å; C1166-L1170 PolarHBondContact O-N 3.04Å; G1167-L1170 PolarHBondContact O-N 3.45Å; L1170-A1172 VanDerWaalsContact C-N 3.26Å; L1170-A1172 PolarHBondContact O-N 3.23Å; L1170-M1173 HydrophobicContact CD2-CE 3.88Å; L1170-M1173 PolarHBondContact O-N 3.43Å; L1170-L1174 WeakPolarHBondContact O-CB 3.18Å; L1170-L1174 VanDerWaalsContact O-CG 3.24Å; L1170-L1174 WeakPolarHBondContact O-CG 3.44Å; L1170-L1174 PolarHBondContact O-N 3.09Å
1171	V	94.5	Very high	93.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.1	-38.1	175.2	171.3	0	0	0	0	111.6	F1133 H1134 G1167 C1168 D1175 Q1176 R1177 F1180 F1226	F1133-V1171 HydrophobicContact CD1-CG2 3.94Å; F1133-V1171 HydrophobicContact CE1-CG2 3.82Å; H1134-V1171 HydrophobicContact CB-CG1 4.45Å; H1134-V1171 HydrophobicContact CB-CG2 3.97Å; G1167-V1171 WeakPolarHBondContact O-CG2 3.3Å; G1167-V1171 PolarHBondContact O-N 2.98Å; C1168-V1171 PolarHBondContact O-N 3.25Å; V1171-D1175 PolarHBondContact O-N 2.92Å; V1171-Q1176 HydrophobicContact CG1-CB 4.15Å; V1171-Q1176 PolarHBondContact O-N 3.05Å; V1171-R1177 VanDerWaalsContact CG1-CA 3.5Å; V1171-R1177 HydrophobicContact CG1-CB 4.15Å; V1171-F1180 HydrophobicContact CG1-CB 4.01Å; V1171-F1180 HydrophobicContact CG1-CG 4.35Å; V1171-F1226 HydrophobicContact CB-CE1 3.98Å; V1171-F1226 HydrophobicContact CB-CZ 4.02Å; V1171-F1226 HydrophobicContact CG1-CE1 3.84Å; V1171-F1226 HydrophobicContact CG1-CZ 3.7Å
1172	A	92.5	Very high	93.7	Very high	12 Å²	12	29.5 Å²	29.5	10%	0.099	14%	0.136	C	C	.	.	H	α-helix	trans	-72.3	-45.2	178.4	0	0	0	0	0	112.7	C1168 A1169 L1170 L1174 D1175 F1226 L1229 L1233	C1168-A1172 WeakPolarHBondContact O-CB 3.22Å; C1168-A1172 PolarHBondContact O-N 3.4Å; A1169-A1172 PolarHBondContact O-N 2.99Å; L1170-A1172 VanDerWaalsContact C-N 3.26Å; L1170-A1172 PolarHBondContact O-N 3.23Å; A1172-L1174 VanDerWaalsContact C-N 3.3Å; A1172-L1174 PolarHBondContact O-N 3.32Å; A1172-D1175 PolarHBondContact O-N 3.06Å; A1172-D1175 VanDerWaalsContact O-N 3.13Å; A1172-F1226 HydrophobicContact CB-CD1 4.19Å; A1172-F1226 HydrophobicContact CB-CE1 4.29Å; A1172-L1229 HydrophobicContact CB-CB 4.36Å; A1172-L1229 HydrophobicContact CB-CD1 4.22Å; A1172-L1233 HydrophobicContact CB-CD1 3.89Å
1173	M	91.9	Very high	93.6	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.02	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-34.7	179.6	-73.5	-173.9	-70.2	0	0	112.4	L1102 M1105 K1106 L1109 A1169 L1170 D1175 L1233	L1102-M1173 HydrophobicContact CD2-SD 4.41Å; M1105-M1173 HydrophobicContact CB-CE 4.39Å; M1105-M1173 HydrophobicContact CB-SD 3.94Å; K1106-M1173 HydrophobicContact CB-CB 4.31Å; K1106-M1173 HydrophobicContact CB-CG 4.47Å; K1106-M1173 HydrophobicContact CB-SD 4.17Å; K1106-M1173 WeakPolarHBondContact CD-O 3.45Å; K1106-M1173 WeakPolarHBondContact CE-O 3.49Å; K1106-M1173 HydrophobicContact CG-CB 4.35Å; K1106-M1173 PolarHBondContact NZ-O 3.44Å; L1109-M1173 HydrophobicContact CD1-CB 4.26Å; L1109-M1173 HydrophobicContact CD1-CE 4.3Å; A1169-M1173 HydrophobicContact CB-CE 4.22Å; A1169-M1173 WeakPolarHBondContact O-CB 3.37Å; A1169-M1173 WeakPolarHBondContact O-CE 3.49Å; A1169-M1173 VanDerWaalsContact O-CG 3.29Å; A1169-M1173 WeakPolarHBondContact O-CG 3.46Å; A1169-M1173 PolarHBondContact O-N 3.24Å; L1170-M1173 HydrophobicContact CD2-CE 3.88Å; L1170-M1173 PolarHBondContact O-N 3.43Å; M1173-D1175 VanDerWaalsContact C-N 3.27Å; M1173-D1175 PolarHBondContact O-N 3.12Å; M1173-L1233 HydrophobicContact CG-CD1 4.45Å
1174	L	91.4	Very high	93.6	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.052	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.6	176	-64.5	171.6	0	0	0	114	L1109 W1114 F1115 F1133 L1170 A1172 Q1176	L1109-L1174 HydrophobicContact CB-CD2 4.14Å; L1109-L1174 HydrophobicContact CD1-CD2 3.87Å; L1109-L1174 HydrophobicContact CD1-CG 4.01Å; W1114-L1174 HydrophobicContact CB-CD1 4.02Å; W1114-L1174 HydrophobicContact CB-CD2 3.88Å; W1114-L1174 HydrophobicContact CE3-CD1 4.09Å; F1115-L1174 HydrophobicContact CD1-CD2 4.05Å; F1115-L1174 HydrophobicContact CE1-CD2 3.36Å; F1115-L1174 HydrophobicContact CE2-CD2 4.38Å; F1115-L1174 HydrophobicContact CZ-CD2 3.56Å; F1133-L1174 HydrophobicContact CB-CD1 3.76Å; F1133-L1174 HydrophobicContact CD1-CD1 4.04Å; F1133-L1174 HydrophobicContact CG-CD1 4.12Å; L1170-L1174 WeakPolarHBondContact O-CB 3.18Å; L1170-L1174 VanDerWaalsContact O-CG 3.24Å; L1170-L1174 WeakPolarHBondContact O-CG 3.44Å; L1170-L1174 PolarHBondContact O-N 3.09Å; A1172-L1174 VanDerWaalsContact C-N 3.3Å; A1172-L1174 PolarHBondContact O-N 3.32Å; L1174-Q1176 HydrophobicContact CB-CB 4.49Å; L1174-Q1176 HydrophobicContact CB-CG 4.02Å; L1174-Q1176 PolarHBondContact O-N 2.96Å
1175	D	89.2	Confident	93.6	Very high	107 Å²	107	29.4 Å²	29.4	57%	0.572	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	37.5	-175.4	-161	28.3	0	0	0	113.6	V1171 A1172 M1173 R1179	V1171-D1175 PolarHBondContact O-N 2.92Å; A1172-D1175 PolarHBondContact O-N 3.06Å; A1172-D1175 VanDerWaalsContact O-N 3.13Å; M1173-D1175 VanDerWaalsContact C-N 3.27Å; M1173-D1175 PolarHBondContact O-N 3.12Å; D1175-R1179 PolarHBondContact O-NH1 3.14Å
1176	Q	92.2	Very high	93.5	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	13%	0.133	C	C	.	.			trans	-100.8	-2.3	-178.7	-76.2	174.6	10.2	0	0	113.3	W1114 H1134 V1171 L1174 R1178 R1179 F1180	W1114-Q1176 PolarHBondContact O-NE2 3.39Å; H1134-Q1176 HydrophobicContact CB-CB 3.97Å; V1171-Q1176 HydrophobicContact CG1-CB 4.15Å; V1171-Q1176 PolarHBondContact O-N 3.05Å; L1174-Q1176 HydrophobicContact CB-CB 4.49Å; L1174-Q1176 HydrophobicContact CB-CG 4.02Å; L1174-Q1176 PolarHBondContact O-N 2.96Å; Q1176-R1178 PolarHBondContact O-N 3Å; Q1176-R1179 PolarHBondContact O-N 3.2Å; Q1176-F1180 WeakPolarHBondContact O-CB 3.46Å; Q1176-F1180 PolarHBondContact O-N 3.26Å
1177	R	92.5	Very high	93.5	Very high	65 Å²	65	29 Å²	29	25%	0.245	13%	0.134	C	C	.	.	H	α-helix	trans	-53.9	-49.4	-174.7	178.4	-171.5	164.9	177.3	-0.4	113.6	V1171 R1179 F1180 E1181 F1226 C1230	V1171-R1177 VanDerWaalsContact CG1-CA 3.5Å; V1171-R1177 HydrophobicContact CG1-CB 4.15Å; R1177-R1179 VanDerWaalsContact C-N 3.28Å; R1177-R1179 PolarHBondContact O-N 2.95Å; R1177-F1180 WeakPolarHBondContact O-CB 3.21Å; R1177-F1180 PolarHBondContact O-N 3.3Å; R1177-E1181 HydrophobicContact CG-CG 4.48Å; R1177-E1181 IonicContact CZ-OE1 2.79Å; R1177-E1181 IonicContact NE-OE1 3.82Å; R1177-E1181 PolarHBondContact NE-OE1 3.2Å; R1177-E1181 IonicContact NH2-OE1 2.7Å; R1177-E1181 PolarHBondContact NH2-OE1 2.97Å; R1177-E1181 WeakPolarHBondContact O-CG 3.46Å; R1177-E1181 PolarHBondContact O-N 2.76Å; R1177-F1226 HydrophobicContact CB-CE1 4.3Å; R1177-F1226 HydrophobicContact CG-CD1 4.05Å; R1177-F1226 HydrophobicContact CG-CD2 4.11Å; R1177-F1226 HydrophobicContact CG-CE1 4.09Å; R1177-F1226 HydrophobicContact CG-CE2 4.17Å; R1177-F1226 HydrophobicContact CG-CG 4.07Å; R1177-F1226 HydrophobicContact CG-CZ 4.18Å; R1177-C1230 PolarHBondContact NH1-SG 3.24Å; R1177-C1230 VanDerWaalsContact NH1-SG 3.4Å
1178	R	90.5	Very high	93.5	Very high	185 Å²	185	29.6 Å²	29.6	70%	0.698	14%	0.137	S	C	*	.	H	α-helix	trans	-63.8	-38.3	-176.8	-64.1	-178.4	-171.7	177.6	4.4	111.1	Q1176 V1182	Q1176-R1178 PolarHBondContact O-N 3Å; R1178-V1182 VanDerWaalsContact O-CG2 3.32Å; R1178-V1182 WeakPolarHBondContact O-CG2 3.44Å; R1178-V1182 PolarHBondContact O-N 3.48Å
