X6RE05_HUMAN Loading...

Ubiquitin protein ligase E3 component n-recognin 4

AlphaFold DB , UniProt , Accession X6RE05, Species HUMAN (Homo sapiens, Human), Gene UBR4, Length 984 aa.

						>X6RE05_HUMAN|X6RE05|UBR4
DFPFTREEALQADKKLNLFIGASVDPAGVTMIDAVKIYGKTKEQFGWPDEPPEEFPSASVSNICPSNLNQSNGTGDSDSAAPTTTSGTVLERLVVSSLEALESCFAVGPIIEKERNKNAAQELATLLLSLPAPASVQQQSKSLLASLHTSRSAYHSHKDQALLSKAVQCLNTSSKEGKDLDPEVFQRLVITARSIAIMRPNNLVHFTESKLPQMETDCFFPRCACWSLGIVGILIGAPLETPSPEGMDEGKEPQKQLEGDCCSFITQLVNHFWKLHASKPKNAFLAPACLPGLTHIEATVNALVDIIHGYCTCELDCINTASKIYMQMLLCPDPAVSFSCKQALIRVLRPRNKRRHVTLPSSPRSNTPMGDKDDDDDDDADEKMQSSGIPNGGHIRQESQEQSEVDHGDFEMVSESMVLETAENVNNGNPSPLEALLAGAEGFPPMLDIPPDADDETMVELAIALSLQQDQQAPASDDEGSTAATDGSTLRTSPADHGGSVGSESGGSAVDSVAGEHSVSGRSSAYGDATAEGHPAGPGSVSSSTGAISTTTGHQEGDGSEGEGEGETEGDVHTSNRLHMVRLMLLERLLQTLPQLRNVGGVRAIPYMQVILMLTTDLDGEDEKDKGALDNLLSQLIAELGMDKKDVSKKNERSALNEVHLVVMRLLSVFMSRTKSGSKSSICESSSLISSATAAALLSSGAVDYCLHVLKSLLEYWKSQQNDEEPVATSQLLKPHTTSSPPDMSPFFLRQYVKGHAADVFEAYTQLLTEMVLRLPYQIKKITDTNSRIPPPVFDHSWFYFLSEYLMIQQTPFVRRQVRKLLLFICGSKEKYRQLRDLHTLDSHVRGIKKLLEEQGIFLRASVVTASSGSALQYDTLISLMEHLKACAEIAAQRTINWQKFCIKDDSVLYFLLQVSFLVDEGVSPVLLQLLSCALCGSKVLAALAASSGSSSASSSSAPVAASSGQATTQSKSSTKKSKKEEKE
					

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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	D	47.9	Very low	58.2	Low	99 Å²	99	94.6 Å²	94.6	53%	0.529	46%	0.463	S	S	.	.				0	148.3	0	-57.7	-12.2	0	0	0	109.4	F45 W47	D1-F45 HydrophobicContact CB-CE2 3.75Å; D1-F45 HydrophobicContact CB-CZ 3.7Å; D1-F45 WeakPolarHBondContact OD2-CE2 3.37Å; D1-F45 WeakPolarHBondContact OD2-CZ 3.31Å; D1-W47 WeakPolarHBondContact O-CZ3 3.37Å
2	F	54.7	Low	58.2	Low	110 Å²	110	91.2 Å²	91.2	48%	0.482	46%	0.461	S	S	.	.			trans	-124.8	99.8	178.8	-73.5	-78.7	0	0	0	109.3	L18	F2-L18 HydrophobicContact CE1-CD1 4.35Å; F2-L18 HydrophobicContact CE2-CD1 3.8Å; F2-L18 HydrophobicContact CZ-CD1 3.71Å
3	P	54.8	Low	57.9	Low	14 Å²	14	94 Å²	94	9%	0.091	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-84.1	139.8	173.3	32.3	-31	0	0	0	111	K42 F45 W47	P3-K42 HydrophobicContact CB-CB 4.49Å; P3-K42 HydrophobicContact CB-CG 3.99Å; P3-K42 HydrophobicContact CG-CG 4.06Å; P3-K42 WeakPolarHBondContact O-CE 3.46Å; P3-F45 HydrophobicContact CB-CB 4.17Å; P3-F45 HydrophobicContact CG-CB 4.34Å; P3-F45 HydrophobicContact CG-CG 4.45Å; P3-W47 HydrophobicContact CG-CB 4.05Å; P3-W47 HydrophobicContact CG-CD2 3.74Å; P3-W47 HydrophobicContact CG-CE3 3.51Å; P3-W47 HydrophobicContact CG-CG 3.98Å; P3-W47 HydrophobicContact CG-CZ3 4.22Å
4	F	57.4	Low	57.9	Low	52 Å²	52	102.1 Å²	102.1	23%	0.228	51%	0.509	C	S	.	.	B	Isolated β-bridge	trans	-96.7	153.6	173.9	-65	-79.6	0	0	0	110.5	E8 A9 L16 T41 K42	F4-E8 VanDerWaalsContact CA-OE2 3.3Å; F4-E8 WeakPolarHBondContact CA-OE2 3.43Å; F4-E8 HydrophobicContact CB-CB 4.21Å; F4-E8 HydrophobicContact CD1-CB 4.11Å; F4-A9 HydrophobicContact CB-CB 4.22Å; F4-L16 HydrophobicContact CE1-CD1 4Å; F4-L16 HydrophobicContact CZ-CD1 3.83Å; F4-L16 HydrophobicContact CZ-CD2 4.09Å; F4-T41 CarbonylContact O-C 3.58Å; F4-T41 VanDerWaalsContact O-CA 3.23Å; F4-T41 WeakPolarHBondContact O-CA 3.47Å; F4-K42 PolarHBondContact O-N 3.38Å; F4-K42 VanDerWaalsContact O-N 3.12Å
5	T	60.7	Low	57.8	Low	30 Å²	30	105 Å²	105	18%	0.184	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-74.4	171	159.4	81.4	0	0	0	0	110.3	E7 E8 A9 K42	T5-E7 VanDerWaalsContact C-N 3.26Å; T5-E7 WeakPolarHBondContact CB-OE2 3.39Å; T5-E7 PolarHBondContact O-N 2.87Å; T5-E7 