1179	R	92	Very high	93.4	Very high	62 Å²	62	29.6 Å²	29.6	23%	0.234	14%	0.137	C	C	.	.	H	α-helix	trans	-67.3	-47.2	175.9	-63.5	-167.2	-69.1	-83.3	17.2	110.4	M1125 E1132 D1175 Q1176 R1177 E1181 V1182 V1183	M1125-R1179 HydrophobicContact CE-CB 4.39Å; M1125-R1179 HydrophobicContact CE-CG 3.86Å; E1132-R1179 IonicContact OE1-CZ 2.68Å; E1132-R1179 IonicContact OE1-NE 2.76Å; E1132-R1179 PolarHBondContact OE1-NE 3.26Å; E1132-R1179 IonicContact OE1-NH2 2.65Å; E1132-R1179 PolarHBondContact OE1-NH2 2.97Å; E1132-R1179 IonicContact OE2-CZ 2.65Å; E1132-R1179 IonicContact OE2-NE 3.6Å; E1132-R1179 PolarHBondContact OE2-NE 3.17Å; E1132-R1179 IonicContact OE2-NH2 2.99Å; E1132-R1179 PolarHBondContact OE2-NH2 2.95Å; E1132-R1179 VanDerWaalsContact OE2-NH2 3.17Å; D1175-R1179 PolarHBondContact O-NH1 3.14Å; Q1176-R1179 PolarHBondContact O-N 3.2Å; R1177-R1179 VanDerWaalsContact C-N 3.28Å; R1177-R1179 PolarHBondContact O-N 2.95Å; R1179-E1181 PolarHBondContact O-N 2.88Å; R1179-V1182 PolarHBondContact O-N 2.96Å; R1179-V1182 VanDerWaalsContact O-N 3.13Å; R1179-V1183 WeakPolarHBondContact O-CG2 3.45Å; R1179-V1183 PolarHBondContact O-N 3.06Å
1180	F	94.2	Very high	93.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-51.6	-52.8	174	177.6	-108.3	0	0	0	112.8	H1134 W1137 S1138 V1171 Q1176 R1177 V1182 V1183 D1184 Y1187 F1226	H1134-F1180 HydrophobicContact CB-CB 3.9Å; H1134-F1180 HydrophobicContact CB-CD2 4.08Å; H1134-F1180 HydrophobicContact CB-CG 4.39Å; W1137-F1180 AromaticContact CD1-CE2 3.73Å; W1137-F1180 AromaticContact CD1-CZ 3.89Å; S1138-F1180 WeakPolarHBondContact OG-CE2 3.49Å; V1171-F1180 HydrophobicContact CG1-CB 4.01Å; V1171-F1180 HydrophobicContact CG1-CG 4.35Å; Q1176-F1180 WeakPolarHBondContact O-CB 3.46Å; Q1176-F1180 PolarHBondContact O-N 3.26Å; R1177-F1180 WeakPolarHBondContact O-CB 3.21Å; R1177-F1180 PolarHBondContact O-N 3.3Å; F1180-V1182 PolarHBondContact O-N 2.85Å; F1180-V1182 VanDerWaalsContact O-N 3.15Å; F1180-V1183 PolarHBondContact O-N 2.93Å; F1180-D1184 HydrophobicContact CD2-CB 4.2Å; F1180-D1184 HydrophobicContact CE2-CB 3.99Å; F1180-D1184 VanDerWaalsContact CE2-OD2 3.24Å; F1180-D1184 WeakPolarHBondContact CE2-OD2 3.35Å; F1180-D1184 HydrophobicContact CZ-CB 4.34Å; F1180-D1184 WeakPolarHBondContact O-CB 3.36Å; F1180-D1184 PolarHBondContact O-N 2.88Å; F1180-Y1187 HydrophobicContact CD1-CE2 4.49Å; F1180-Y1187 HydrophobicContact CE1-CE2 4.01Å; F1180-F1226 HydrophobicContact CD1-CE2 4.01Å; F1180-F1226 HydrophobicContact CD1-CZ 4.12Å; F1180-F1226 HydrophobicContact CE1-CE2 4.09Å; F1180-F1226 HydrophobicContact CE1-CZ 4.37Å
1181	E	93.4	Very high	93.3	Very high	64 Å²	64	33.3 Å²	33.3	30%	0.299	15%	0.151	S	C	.	.	H	α-helix	trans	-59.5	-30.1	-178.8	-72.6	173.4	174.2	0	0	113	R1177 R1179 Y1187 R1191	R1177-E1181 HydrophobicContact CG-CG 4.48Å; R1177-E1181 IonicContact CZ-OE1 2.79Å; R1177-E1181 IonicContact NE-OE1 3.82Å; R1177-E1181 PolarHBondContact NE-OE1 3.2Å; R1177-E1181 IonicContact NH2-OE1 2.7Å; R1177-E1181 PolarHBondContact NH2-OE1 2.97Å; R1177-E1181 WeakPolarHBondContact O-CG 3.46Å; R1177-E1181 PolarHBondContact O-N 2.76Å; R1179-E1181 PolarHBondContact O-N 2.88Å; E1181-Y1187 HydrophobicContact CG-CE2 4.47Å; E1181-R1191 PolarHBondContact O-NH1 2.83Å
1182	V	92	Very high	93.3	Very high	87 Å²	87	33.4 Å²	33.4	53%	0.527	15%	0.151	S	C	.	.	H	α-helix	trans	-81.1	-52.2	178.7	176.1	0	0	0	0	111.6	R1178 R1179 F1180 R1191	R1178-V1182 VanDerWaalsContact O-CG2 3.32Å; R1178-V1182 WeakPolarHBondContact O-CG2 3.44Å; R1178-V1182 PolarHBondContact O-N 3.48Å; R1179-V1182 PolarHBondContact O-N 2.96Å; R1179-V1182 VanDerWaalsContact O-N 3.13Å; F1180-V1182 PolarHBondContact O-N 2.85Å; F1180-V1182 VanDerWaalsContact O-N 3.15Å; V1182-R1191 PolarHBondContact O-NH1 2.97Å; V1182-R1191 PolarHBondContact O-NH2 3.21Å
1183	V	93.6	Very high	93.3	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.024	15%	0.154	C	C	.	.	H	α-helix	trans	-103.4	8.9	-168.1	-51.7	0	0	0	0	114.9	L967 H1134 R1135 R1179 F1180	L967-V1183 HydrophobicContact CD1-CB 4.14Å; L967-V1183 HydrophobicContact CD1-CG1 4.06Å; H1134-V1183 WeakPolarHBondContact CE1-CG2 3.46Å; R1135-V1183 PolarHBondContact NH1-O 2.82Å; R1179-V1183 WeakPolarHBondContact O-CG2 3.45Å; R1179-V1183 PolarHBondContact O-N 3.06Å; F1180-V1183 PolarHBondContact O-N 2.93Å
1184	D	95.4	Very high	93.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	18%	0.183	C	C	.	.			trans	-62.3	134.9	174.9	178	-97.7	0	0	0	112.5	S1138 Q1141 F1180 C1186 Y1187 H1188	S1138-D1184 VanDerWaalsContact CA-OD2 3.28Å; S1138-D1184 WeakPolarHBondContact CA-OD2 3.34Å; S1138-D1184 WeakPolarHBondContact CB-OD2 3.38Å; S1138-D1184 WeakPolarHBondContact OG-CA 3.25Å; S1138-D1184 PolarHBondContact OG-OD2 3.18Å; Q1141-D1184 PolarHBondContact NE2-OD1 3.42Å; Q1141-D1184 PolarHBondContact NE2-OD2 3.1Å; Q1141-D1184 VanDerWaalsContact NE2-OD2 3.11Å; F1180-D1184 HydrophobicContact CD2-CB 4.2Å; F1180-D1184 HydrophobicContact CE2-CB 3.99Å; F1180-D1184 VanDerWaalsContact CE2-OD2 3.24Å; F1180-D1184 WeakPolarHBondContact CE2-OD2 3.35Å; F1180-D1184 HydrophobicContact CZ-CB 4.34Å; F1180-D1184 WeakPolarHBondContact O-CB 3.36Å; F1180-D1184 PolarHBondContact O-N 2.88Å; D1184-C1186 WeakPolarHBondContact OD1-CA 3.46Å; D1184-C1186 VanDerWaalsContact OD1-CB 3.29Å; D1184-C1186 WeakPolarHBondContact OD1-CB 3.47Å; D1184-C1186 PolarHBondContact OD1-N 3.21Å; D1184-Y1187 HydrophobicContact CB-CD2 3.98Å; D1184-Y1187 HydrophobicContact CB-CG 3.95Å; D1184-Y1187 PolarHBondContact O-N 3.27Å; D1184-Y1187 WeakPolarHBondContact OD1-CD1 3.13Å; D1184-Y1187 PolarHBondContact OD1-N 2.93Å; D1184-H1188 WeakPolarHBondContact O-CB 3.32Å; D1184-H1188 PolarHBondContact O-N 3.39Å
1185	F	94.7	Very high	93.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-46.1	-176.4	-55	-48.5	0	0	0	112.1	C965 Y981 L985 A1139 H1188 V1189	C965-F1185 HydrophobicContact CB-CE1 3.94Å; C965-F1185 HydrophobicContact CB-CZ 4.06Å; Y981-F1185 HydrophobicContact CD1-CB 4.22Å; Y981-F1185 AromaticContact CD1-CD1 3.79Å; Y981-F1185 HydrophobicContact CD1-CD1 3.79Å; Y981-F1185 HydrophobicContact CD1-CE1 4.37Å; Y981-F1185 HydrophobicContact CD1-CG 4.11Å; Y981-F1185 HydrophobicContact CD2-CB 4.2Å; Y981-F1185 HydrophobicContact CE1-CB 4.24Å; Y981-F1185 AromaticContact CE1-CD1 3.37Å; Y981-F1185 HydrophobicContact CE1-CD1 3.37Å; Y981-F1185 AromaticContact CE1-CE1 3.99Å; Y981-F1185 HydrophobicContact CE1-CE1 3.99Å; Y981-F1185 HydrophobicContact CE1-CG 4.08Å; Y981-F1185 HydrophobicContact CE2-CB 4.17Å; Y981-F1185 HydrophobicContact CG-CB 4.22Å; Y981-F1185 AromaticContact CZ-CD1 3.84Å; L985-F1185 HydrophobicContact CD1-CD2 4.05Å; L985-F1185 HydrophobicContact CD1-CE2 4.29Å; A1139-F1185 HydrophobicContact CB-CE2 4.13Å; F1185-H1188 WeakPolarHBondContact O-CB 3.25Å; F1185-H1188 PolarHBondContact O-N 2.95Å; F1185-V1189 WeakPolarHBondContact O-CG2 3.37Å; F1185-V1189 PolarHBondContact O-N 3.33Å
1186	C	95.4	Very high	93.5	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.4	-41.5	-179.9	-71.3	0	0	0	0	111.5	Q1141 F1142 D1184 H1188 V1189 L1190 I1215	Q1141-C1186 HydrophobicContact CG-CB 4.33Å; F1142-C1186 WeakPolarHBondContact CA-SG 3.34Å; D1184-C1186 WeakPolarHBondContact OD1-CA 3.46Å; D1184-C1186 VanDerWaalsContact OD1-CB 3.29Å; D1184-C1186 WeakPolarHBondContact OD1-CB 3.47Å; D1184-C1186 PolarHBondContact OD1-N 3.21Å; C1186-H1188 VanDerWaalsContact C-N 3.27Å; C1186-H1188 PolarHBondContact O-N 2.79Å; C1186-V1189 WeakPolarHBondContact O-CB 3.34Å; C1186-V1189 PolarHBondContact O-N 3.41Å; C1186-L1190 WeakPolarHBondContact O-CB 3.41Å; C1186-L1190 PolarHBondContact O-N 2.93Å; C1186-I1215 HydrophobicContact CB-CB 4.44Å; C1186-I1215 HydrophobicContact CB-CD1 3.89Å; C1186-I1215 HydrophobicContact CB-CG1 3.82Å; C1186-I1215 HydrophobicContact CB-CG2 3.8Å; C1186-I1215 WeakPolarHBondContact O-CG2 3.49Å
1187	Y	96.2	Very high	93.4	Very high	5 Å²	5	45.4 Å²	45.4	2%	0.02	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-34.7	177.6	-66.2	3	0	0	0	111	F1180 E1181 D1184 L1190 R1191 I1215 Q1219 N1222	F1180-Y1187 HydrophobicContact CD1-CE2 4.49Å; F1180-Y1187 HydrophobicContact CE1-CE2 4.01Å; E1181-Y1187 HydrophobicContact CG-CE2 4.47Å; D1184-Y1187 HydrophobicContact CB-CD2 3.98Å; D1184-Y1187 HydrophobicContact CB-CG 3.95Å; D1184-Y1187 PolarHBondContact O-N 3.27Å; D1184-Y1187 WeakPolarHBondContact OD1-CD1 3.13Å; D1184-Y1187 PolarHBondContact OD1-N 2.93Å; Y1187-L1190 PolarHBondContact O-N 3.13Å; Y1187-R1191 VanDerWaalsContact O-CG 3.3Å; Y1187-R1191 WeakPolarHBondContact O-CG 3.47Å; Y1187-R1191 PolarHBondContact O-N 3.4Å; Y1187-I1215 HydrophobicContact CD1-CG2 4.45Å; Y1187-Q1219 HydrophobicContact CD1-CB 4.16Å; Y1187-Q1219 HydrophobicContact CD1-CG 4.19Å; Y1187-Q1219 HydrophobicContact CE1-CB 3.49Å; Y1187-Q1219 VanDerWaalsContact CE1-CB 3.49Å; Y1187-Q1219 HydrophobicContact CE1-CG 3.67Å; Y1187-Q1219 HydrophobicContact CE2-CG 4.23Å; Y1187-N1222 WeakPolarHBondContact OH-CB 3.41Å; Y1187-N1222 PolarHBondContact OH-ND2 2.96Å; Y1187-N1222 VanDerWaalsContact OH-ND2 3.1Å
1188	H	95.2	Very high	93.2	Very high	13 Å²	13	47.6 Å²	47.6	6%	0.06	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-49.2	171.8	-171.7	62.1	0	0	0	112.2	L967 P968 Y981 D1184 F1185 C1186 L1190 R1191 V1192	L967-H1188 HydrophobicContact CD2-CB 3.55Å; L967-H1188 VanDerWaalsContact CD2-CG 3.44Å; P968-H1188 PolarHBondContact O-CE1 2.94Å; P968-H1188 PolarHBondContact O-NE2 3.39Å; Y981-H1188 PolarHBondContact OH-CD2 2.81Å; D1184-H1188 WeakPolarHBondContact O-CB 3.32Å; D1184-H1188 PolarHBondContact O-N 3.39Å; F1185-H1188 WeakPolarHBondContact O-CB 3.25Å; F1185-H1188 PolarHBondContact O-N 2.95Å; C1186-H1188 VanDerWaalsContact C-N 3.27Å; C1186-H1188 PolarHBondContact O-N 2.79Å; H1188-L1190 VanDerWaalsContact C-N 3.28Å; H1188-L1190 PolarHBondContact O-N 3.15Å; H1188-R1191 PolarHBondContact ND1-NH2 3.38Å; H1188-R1191 PolarHBondContact O-N 3Å; H1188-R1191 VanDerWaalsContact O-N 3.09Å; H1188-V1192 WeakPolarHBondContact O-CG2 3.44Å; H1188-V1192 PolarHBondContact O-N 2.94Å
1189	V	94.1	Very high	93.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-52.7	-47.8	174	163.5	0	0	0	0	111.1	V977 V978 Y981 F1185 C1186 R1191 V1192 F1193 I1212 I1215	V977-V1189 HydrophobicContact CG1-CG2 4.01Å; V978-V1189 HydrophobicContact CG2-CB 3.97Å; V978-V1189 HydrophobicContact CG2-CG1 3.2Å; V978-V1189 HydrophobicContact CG2-CG2 3.48Å; V978-V1189 VanDerWaalsContact CG2-CG2 3.48Å; Y981-V1189 HydrophobicContact CD2-CG2 3.61Å; Y981-V1189 HydrophobicContact CE2-CG2 3.77Å; F1185-V1189 WeakPolarHBondContact O-CG2 3.37Å; F1185-V1189 PolarHBondContact O-N 3.33Å; C1186-V1189 WeakPolarHBondContact O-CB 3.34Å; C1186-V1189 PolarHBondContact O-N 3.41Å; V1189-R1191 VanDerWaalsContact C-N 3.35Å; V1189-R1191 PolarHBondContact O-N 3.36Å; V1189-V1192 PolarHBondContact O-N 3.41Å; V1189-F1193 WeakPolarHBondContact O-CB 3.35Å; V1189-F1193 PolarHBondContact O-N 3Å; V1189-I1212 HydrophobicContact CG1-CD1 3.56Å; V1189-I1215 HydrophobicContact CB-CD1 4.39Å; V1189-I1215 HydrophobicContact CG1-CD1 3.98Å
1190	L	94.4	Very high	93	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-40.8	177.9	176.8	64.6	0	0	0	112.3	C1186 Y1187 H1188 K1194 I1212 I1215	C1186-L1190 WeakPolarHBondContact O-CB 3.41Å; C1186-L1190 PolarHBondContact O-N 2.93Å; Y1187-L1190 PolarHBondContact O-N 3.13Å; H1188-L1190 VanDerWaalsContact C-N 3.28Å; H1188-L1190 PolarHBondContact O-N 3.15Å; L1190-K1194 HydrophobicContact CD1-CG 4.47Å; L1190-K1194 WeakPolarHBondContact O-CB 3.29Å; L1190-K1194 VanDerWaalsContact O-CG 3.29Å; L1190-K1194 WeakPolarHBondContact O-CG 3.4Å; L1190-K1194 PolarHBondContact O-N 2.71Å; L1190-I1212 HydrophobicContact CD1-CG2 3.68Å; L1190-I1215 HydrophobicContact CB-CG2 3.97Å; L1190-I1215 HydrophobicContact CD2-CG2 4.23Å
1191	R	94.6	Very high	92.7	Very high	76 Å²	76	48.3 Å²	48.3	29%	0.287	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-38.8	177.5	-73.3	-175.4	-58.4	-108.3	5.1	112.3	Y970 E1181 V1182 Y1187 H1188 V1189	Y970-R1191 WeakPolarHBondContact OH-CB 3.5Å; E1181-R1191 PolarHBondContact O-NH1 2.83Å; V1182-R1191 PolarHBondContact O-NH1 2.97Å; V1182-R1191 PolarHBondContact O-NH2 3.21Å; Y1187-R1191 VanDerWaalsContact O-CG 3.3Å; Y1187-R1191 WeakPolarHBondContact O-CG 3.47Å; Y1187-R1191 PolarHBondContact O-N 3.4Å; H1188-R1191 PolarHBondContact ND1-NH2 3.38Å; H1188-R1191 PolarHBondContact O-N 3Å; H1188-R1191 VanDerWaalsContact O-N 3.09Å; V1189-R1191 VanDerWaalsContact C-N 3.35Å; V1189-R1191 PolarHBondContact O-N 3.36Å
1192	V	93.9	Very high	92.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-68.9	-45.7	176.7	178.9	0	0	0	0	110.5	Y970 V977 H1188 V1189 K1194 V1195 D1196	Y970-V1192 HydrophobicContact CD1-CB 4.38Å; Y970-V1192 HydrophobicContact CD1-CG1 4.42Å; Y970-V1192 HydrophobicContact CD1-CG2 4.07Å; Y970-V1192 HydrophobicContact CD2-CG2 4.17Å; Y970-V1192 HydrophobicContact CE1-CB 4.45Å; Y970-V1192 HydrophobicContact CE1-CG2 4.07Å; Y970-V1192 HydrophobicContact CE2-CG2 4.17Å; Y970-V1192 HydrophobicContact CG-CG2 4.13Å; V977-V1192 HydrophobicContact CG2-CG1 4.12Å; V977-V1192 HydrophobicContact CG2-CG2 4.31Å; H1188-V1192 WeakPolarHBondContact O-CG2 3.44Å; H1188-V1192 PolarHBondContact O-N 2.94Å; V1189-V1192 PolarHBondContact O-N 3.41Å; V1192-K1194 VanDerWaalsContact C-N 3.31Å; V1192-K1194 PolarHBondContact O-N 2.8Å; V1192-V1195 PolarHBondContact O-N 3.44Å; V1192-D1196 PolarHBondContact O-N 2.97Å; V1192-D1196 VanDerWaalsContact O-N 3.12Å
1193	F	93.3	Very high	92	Very high	38 Å²	38	46.5 Å²	46.5	17%	0.167	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-37.7	177.2	-178.3	-89.6	0	0	0	112.8	V1189 V1195 D1196 G1197 K1198 L1208 I1212	V1189-F1193 WeakPolarHBondContact O-CB 3.35Å; V1189-F1193 PolarHBondContact O-N 3Å; F1193-V1195 PolarHBondContact O-N 2.91Å; F1193-D1196 WeakPolarHBondContact CA-OD1 3.28Å; F1193-D1196 PolarHBondContact O-N 3.26Å; F1193-G1197 WeakPolarHBondContact O-CA 3.44Å; F1193-G1197 PolarHBondContact O-N 2.85Å; F1193-K1198 WeakPolarHBondContact CD2-O 3.33Å; F1193-K1198 WeakPolarHBondContact CE2-O 3.32Å; F1193-L1208 HydrophobicContact CD2-CD2 4.06Å; F1193-L1208 HydrophobicContact CD2-CG 4.12Å; F1193-L1208 HydrophobicContact CE2-CD2 4.44Å; F1193-L1208 HydrophobicContact CE2-CG 4.28Å; F1193-I1212 HydrophobicContact CB-CD1 3.53Å; F1193-I1212 HydrophobicContact CB-CG1 4.09Å; F1193-I1212 HydrophobicContact CD1-CB 4.32Å; F1193-I1212 HydrophobicContact CD1-CD1 4.19Å; F1193-I1212 HydrophobicContact CD1-CG1 3.93Å; F1193-I1212 HydrophobicContact CD1-CG2 3.66Å; F1193-I1212 HydrophobicContact CD2-CD1 4.17Å; F1193-I1212 HydrophobicContact CD2-CG1 3.8Å; F1193-I1212 HydrophobicContact CE1-CB 4.43Å; F1193-I1212 HydrophobicContact CE1-CG1 4.3Å; F1193-I1212 HydrophobicContact CE1-CG2 3.87Å; F1193-I1212 HydrophobicContact CE2-CG1 4.17Å; F1193-I1212 HydrophobicContact CG-CD1 3.71Å; F1193-I1212 HydrophobicContact CG-CG1 3.66Å; F1193-I1212 HydrophobicContact CG-CG2 4.26Å; F1193-I1212 HydrophobicContact CZ-CG1 4.41Å
1194	K	92.8	Very high	91.4	Very high	142 Å²	142	48.8 Å²	48.8	62%	0.617	28%	0.275	S	S	*	.	H	α-helix	trans	-60.6	-23.4	174.6	-81.7	179.3	-179.6	-179.3	0	113.6	L1190 V1192	L1190-K1194 HydrophobicContact CD1-CG 4.47Å; L1190-K1194 WeakPolarHBondContact O-CB 3.29Å; L1190-K1194 VanDerWaalsContact O-CG 3.29Å; L1190-K1194 WeakPolarHBondContact O-CG 3.4Å; L1190-K1194 PolarHBondContact O-N 2.71Å; V1192-K1194 VanDerWaalsContact C-N 3.31Å; V1192-K1194 PolarHBondContact O-N 2.8Å
1195	V	92	Very high	91	Very high	107 Å²	107	49.2 Å²	49.2	65%	0.648	28%	0.277	S	S	*	.	H	α-helix	trans	-90.7	-42.5	179.2	174.4	0	0	0	0	111.5	Y970 V1192 F1193	Y970-V1195 HydrophobicContact CD1-CB 4.01Å; Y970-V1195 HydrophobicContact CD1-CG1 4.25Å; Y970-V1195 HydrophobicContact CD1-CG2 3.92Å; Y970-V1195 HydrophobicContact CE1-CB 4.14Å; Y970-V1195 HydrophobicContact CE1-CG2 3.6Å; V1192-V1195 PolarHBondContact O-N 3.44Å; F1193-V1195 PolarHBondContact O-N 2.91Å
1196	D	91.8	Very high	90.5	Very high	47 Å²	47	50.5 Å²	50.5	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-100.5	-22.4	-172.8	76.3	-5.4	0	0	0	115.7	G973 S974 V1192 F1193 K1198	G973-D1196 WeakPolarHBondContact CA-OD2 3.26Å; S974-D1196 WeakPolarHBondContact CB-OD1 3.44Å; S974-D1196 PolarHBondContact N-OD2 3.34Å; S974-D1196 PolarHBondContact OG-OD1 2.78Å; S974-D1196 PolarHBondContact OG-OD2 3.45Å; V1192-D1196 PolarHBondContact O-N 2.97Å; V1192-D1196 VanDerWaalsContact O-N 3.12Å; F1193-D1196 WeakPolarHBondContact CA-OD1 3.28Å; F1193-D1196 PolarHBondContact O-N 3.26Å; D1196-K1198 HydrophobicContact CB-CD 4.44Å; D1196-K1198 HydrophobicContact CB-CG 4.19Å; D1196-K1198 PolarHBondContact O-N 3.04Å; D1196-K1198 VanDerWaalsContact O-N 3.16Å; D1196-K1198 PolarHBondContact OD1-N 3.37Å
1197	G	88.7	Confident	90.2	Very high	52 Å²	52	53.7 Å²	53.7	54%	0.536	31%	0.306	S	S	.	.			trans	60.2	18.7	179.1	0	0	0	0	0	115.5	F1193	F1193-G1197 WeakPolarHBondContact O-CA 3.44Å; F1193-G1197 PolarHBondContact O-N 2.85Å
1198	K	89.2	Confident	90	Very high	111 Å²	111	53.5 Å²	53.5	48%	0.483	31%	0.305	S	S	.	.			trans	-79.1	121.2	-175.2	-67.4	-178.3	-177.8	176.4	0	111.2	S974 P975 F1193 D1196 L1208	S974-K1198 PolarHBondContact OG-O 3.3Å; P975-K1198 HydrophobicContact CG-CB 3.96Å; F1193-K1198 WeakPolarHBondContact CD2-O 3.33Å; F1193-K1198 WeakPolarHBondContact CE2-O 3.32Å; D1196-K1198 HydrophobicContact CB-CD 4.44Å; D1196-K1198 HydrophobicContact CB-CG 4.19Å; D1196-K1198 PolarHBondContact O-N 3.04Å; D1196-K1198 VanDerWaalsContact O-N 3.16Å; D1196-K1198 PolarHBondContact OD1-N 3.37Å; K1198-L1208 WeakPolarHBondContact O-CD2 3.3Å
1199	D	88.6	Confident	89.8	Confident	60 Å²	60	54.9 Å²	54.9	32%	0.321	32%	0.316	S	S	.	.			trans	-114.4	77.8	-178.4	-170.8	24.4	0	0	0	112.7	Q1207 L1208 S1209	D1199-Q1207 PolarHBondContact O-NE2 3.38Å; D1199-Q1207 PolarHBondContact OD1-NE2 3.48Å; D1199-Q1207 VanDerWaalsContact OD1-NE2 3.11Å; D1199-Q1207 PolarHBondContact OD2-NE2 3.26Å; D1199-L1208 PolarHBondContact OD1-N 2.91Å; D1199-S1209 VanDerWaalsContact CG-CB 3.45Å; D1199-S1209 VanDerWaalsContact CG-OG 3.27Å; D1199-S1209 WeakPolarHBondContact OD1-CB 3.27Å; D1199-S1209 PolarHBondContact OD1-N 3Å; D1199-S1209 PolarHBondContact OD1-OG 3.13Å; D1199-S1209 WeakPolarHBondContact OD2-CB 3.45Å; D1199-S1209 PolarHBondContact OD2-OG 3.35Å
1200	D	89.5	Confident	89.6	Confident	89 Å²	89	61.4 Å²	61.4	48%	0.476	34%	0.341	S	S	.	.			trans	-94.5	153.4	177.2	-66	-18.9	0	0	0	111.6	P975 V1202 L1208	P975-D1200 HydrophobicContact CB-CB 3.98Å; P975-D1200 HydrophobicContact CG-CB 3.81Å; P975-D1200 VanDerWaalsContact CG-OD2 3.23Å; P975-D1200 WeakPolarHBondContact CG-OD2 3.46Å; D1200-V1202 PolarHBondContact O-N 3.18Å; D1200-L1208 VanDerWaalsContact O-CB 3.29Å; D1200-L1208 WeakPolarHBondContact O-CB 3.42Å; D1200-L1208 PolarHBondContact O-N 3.04Å
1201	N	88.1	Confident	89.5	Confident	114 Å²	114	61.2 Å²	61.2	61%	0.61	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	107.8	169.5	-172.3	12.3	0	0	0	109.8	G1206	N1201-G1206 WeakPolarHBondContact OD1-CA 3.32Å; N1201-G1206 PolarHBondContact OD1-O 3.19Å
1202	V	87.8	Confident	89.5	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.03	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125	-175.8	-179.7	0	0	0	0	110.1	P975 V978 S979 D1200 G1204 I1205 G1206	P975-V1202 HydrophobicContact CB-CG2 4.32Å; V978-V1202 HydrophobicContact CG1-CG1 4.34Å; V978-V1202 HydrophobicContact CG1-CG2 4.46Å; S979-V1202 WeakPolarHBondContact OG-CG1 3.27Å; D1200-V1202 PolarHBondContact O-N 3.18Å; V1202-G1204 PolarHBondContact O-N 3.45Å; V1202-I1205 HydrophobicContact CB-CB 4.39Å; V1202-I1205 HydrophobicContact CB-CD1 4.41Å; V1202-I1205 HydrophobicContact CG1-CD1 3.98Å; V1202-I1205 PolarHBondContact O-N 3.38Å; V1202-G1206 PolarHBondContact N-O 2.96Å; V1202-G1206 PolarHBondContact O-N 2.87Å
1203	P	83.4	Confident	89.5	Confident	107 Å²	107	64.1 Å²	64.1	70%	0.695	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	123.2	-179.6	-27.5	34.8	0	0	0	113
1204	G	81	Confident	89.5	Confident	53 Å²	53	64.4 Å²	64.4	55%	0.546	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	-11.4	179.6	0	0	0	0	0	115.6	V1202	V1202-G1204 PolarHBondContact O-N 3.45Å
1205	I	85.5	Confident	89.6	Confident	9 Å²	9	57.6 Å²	57.6	5%	0.046	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-39.1	179.2	-60.9	174.3	0	0	0	111.1	V978 Y982 F1142 V1202 M1211	V978-I1205 HydrophobicContact CG1-CD1 3.09Å; Y982-I1205 HydrophobicContact CD2-CD1 4.1Å; Y982-I1205 HydrophobicContact CD2-CG1 3.75Å; Y982-I1205 HydrophobicContact CE2-CG1 4.24Å; Y982-I1205 HydrophobicContact CG-CD1 4.21Å; Y982-I1205 HydrophobicContact CG-CG1 4.23Å; F1142-I1205 HydrophobicContact CZ-CD1 4.23Å; V1202-I1205 HydrophobicContact CB-CB 4.39Å; V1202-I1205 HydrophobicContact CB-CD1 4.41Å; V1202-I1205 HydrophobicContact CG1-CD1 3.98Å; V1202-I1205 PolarHBondContact O-N 3.38Å; I1205-M1211 HydrophobicContact CD1-SD 4.14Å; I1205-M1211 HydrophobicContact CG2-CB 4.09Å; I1205-M1211 HydrophobicContact CG2-CG 4.2Å; I1205-M1211 HydrophobicContact CG2-SD 3.49Å; I1205-M1211 WeakPolarHBondContact CG2-SD 3.29Å
1206	G	85.5	Confident	89.8	Confident	27 Å²	27	59.7 Å²	59.7	28%	0.278	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	97.3	-155.9	-171.5	0	0	0	0	0	111.9	N1201 V1202 L1208	N1201-G1206 WeakPolarHBondContact OD1-CA 3.32Å; N1201-G1206 PolarHBondContact OD1-O 3.19Å; V1202-G1206 PolarHBondContact N-O 2.96Å; V1202-G1206 PolarHBondContact O-N 2.87Å; G1206-L1208 PolarHBondContact O-N 3.39Å
1207	Q	89.7	Confident	89.9	Confident	67 Å²	67	63 Å²	63	31%	0.313	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	124.8	-178.4	-164.5	68.2	13.6	0	0	111.1	D1199 S1209 R1210 M1211	D1199-Q1207 PolarHBondContact O-NE2 3.38Å; D1199-Q1207 PolarHBondContact OD1-NE2 3.48Å; D1199-Q1207 VanDerWaalsContact OD1-NE2 3.11Å; D1199-Q1207 PolarHBondContact OD2-NE2 3.26Å; Q1207-S1209 VanDerWaalsContact C-N 3.33Å; Q1207-S1209 VanDerWaalsContact CG-OG 3.27Å; Q1207-S1209 WeakPolarHBondContact CG-OG 3.41Å; Q1207-S1209 PolarHBondContact O-N 2.72Å; Q1207-R1210 HydrophobicContact CB-CG 4.23Å; Q1207-R1210 PolarHBondContact O-N 3.24Å; Q1207-M1211 PolarHBondContact O-N 2.88Å
1208	L	90.6	Very high	90.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-39.9	-175.8	178.4	53.5	0	0	0	112.3	P975 V978 F1193 K1198 D1199 D1200 G1206 R1210 M1211 I1212	P975-L1208 HydrophobicContact CB-CD2 4.49Å; P975-L1208 HydrophobicContact CG-CD2 4.01Å; V978-L1208 HydrophobicContact CB-CD1 4.33Å; V978-L1208 HydrophobicContact CG1-CD1 4.38Å; V978-L1208 HydrophobicContact CG2-CD1 3.67Å; F1193-L1208 HydrophobicContact CD2-CD2 4.06Å; F1193-L1208 HydrophobicContact CD2-CG 4.12Å; F1193-L1208 HydrophobicContact CE2-CD2 4.44Å; F1193-L1208 HydrophobicContact CE2-CG 4.28Å; K1198-L1208 WeakPolarHBondContact O-CD2 3.3Å; D1199-L1208 PolarHBondContact OD1-N 2.91Å; D1200-L1208 VanDerWaalsContact O-CB 3.29Å; D1200-L1208 WeakPolarHBondContact O-CB 3.42Å; D1200-L1208 PolarHBondContact O-N 3.04Å; G1206-L1208 PolarHBondContact O-N 3.39Å; L1208-R1210 VanDerWaalsContact C-N 3.28Å; L1208-R1210 PolarHBondContact O-N 2.96Å; L1208-M1211 WeakPolarHBondContact O-CB 3.34Å; L1208-M1211 PolarHBondContact O-N 3.35Å; L1208-I1212 HydrophobicContact CD1-CD1 4.22Å; L1208-I1212 HydrophobicContact CD1-CG1 3.95Å; L1208-I1212 HydrophobicContact CG-CG1 4.13Å; L1208-I1212 VanDerWaalsContact O-CG1 3.3Å; L1208-I1212 WeakPolarHBondContact O-CG1 3.45Å; L1208-I1212 PolarHBondContact O-N 3.02Å
1209	S	90.8	Very high	90.5	Very high	43 Å²	43	58 Å²	58	30%	0.301	30%	0.301	S	S	.	.	H	α-helix	trans	-55.6	-39.6	176.5	51.4	0	0	0	0	113.1	D1199 Q1207 I1212 E1213	D1199-S1209 VanDerWaalsContact CG-CB 3.45Å; D1199-S1209 VanDerWaalsContact CG-OG 3.27Å; D1199-S1209 WeakPolarHBondContact OD1-CB 3.27Å; D1199-S1209 PolarHBondContact OD1-N 3Å; D1199-S1209 PolarHBondContact OD1-OG 3.13Å; D1199-S1209 WeakPolarHBondContact OD2-CB 3.45Å; D1199-S1209 PolarHBondContact OD2-OG 3.35Å; Q1207-S1209 VanDerWaalsContact C-N 3.33Å; Q1207-S1209 VanDerWaalsContact CG-OG 3.27Å; Q1207-S1209 WeakPolarHBondContact CG-OG 3.41Å; Q1207-S1209 PolarHBondContact O-N 2.72Å; S1209-I1212 PolarHBondContact O-N 3.41Å; S1209-E1213 PolarHBondContact O-N 3.27Å
1210	R	91	Very high	90.8	Very high	137 Å²	137	59.6 Å²	59.6	52%	0.517	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-40.8	175.2	-68.7	-173.8	179.2	-171.2	0.5	111.9	P1147 Q1207 L1208 R1214	P1147-R1210 HydrophobicContact CB-CB 4.32Å; P1147-R1210 HydrophobicContact CG-CB 3.86Å; Q1207-R1210 HydrophobicContact CB-CG 4.23Å; Q1207-R1210 PolarHBondContact O-N 3.24Å; L1208-R1210 VanDerWaalsContact C-N 3.28Å; L1208-R1210 PolarHBondContact O-N 2.96Å; R1210-R1214 WeakPolarHBondContact O-CG 3.46Å; R1210-R1214 PolarHBondContact O-N 2.95Å
1211	M	92.7	Very high	91.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-43.7	175.6	-172.7	-177	-170.2	0	0	111.1	V978 F1142 C1145 P1147 I1205 Q1207 L1208 E1213 R1214 I1215	V978-M1211 HydrophobicContact CG1-SD 4.01Å; F1142-M1211 HydrophobicContact CD2-CE 3.82Å; F1142-M1211 HydrophobicContact CE1-CE 4.48Å; F1142-M1211 HydrophobicContact CE2-CE 3.49Å; F1142-M1211 VanDerWaalsContact CE2-CE 3.49Å; F1142-M1211 HydrophobicContact CG-CE 4.45Å; F1142-M1211 HydrophobicContact CZ-CE 3.86Å; C1145-M1211 HydrophobicContact CB-CE 4.4Å; P1147-M1211 HydrophobicContact CG-CB 4.11Å; I1205-M1211 HydrophobicContact CD1-SD 4.14Å; I1205-M1211 HydrophobicContact CG2-CB 4.09Å; I1205-M1211 HydrophobicContact CG2-CG 4.2Å; I1205-M1211 HydrophobicContact CG2-SD 3.49Å; I1205-M1211 WeakPolarHBondContact CG2-SD 3.29Å; Q1207-M1211 PolarHBondContact O-N 2.88Å; L1208-M1211 WeakPolarHBondContact O-CB 3.34Å; L1208-M1211 PolarHBondContact O-N 3.35Å; M1211-E1213 VanDerWaalsContact C-N 3.33Å; M1211-E1213 PolarHBondContact O-N 3.43Å; M1211-R1214 PolarHBondContact O-N 3.37Å; M1211-I1215 HydrophobicContact CE-CD1 4.23Å; M1211-I1215 HydrophobicContact CG-CD1 3.94Å; M1211-I1215 HydrophobicContact CG-CG1 4.37Å; M1211-I1215 VanDerWaalsContact O-CG1 3.27Å; M1211-I1215 WeakPolarHBondContact O-CG1 3.38Å; M1211-I1215 PolarHBondContact O-N 3.34Å; M1211-I1215 HydrophobicContact SD-CD1 4.46Å
1212	I	94.2	Very high	91.4	Very high	13 Å²	13	51.5 Å²	51.5	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-42.1	178.5	-67.5	-65.9	0	0	0	111.6	V1189 L1190 F1193 L1208 S1209 I1215 R1216	V1189-I1212 HydrophobicContact CG1-CD1 3.56Å; L1190-I1212 HydrophobicContact CD1-CG2 3.68Å; F1193-I1212 HydrophobicContact CB-CD1 3.53Å; F1193-I1212 HydrophobicContact CB-CG1 4.09Å; F1193-I1212 HydrophobicContact CD1-CB 4.32Å; F1193-I1212 HydrophobicContact CD1-CD1 4.19Å; F1193-I1212 HydrophobicContact CD1-CG1 3.93Å; F1193-I1212 HydrophobicContact CD1-CG2 3.66Å; F1193-I1212 HydrophobicContact CD2-CD1 4.17Å; F1193-I1212 HydrophobicContact CD2-CG1 3.8Å; F1193-I1212 HydrophobicContact CE1-CB 4.43Å; F1193-I1212 HydrophobicContact CE1-CG1 4.3Å; F1193-I1212 HydrophobicContact CE1-CG2 3.87Å; F1193-I1212 HydrophobicContact CE2-CG1 4.17Å; F1193-I1212 HydrophobicContact CG-CD1 3.71Å; F1193-I1212 HydrophobicContact CG-CG1 3.66Å; F1193-I1212 HydrophobicContact CG-CG2 4.26Å; F1193-I1212 HydrophobicContact CZ-CG1 4.41Å; L1208-I1212 HydrophobicContact CD1-CD1 4.22Å; L1208-I1212 HydrophobicContact CD1-CG1 3.95Å; L1208-I1212 HydrophobicContact CG-CG1 4.13Å; L1208-I1212 VanDerWaalsContact O-CG1 3.3Å; L1208-I1212 WeakPolarHBondContact O-CG1 3.45Å; L1208-I1212 PolarHBondContact O-N 3.02Å; S1209-I1212 PolarHBondContact O-N 3.41Å; I1212-I1215 PolarHBondContact O-N 3.35Å; I1212-R1216 PolarHBondContact O-N 2.93Å
1213	E	92.6	Very high	91.8	Very high	126 Å²	126	53.7 Å²	53.7	59%	0.589	28%	0.282	S	S	*	.	H	α-helix	trans	-60.4	-48.5	175.5	-174.6	172.2	-164.8	0	0	111.1	S1209 M1211 I1215 R1216 Q1217	S1209-E1213 PolarHBondContact O-N 3.27Å; M1211-E1213 VanDerWaalsContact C-N 3.33Å; M1211-E1213 PolarHBondContact O-N 3.43Å; E1213-I1215 PolarHBondContact O-N 3.18Å; E1213-R1216 WeakPolarHBondContact O-CB 3.33Å; E1213-R1216 PolarHBondContact O-N 3.31Å; E1213-Q1217 WeakPolarHBondContact O-CG 3.27Å; E1213-Q1217 PolarHBondContact O-N 3.41Å
1214	R	94.1	Very high	92.3	Very high	43 Å²	43	53 Å²	53	16%	0.162	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-46.5	175.4	-71.7	-174.9	66	73.8	0.9	112.2	F1144 E1156 R1210 M1211 R1216 Q1217 F1218	F1144-R1214 PolarHBondContact O-NH2 3.23Å; E1156-R1214 IonicContact OE1-CZ 3.66Å; E1156-R1214 IonicContact OE1-NH1 3.78Å; E1156-R1214 PolarHBondContact OE1-NH1 3.36Å; E1156-R1214 IonicContact OE1-NH2 2.92Å; E1156-R1214 IonicContact OE2-CZ 3.33Å; E1156-R1214 IonicContact OE2-NH1 2.95Å; E1156-R1214 PolarHBondContact OE2-NH1 3.18Å; E1156-R1214 IonicContact OE2-NH2 2.56Å; E1156-R1214 PolarHBondContact OE2-NH2 2.73Å; R1210-R1214 WeakPolarHBondContact O-CG 3.46Å; R1210-R1214 PolarHBondContact O-N 2.95Å; M1211-R1214 PolarHBondContact O-N 3.37Å; R1214-R1216 VanDerWaalsContact C-N 3.26Å; R1214-R1216 PolarHBondContact O-N 3.02Å; R1214-Q1217 PolarHBondContact O-N 3.17Å; R1214-Q1217 VanDerWaalsContact O-N 3.09Å; R1214-F1218 WeakPolarHBondContact O-CD2 3.41Å; R1214-F1218 PolarHBondContact O-N 3.28Å
1215	I	95.6	Very high	93	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.4	-43.6	177.1	-69.9	169.2	0	0	0	110.6	C1145 C1186 Y1187 V1189 L1190 M1211 I1212 E1213 Q1217 F1218 Q1219	C1145-I1215 HydrophobicContact CB-CG1 3.76Å; C1186-I1215 HydrophobicContact CB-CB 4.44Å; C1186-I1215 HydrophobicContact CB-CD1 3.89Å; C1186-I1215 HydrophobicContact CB-CG1 3.82Å; C1186-I1215 HydrophobicContact CB-CG2 3.8Å; C1186-I1215 WeakPolarHBondContact O-CG2 3.49Å; Y1187-I1215 HydrophobicContact CD1-CG2 4.45Å; V1189-I1215 HydrophobicContact CB-CD1 4.39Å; V1189-I1215 HydrophobicContact CG1-CD1 3.98Å; L1190-I1215 HydrophobicContact CB-CG2 3.97Å; L1190-I1215 HydrophobicContact CD2-CG2 4.23Å; M1211-I1215 HydrophobicContact CE-CD1 4.23Å; M1211-I1215 HydrophobicContact CG-CD1 3.94Å; M1211-I1215 HydrophobicContact CG-CG1 4.37Å; M1211-I1215 VanDerWaalsContact O-CG1 3.27Å; M1211-I1215 WeakPolarHBondContact O-CG1 3.38Å; M1211-I1215 PolarHBondContact O-N 3.34Å; M1211-I1215 HydrophobicContact SD-CD1 4.46Å; I1212-I1215 PolarHBondContact O-N 3.35Å; E1213-I1215 PolarHBondContact O-N 3.18Å; I1215-Q1217 VanDerWaalsContact C-N 3.35Å; I1215-Q1217 PolarHBondContact O-N 3.26Å; I1215-F1218 PolarHBondContact O-N 3.2Å; I1215-Q1219 VanDerWaalsContact O-CB 3.28Å; I1215-Q1219 WeakPolarHBondContact O-CB 3.3Å; I1215-Q1219 PolarHBondContact O-N 3.29Å
1216	R	94.9	Very high	93.4	Very high	151 Å²	151	50.1 Å²	50.1	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-62.4	-41.9	177.8	-175.2	-179.7	178.9	178.3	-1	111.6	I1212 E1213 R1214 Q1219 L1220	I1212-R1216 PolarHBondContact O-N 2.93Å; E1213-R1216 WeakPolarHBondContact O-CB 3.33Å; E1213-R1216 PolarHBondContact O-N 3.31Å; R1214-R1216 VanDerWaalsContact C-N 3.26Å; R1214-R1216 PolarHBondContact O-N 3.02Å; R1216-Q1219 PolarHBondContact O-N 2.7Å; R1216-L1220 HydrophobicContact CG-CD1 4.02Å; R1216-L1220 WeakPolarHBondContact O-CD1 3.39Å; R1216-L1220 PolarHBondContact O-N 2.73Å
1217	Q	93.8	Very high	93.7	Very high	115 Å²	115	50.3 Å²	50.3	54%	0.537	25%	0.25	S	C	.	.	H	α-helix	trans	-62.8	-49.1	177.4	-63.8	-60.7	-15.4	0	0	111.7	E1213 R1214 I1215 Q1219 L1220 L1221	E1213-Q1217 WeakPolarHBondContact O-CG 3.27Å; E1213-Q1217 PolarHBondContact O-N 3.41Å; R1214-Q1217 PolarHBondContact O-N 3.17Å; R1214-Q1217 VanDerWaalsContact O-N 3.09Å; I1215-Q1217 VanDerWaalsContact C-N 3.35Å; I1215-Q1217 PolarHBondContact O-N 3.26Å; Q1217-Q1219 VanDerWaalsContact C-N 3.31Å; Q1217-Q1219 PolarHBondContact O-N 2.89Å; Q1217-L1220 PolarHBondContact O-N 3.44Å; Q1217-L1221 PolarHBondContact O-N 3.27Å
1218	F	95	Very high	93.7	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	25%	0.248	C	C	.	.	H	α-helix	trans	-64.9	-34	176.4	-72.5	-68.9	0	0	0	112.5	F1144 R1214 I1215 L1221 N1222	F1144-F1218 HydrophobicContact CD2-CD1 4.17Å; F1144-F1218 HydrophobicContact CD2-CD2 4.11Å; F1144-F1218 HydrophobicContact CD2-CE1 4.05Å; F1144-F1218 AromaticContact CD2-CE2 3.98Å; F1144-F1218 HydrophobicContact CD2-CE2 3.98Å; F1144-F1218 HydrophobicContact CD2-CG 4.22Å; F1144-F1218 AromaticContact CD2-CZ 3.96Å; F1144-F1218 HydrophobicContact CD2-CZ 3.96Å; F1144-F1218 HydrophobicContact CE2-CB 4.37Å; F1144-F1218 AromaticContact CE2-CD1 3.77Å; F1144-F1218 HydrophobicContact CE2-CD1 3.77Å; F1144-F1218 HydrophobicContact CE2-CD2 4.17Å; F1144-F1218 HydrophobicContact CE2-CE1 4.06Å; F1144-F1218 HydrophobicContact CE2-CE2 4.43Å; F1144-F1218 AromaticContact CE2-CG 3.84Å; F1144-F1218 HydrophobicContact CE2-CG 3.84Å; F1144-F1218 HydrophobicContact CE2-CZ 4.39Å; R1214-F1218 WeakPolarHBondContact O-CD2 3.41Å; R1214-F1218 PolarHBondContact O-N 3.28Å; I1215-F1218 PolarHBondContact O-N 3.2Å; F1218-L1221 HydrophobicContact CD1-CD2 4.28Å; F1218-L1221 PolarHBondContact O-N 2.81Å; F1218-N1222 VanDerWaalsContact O-CB 3.32Å; F1218-N1222 WeakPolarHBondContact O-CB 3.43Å; F1218-N1222 PolarHBondContact O-N 3.29Å; F1218-N1222 PolarHBondContact O-ND2 3.44Å; F1218-N1222 PolarHBondContact O-OD1 2.91Å
1219	Q	95.9	Very high	93.8	Very high	45 Å²	45	49.3 Å²	49.3	21%	0.21	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-45.5	173.7	-179.8	174.8	66.1	0	0	112.1	Y1187 I1215 R1216 Q1217 S1223	Y1187-Q1219 HydrophobicContact CD1-CB 4.16Å; Y1187-Q1219 HydrophobicContact CD1-CG 4.19Å; Y1187-Q1219 HydrophobicContact CE1-CB 3.49Å; Y1187-Q1219 VanDerWaalsContact CE1-CB 3.49Å; Y1187-Q1219 HydrophobicContact CE1-CG 3.67Å; Y1187-Q1219 HydrophobicContact CE2-CG 4.23Å; I1215-Q1219 VanDerWaalsContact O-CB 3.28Å; I1215-Q1219 WeakPolarHBondContact O-CB 3.3Å; I1215-Q1219 PolarHBondContact O-N 3.29Å; R1216-Q1219 PolarHBondContact O-N 2.7Å; Q1217-Q1219 VanDerWaalsContact C-N 3.31Å; Q1217-Q1219 PolarHBondContact O-N 2.89Å; Q1219-S1223 WeakPolarHBondContact O-CB 3.42Å; Q1219-S1223 PolarHBondContact O-N 3.29Å; Q1219-S1223 PolarHBondContact O-OG 3.34Å
1220	L	95	Very high	93.6	Very high	95 Å²	95	48.5 Å²	48.5	50%	0.497	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-43.6	175.4	-97.7	101	0	0	0	111.5	R1216 Q1217 S1223 T1224	R1216-L1220 HydrophobicContact CG-CD1 4.02Å; R1216-L1220 WeakPolarHBondContact O-CD1 3.39Å; R1216-L1220 PolarHBondContact O-N 2.73Å; Q1217-L1220 PolarHBondContact O-N 3.44Å; L1220-S1223 PolarHBondContact O-N 2.96Å; L1220-T1224 PolarHBondContact O-N 3Å; L1220-T1224 PolarHBondContact O-OG1 2.89Å
1221	L	94.8	Very high	93.3	Very high	32 Å²	32	49.2 Å²	49.2	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-53.9	177.3	177.9	60.4	0	0	0	111.1	E1161 N1164 Q1217 F1218 S1223 T1224 I1225	E1161-L1221 HydrophobicContact CG-CD1 4.05Å; E1161-L1221 HydrophobicContact CG-CD2 3.96Å; N1164-L1221 HydrophobicContact CB-CD2 3.98Å; N1164-L1221 HydrophobicContact CB-CG 4.47Å; N1164-L1221 VanDerWaalsContact ND2-CD2 3.28Å; N1164-L1221 WeakPolarHBondContact ND2-CD2 3.35Å; Q1217-L1221 PolarHBondContact O-N 3.27Å; F1218-L1221 HydrophobicContact CD1-CD2 4.28Å; F1218-L1221 PolarHBondContact O-N 2.81Å; L1221-S1223 VanDerWaalsContact C-N 3.29Å; L1221-S1223 PolarHBondContact O-N 3.48Å; L1221-T1224 WeakPolarHBondContact O-CA 3.35Å; L1221-T1224 WeakPolarHBondContact O-CB 3.42Å; L1221-T1224 PolarHBondContact O-N 3.32Å; L1221-I1225 HydrophobicContact CD1-CD1 3.91Å; L1221-I1225 HydrophobicContact CD1-CG1 4.19Å; L1221-I1225 HydrophobicContact CG-CD1 3.85Å; L1221-I1225 HydrophobicContact CG-CG1 4.49Å; L1221-I1225 WeakPolarHBondContact O-CG1 3.29Å; L1221-I1225 PolarHBondContact O-N 3.45Å
1222	N	95.9	Very high	92.9	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.6	-43.9	177.9	-69.5	-14.3	0	0	0	111.7	Q1141 C1168 Y1187 F1218 T1224 I1225 F1226	Q1141-N1222 PolarHBondContact OE1-ND2 3.44Å; C1168-N1222 PolarHBondContact SG-OD1 3.09Å; Y1187-N1222 WeakPolarHBondContact OH-CB 3.41Å; Y1187-N1222 PolarHBondContact OH-ND2 2.96Å; Y1187-N1222 VanDerWaalsContact OH-ND2 3.1Å; F1218-N1222 VanDerWaalsContact O-CB 3.32Å; F1218-N1222 WeakPolarHBondContact O-CB 3.43Å; F1218-N1222 PolarHBondContact O-N 3.29Å; F1218-N1222 PolarHBondContact O-ND2 3.44Å; F1218-N1222 PolarHBondContact O-OD1 2.91Å; N1222-T1224 VanDerWaalsContact C-N 3.27Å; N1222-T1224 PolarHBondContact O-N 2.8Å; N1222-I1225 PolarHBondContact O-N 3.44Å; N1222-F1226 HydrophobicContact CB-CD2 4.36Å; N1222-F1226 HydrophobicContact CB-CE2 4.16Å; N1222-F1226 WeakPolarHBondContact O-CB 3.44Å; N1222-F1226 WeakPolarHBondContact O-CD2 3.36Å; N1222-F1226 WeakPolarHBondContact O-CG 3.49Å; N1222-F1226 PolarHBondContact O-N 3.01Å
1223	S	94.9	Very high	92.2	Very high	52 Å²	52	54.2 Å²	54.2	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-38.7	177.8	-59.7	0	0	0	0	111.9	Q1219 L1220 L1221 G1227	Q1219-S1223 WeakPolarHBondContact O-CB 3.42Å; Q1219-S1223 PolarHBondContact O-N 3.29Å; Q1219-S1223 PolarHBondContact O-OG 3.34Å; L1220-S1223 PolarHBondContact O-N 2.96Å; L1221-S1223 VanDerWaalsContact C-N 3.29Å; L1221-S1223 PolarHBondContact O-N 3.48Å; S1223-G1227 PolarHBondContact O-N 2.73Å
1224	T	93.9	Very high	90.9	Very high	91 Å²	91	55.7 Å²	55.7	56%	0.558	28%	0.276	S	S	*	.	H	α-helix	trans	-68.2	-47.1	177.4	-56.2	0	0	0	0	110.8	L1220 L1221 N1222 G1227 V1228	L1220-T1224 PolarHBondContact O-N 3Å; L1220-T1224 PolarHBondContact O-OG1 2.89Å; L1221-T1224 WeakPolarHBondContact O-CA 3.35Å; L1221-T1224 WeakPolarHBondContact O-CB 3.42Å; L1221-T1224 PolarHBondContact O-N 3.32Å; N1222-T1224 VanDerWaalsContact C-N 3.27Å; N1222-T1224 PolarHBondContact O-N 2.8Å; T1224-G1227 WeakPolarHBondContact O-CA 3.4Å; T1224-G1227 PolarHBondContact O-N 3.21Å; T1224-G1227 VanDerWaalsContact O-N 3.11Å; T1224-V1228 PolarHBondContact O-N 3.32Å; T1224-V1228 VanDerWaalsContact O-N 3.1Å
1225	I	95.5	Very high	88.8	Confident	2 Å²	2	62 Å²	62	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-48.4	177.7	-62.8	170.9	0	0	0	110.5	N1164 W1165 C1168 L1221 N1222 G1227 V1228 L1229	N1164-I1225 HydrophobicContact CB-CD1 3.75Å; W1165-I1225 HydrophobicContact CD2-CD1 4.42Å; W1165-I1225 HydrophobicContact CD2-CG1 4.23Å; W1165-I1225 HydrophobicContact CD2-CG2 3.78Å; W1165-I1225 HydrophobicContact CE3-CG2 3.83Å; W1165-I1225 HydrophobicContact CG-CD1 4.07Å; W1165-I1225 HydrophobicContact CG-CG1 4.39Å; W1165-I1225 HydrophobicContact CG-CG2 4.25Å; W1165-I1225 HydrophobicContact CH2-CG2 4.43Å; W1165-I1225 HydrophobicContact CZ2-CG1 4.2Å; W1165-I1225 HydrophobicContact CZ2-CG2 4.37Å; W1165-I1225 HydrophobicContact CZ3-CG2 4.17Å; C1168-I1225 HydrophobicContact CB-CB 4.13Å; C1168-I1225 HydrophobicContact CB-CG2 3.49Å; C1168-I1225 VanDerWaalsContact CB-CG2 3.49Å; L1221-I1225 HydrophobicContact CD1-CD1 3.91Å; L1221-I1225 HydrophobicContact CD1-CG1 4.19Å; L1221-I1225 HydrophobicContact CG-CD1 3.85Å; L1221-I1225 HydrophobicContact CG-CG1 4.49Å; L1221-I1225 WeakPolarHBondContact O-CG1 3.29Å; L1221-I1225 PolarHBondContact O-N 3.45Å; N1222-I1225 PolarHBondContact O-N 3.44Å; I1225-G1227 VanDerWaalsContact C-N 3.26Å; I1225-G1227 PolarHBondContact O-N 2.69Å; I1225-V1228 PolarHBondContact O-N 2.81Å; I1225-V1228 VanDerWaalsContact O-N 3.07Å; I1225-L1229 HydrophobicContact CG2-CD1 3.66Å; I1225-L1229 HydrophobicContact CG2-CG 4.19Å; I1225-L1229 WeakPolarHBondContact O-CG 3.21Å; I1225-L1229 PolarHBondContact O-N 2.71Å
1226	F	94.6	Very high	86.4	Confident	1 Å²	1	65.4 Å²	65.4	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-37.5	174.2	-72.4	-50.7	0	0	0	112.3	C1168 V1171 A1172 R1177 F1180 N1222 V1228 C1230	C1168-F1226 HydrophobicContact CB-CD1 4.11Å; C1168-F1226 HydrophobicContact CB-CE1 3.78Å; C1168-F1226 HydrophobicContact CB-CZ 4.06Å; C1168-F1226 VanDerWaalsContact O-CE1 3.27Å; C1168-F1226 WeakPolarHBondContact O-CE1 3.28Å; V1171-F1226 HydrophobicContact CB-CE1 3.98Å; V1171-F1226 HydrophobicContact CB-CZ 4.02Å; V1171-F1226 HydrophobicContact CG1-CE1 3.84Å; V1171-F1226 HydrophobicContact CG1-CZ 3.7Å; A1172-F1226 HydrophobicContact CB-CD1 4.19Å; A1172-F1226 HydrophobicContact CB-CE1 4.29Å; R1177-F1226 HydrophobicContact CB-CE1 4.3Å; R1177-F1226 HydrophobicContact CG-CD1 4.05Å; R1177-F1226 HydrophobicContact CG-CD2 4.11Å; R1177-F1226 HydrophobicContact CG-CE1 4.09Å; R1177-F1226 HydrophobicContact CG-CE2 4.17Å; R1177-F1226 HydrophobicContact CG-CG 4.07Å; R1177-F1226 HydrophobicContact CG-CZ 4.18Å; F1180-F1226 HydrophobicContact CD1-CE2 4.01Å; F1180-F1226 HydrophobicContact CD1-CZ 4.12Å; F1180-F1226 HydrophobicContact CE1-CE2 4.09Å; F1180-F1226 HydrophobicContact CE1-CZ 4.37Å; N1222-F1226 HydrophobicContact CB-CD2 4.36Å; N1222-F1226 HydrophobicContact CB-CE2 4.16Å; N1222-F1226 WeakPolarHBondContact O-CB 3.44Å; N1222-F1226 WeakPolarHBondContact O-CD2 3.36Å; N1222-F1226 WeakPolarHBondContact O-CG 3.49Å; N1222-F1226 PolarHBondContact O-N 3.01Å; F1226-V1228 VanDerWaalsContact C-N 3.25Å; F1226-V1228 PolarHBondContact O-N 3.46Å; F1226-C1230 WeakPolarHBondContact O-CB 3.44Å; F1226-C1230 PolarHBondContact O-N 3.11Å; F1226-C1230 PolarHBondContact O-SG 3.28Å
1227	G	91.2	Very high	83.6	Confident	31 Å²	31	60.4 Å²	60.4	32%	0.32	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-34.5	174.9	0	0	0	0	0	113.3	S1223 T1224 I1225 K1231	S1223-G1227 PolarHBondContact O-N 2.73Å; T1224-G1227 WeakPolarHBondContact O-CA 3.4Å; T1224-G1227 PolarHBondContact O-N 3.21Å; T1224-G1227 VanDerWaalsContact O-N 3.11Å; I1225-G1227 VanDerWaalsContact C-N 3.26Å; I1225-G1227 PolarHBondContact O-N 2.69Å; G1227-K1231 WeakPolarHBondContact O-CG 3.47Å
1228	V	91.5	Very high	80.7	Confident	44 Å²	44	62.4 Å²	62.4	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-77.6	-55.2	174.5	-179.6	0	0	0	0	110.8	L1013 W1165 T1224 I1225 F1226 C1230 K1231 Y1232	L1013-V1228 HydrophobicContact CD2-CG1 4.33Å; W1165-V1228 HydrophobicContact CH2-CB 4.08Å; W1165-V1228 HydrophobicContact CH2-CG1 3.96Å; T1224-V1228 PolarHBondContact O-N 3.32Å; T1224-V1228 VanDerWaalsContact O-N 3.1Å; I1225-V1228 PolarHBondContact O-N 2.81Å; I1225-V1228 VanDerWaalsContact O-N 3.07Å; F1226-V1228 VanDerWaalsContact C-N 3.25Å; F1226-V1228 PolarHBondContact O-N 3.46Å; V1228-C1230 VanDerWaalsContact C-N 3.34Å; V1228-C1230 PolarHBondContact O-N 3.16Å; V1228-K1231 WeakPolarHBondContact O-CB 3.35Å; V1228-K1231 PolarHBondContact O-N 3.19Å; V1228-Y1232 HydrophobicContact CG1-CD2 4.27Å; V1228-Y1232 HydrophobicContact CG1-CE2 3.97Å; V1228-Y1232 WeakPolarHBondContact O-CD2 3.48Å
1229	L	92.2	Very high	77.8	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-58.8	-42.9	-175.8	-68.1	168.8	0	0	0	112.7	F1098 L1102 W1165 C1168 A1169 A1172 I1225 K1231 Y1232 L1233	F1098-L1229 HydrophobicContact CE1-CD2 4.41Å; F1098-L1229 HydrophobicContact CZ-CD2 4.29Å; L1102-L1229 HydrophobicContact CD1-CD2 3.98Å; L1102-L1229 HydrophobicContact CD2-CD2 4.43Å; W1165-L1229 HydrophobicContact CE3-CD2 4.37Å; W1165-L1229 HydrophobicContact CZ3-CD2 4.01Å; W1165-L1229 HydrophobicContact CZ3-CG 4.23Å; C1168-L1229 HydrophobicContact CB-CD1 4.15Å; A1169-L1229 HydrophobicContact CB-CD1 4.14Å; A1169-L1229 HydrophobicContact CB-CD2 4.44Å; A1172-L1229 HydrophobicContact CB-CB 4.36Å; A1172-L1229 HydrophobicContact CB-CD1 4.22Å; I1225-L1229 HydrophobicContact CG2-CD1 3.66Å; I1225-L1229 HydrophobicContact CG2-CG 4.19Å; I1225-L1229 WeakPolarHBondContact O-CG 3.21Å; I1225-L1229 PolarHBondContact O-N 2.71Å; L1229-K1231 PolarHBondContact O-N 3.06Å; L1229-Y1232 PolarHBondContact O-N 3.18Å; L1229-L1233 PolarHBondContact O-N 3.12Å
1230	C	86	Confident	75	Confident	26 Å²	26	74.4 Å²	74.4	18%	0.176	41%	0.411	C	S	.	.	H	α-helix	trans	-67.4	-19.2	179.1	-68.1	0	0	0	0	113.1	R1177 F1226 V1228 K1234	R1177-C1230 PolarHBondContact NH1-SG 3.24Å; R1177-C1230 VanDerWaalsContact NH1-SG 3.4Å; F1226-C1230 WeakPolarHBondContact O-CB 3.44Å; F1226-C1230 PolarHBondContact O-N 3.11Å; F1226-C1230 PolarHBondContact O-SG 3.28Å; V1228-C1230 VanDerWaalsContact C-N 3.34Å; V1228-C1230 PolarHBondContact O-N 3.16Å; C1230-K1234 WeakPolarHBondContact O-CB 3.4Å; C1230-K1234 VanDerWaalsContact O-CD 3.25Å; C1230-K1234 WeakPolarHBondContact O-CD 3.21Å; C1230-K1234 WeakPolarHBondContact O-CG 3.23Å; C1230-K1234 PolarHBondContact O-N 3.19Å
1231	K	84.6	Confident	72.4	Confident	153 Å²	153	78.4 Å²	78.4	67%	0.665	43%	0.425	S	S	*	.	H	α-helix	trans	-71.6	-41.4	173.1	-75.2	175.3	-179.1	-176	0	111	G1227 V1228 L1229	G1227-K1231 WeakPolarHBondContact O-CG 3.47Å; V1228-K1231 WeakPolarHBondContact O-CB 3.35Å; V1228-K1231 PolarHBondContact O-N 3.19Å; L1229-K1231 PolarHBondContact O-N 3.06Å
1232	Y	84.8	Confident	70.1	Confident	59 Å²	59	82.7 Å²	82.7	23%	0.231	45%	0.445	C	S	.	.	H	α-helix	trans	-75.1	-41.5	178.3	-69.3	-82.7	0	0	0	112.3	L1013 F1098 E1099 V1228 L1229 K1234 Y1235	L1013-Y1232 HydrophobicContact CD1-CE2 4.01Å; F1098-Y1232 AromaticContact CD1-CD1 3.96Å; F1098-Y1232 HydrophobicContact CD1-CD1 3.96Å; F1098-Y1232 AromaticContact CD1-CD2 3.81Å; F1098-Y1232 HydrophobicContact CD1-CD2 3.81Å; F1098-Y1232 HydrophobicContact CD1-CE1 4.25Å; F1098-Y1232 HydrophobicContact CD1-CE2 4.11Å; F1098-Y1232 AromaticContact CD1-CG 3.74Å; F1098-Y1232 HydrophobicContact CD1-CG 3.74Å; F1098-Y1232 AromaticContact CE1-CD2 3.97Å; F1098-Y1232 HydrophobicContact CE1-CD2 3.97Å; F1098-Y1232 HydrophobicContact CE1-CE2 4.37Å; F1098-Y1232 HydrophobicContact CE1-CG 4.24Å; E1099-Y1232 WeakPolarHBondContact CG-O 3.39Å; V1228-Y1232 HydrophobicContact CG1-CD2 4.27Å; V1228-Y1232 HydrophobicContact CG1-CE2 3.97Å; V1228-Y1232 WeakPolarHBondContact O-CD2 3.48Å; L1229-Y1232 PolarHBondContact O-N 3.18Å; Y1232-K1234 PolarHBondContact O-N 3.01Å; Y1232-Y1235 PolarHBondContact O-N 3.12Å
1233	L	79.4	Confident	67.8	Low	58 Å²	58	86 Å²	86	30%	0.304	47%	0.467	S	S	.	.	H	α-helix	trans	-70.4	-14.3	-179.2	-70.7	170.1	0	0	0	114.5	L1102 A1172 M1173 L1229	L1102-L1233 HydrophobicContact CB-CD2 4.04Å; L1102-L1233 HydrophobicContact CD1-CD2 4.31Å; L1102-L1233 HydrophobicContact CD1-CG 4.28Å; A1172-L1233 HydrophobicContact CB-CD1 3.89Å; M1173-L1233 HydrophobicContact CG-CD1 4.45Å; L1229-L1233 PolarHBondContact O-N 3.12Å
1234	K	65.5	Low	65.5	Low	158 Å²	158	91 Å²	91	69%	0.687	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-21.2	-179.9	-83	176.7	-175	-172.4	0	113.8	C1230 Y1232 G1236	C1230-K1234 WeakPolarHBondContact O-CB 3.4Å; C1230-K1234 VanDerWaalsContact O-CD 3.25Å; C1230-K1234 WeakPolarHBondContact O-CD 3.21Å; C1230-K1234 WeakPolarHBondContact O-CG 3.23Å; C1230-K1234 PolarHBondContact O-N 3.19Å; Y1232-K1234 PolarHBondContact O-N 3.01Å; K1234-G1236 VanDerWaalsContact C-N 3.34Å
1235	Y	50.8	Low	63.5	Low	176 Å²	176	95.5 Å²	95.5	69%	0.69	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.8	-175.1	-94.2	-86.4	0	0	0	114.3	Y1232 G1237	Y1232-Y1235 PolarHBondContact O-N 3.12Å; Y1235-G1237 PolarHBondContact O-N 3Å
1236	G	43.8	Very low	61.6	Low	71 Å²	71	103.2 Å²	103.2	73%	0.732	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	1.6	172.6	0	0	0	0	0	114.7	E1099 K1234	E1099-G1236 VanDerWaalsContact OE1-CA 3.28Å; E1099-G1236 WeakPolarHBondContact OE1-CA 3.21Å; E1099-G1236 PolarHBondContact OE1-N 3.21Å; K1234-G1236 VanDerWaalsContact C-N 3.34Å
1237	G	37.6	Very low	60.4	Low	45 Å²	45	107.1 Å²	107.1	46%	0.464	56%	0.56	S	S	.	*	S	Bend	trans	-136.6	102.5	165.4	0	0	0	0	0	108.6	Y1235 N1239	Y1235-G1237 PolarHBondContact O-N 3Å; G1237-N1239 PolarHBondContact O-N 3.36Å
1238	L	31.9	Very low	59.5	Low	158 Å²	158	112 Å²	112	83%	0.827	58%	0.575	S	S	*	*	S	Bend	trans	-48.5	124.2	166.6	-84.2	146.6	0	0	0	109.6
1239	N	34.3	Very low	59	Low	133 Å²	133	115.3 Å²	115.3	71%	0.711	60%	0.595	S	S	*	*	S	Bend	trans	91.6	134.9	173.3	-58.4	-32.6	0	0	0	118.2	G1237 F1241	G1237-N1239 PolarHBondContact O-N 3.36Å; N1239-F1241 PolarHBondContact O-N 3.18Å
1240	N	37.9	Very low	58.5	Low	177 Å²	177	120.6 Å²	120.6	95%	0.947	62%	0.618	S	S	*	*	S	Bend	trans	-62.3	33.6	173.8	-81.2	-38.3	0	0	0	115
1241	F	40.3	Very low	58.1	Low	179 Å²	179	127.7 Å²	127.7	79%	0.785	65%	0.648	S	S	*	*			trans	-116.6	111.9	166.3	-85.7	-89.5	0	0	0	107.4	N1239 P1243	N1239-F1241 PolarHBondContact O-N 3.18Å; F1241-P1243 WeakPolarHBondContact O-CD 3.41Å; F1241-P1243 VanDerWaalsContact O-N 3.13Å
1242	M	46.6	Very low	57.8	Low	121 Å²	121	125.3 Å²	125.3	60%	0.596	65%	0.648	S	S	*	*			trans	-58.4	118.9	159.3	-80.4	-172	96.9	0	0	106.1	L1244	M1242-L1244 PolarHBondContact O-N 3.38Å
1243	P	45.7	Very low	57.4	Low	70 Å²	70	128.8 Å²	128.8	46%	0.455	68%	0.678	S	S	.	*			trans	-57.8	134	175.6	18.4	-25.5	0	0	0	108.4	F1241 E1245 K1246	F1241-P1243 WeakPolarHBondContact O-CD 3.41Å; F1241-P1243 VanDerWaalsContact O-N 3.13Å; P1243-E1245 PolarHBondContact O-N 3.43Å; P1243-K1246 PolarHBondContact O-N 2.85Å
1244	L	48.2	Very low	56.9	Low	156 Å²	156	130.4 Å²	130.4	82%	0.817	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-50.4	-25	178.3	-99.8	136.7	0	0	0	112.4	M1242 K1246 V1247	M1242-L1244 PolarHBondContact O-N 3.38Å; L1244-K1246 PolarHBondContact O-N 3.25Å; L1244-K1246 VanDerWaalsContact O-N 3.14Å; L1244-V1247 PolarHBondContact O-N 3.16Å; L1244-V1247 VanDerWaalsContact O-N 3.17Å
1245	E	50.6	Low	56.7	Low	186 Å²	186	132.1 Å²	132.1	87%	0.869	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-57.3	-20.6	174.2	-67.3	-176.9	158.1	0	0	115.1	P1243	P1243-E1245 PolarHBondContact O-N 3.43Å
1246	K	56.4	Low	56.8	Low	164 Å²	164	131.6 Å²	131.6	71%	0.713	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-96.6	-1.3	178.7	-74	-171.2	177	177.2	0	114.8	P1243 L1244	P1243-K1246 PolarHBondContact O-N 2.85Å; L1244-K1246 PolarHBondContact O-N 3.25Å; L1244-K1246 VanDerWaalsContact O-N 3.14Å
1247	V	69.6	Low	57.1	Low	83 Å²	83	136.7 Å²	136.7	50%	0.503	72%	0.723	S	S	.	*	S	Bend	trans	-101.9	110.9	-178.6	-176.3	0	0	0	0	109.4	L1244 V1249	L1244-V1247 PolarHBondContact O-N 3.16Å; L1244-V1247 VanDerWaalsContact O-N 3.17Å; V1247-V1249 PolarHBondContact O-N 2.9Å
1248	Q	72.6	Confident	57.3	Low	134 Å²	134	143.6 Å²	143.6	63%	0.626	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-69.1	116.7	173.2	-170.9	177	-0.2	0	0	109.6	F1250	Q1248-F1250 HydrophobicContact CG-CE1 4.48Å; Q1248-F1250 HydrophobicContact CG-CZ 4.49Å
1249	V	79.6	Confident	57.8	Low	113 Å²	113	145.1 Å²	145.1	69%	0.685	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-91.1	130.1	179.6	-175.1	0	0	0	0	109.3	V1247	V1247-V1249 PolarHBondContact O-N 2.9Å
1250	F	81.9	Confident	57.8	Low	113 Å²	113	151.9 Å²	151.9	50%	0.496	78%	0.776	S	S	.	*	P	Polyproline II helix	trans	-93.8	135.5	175	-57.9	-74.9	0	0	0	110.2	V1124 Q1248	V1124-F1250 HydrophobicContact CB-CZ 4.31Å; V1124-F1250 HydrophobicContact CG1-CZ 4.22Å; V1124-F1250 HydrophobicContact CG2-CE1 3.88Å; V1124-F1250 HydrophobicContact CG2-CE2 4.43Å; V1124-F1250 HydrophobicContact CG2-CZ 3.71Å; Q1248-F1250 HydrophobicContact CG-CE1 4.48Å; Q1248-F1250 HydrophobicContact CG-CZ 4.49Å
1251	H	77.5	Confident	58.7	Low	175 Å²	175	150.7 Å²	150.7	81%	0.81	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.8	136.2	176.8	-68.9	-64.7	0	0	0	110.6
1252	P	78.6	Confident	59.7	Low	103 Å²	103	149.2 Å²	149.2	67%	0.669	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.4	157	164.6	29.1	-33.5	0	0	0	109.2	A1254	P1252-A1254 PolarHBondContact O-N 2.91Å
1253	P	76	Confident	60.4	Low	132 Å²	132	150.7 Å²	150.7	86%	0.857	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-53.7	119.7	179.3	-9.3	13.3	0	0	0	110.5	K1255	P1253-K1255 PolarHBondContact O-N 2.93Å
1254	A	69.4	Low	61.3	Low	91 Å²	91	155.5 Å²	155.5	75%	0.752	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.3	120.7	178.5	0	0	0	0	0	109.5	P1252 N1256	P1252-A1254 PolarHBondContact O-N 2.91Å; A1254-N1256 PolarHBondContact O-N 3.22Å
1255	K	60.8	Low	62.1	Low	195 Å²	195	155.4 Å²	155.4	85%	0.848	79%	0.793	S	S	*	*			trans	-67.9	113.6	167.8	-102.9	-177.6	174.3	-179.7	0	107.8	P1253 M1257	P1253-K1255 PolarHBondContact O-N 2.93Å; K1255-M1257 PolarHBondContact O-N 3.27Å
1256	N	54.4	Low	62.9	Low	164 Å²	164	153.4 Å²	153.4	88%	0.877	79%	0.788	S	S	*	*			trans	-57.8	101.4	169.3	-77.2	-16.4	0	0	0	109.7	A1254	A1254-N1256 PolarHBondContact O-N 3.22Å
1257	M	48.3	Very low	63.4	Low	178 Å²	178	152.6 Å²	152.6	88%	0.877	79%	0.794	S	S	*	*			trans	-104.9	81.5	159.8	-83.4	-172.4	179.4	0	0	108.5	K1255	K1255-M1257 PolarHBondContact O-N 3.27Å
1258	Q	42.1	Very low	62.9	Low	191 Å²	191	158 Å²	158	89%	0.893	82%	0.816	S	S	*	*			trans	-122.4	92.9	152.7	-87.4	-173.7	-19.6	0	0	106.4
1259	M	43	Very low	62.1	Low	190 Å²	190	160 Å²	160	94%	0.936	83%	0.832	S	S	*	*			trans	163.1	81.2	152.6	-92	-168.3	-173.8	0	0	109.7
1260	Q	33.2	Very low	60.5	Low	275 Å²	275	164.3 Å²	164.3	100%	1.285	85%	0.845	S	S	*	*				179.7	0	128.7	-99.2	-177.9	4	0	0	110.2

Retrieved 1,260 of 1,260 residues in 2760.1 ms (Link to these results)

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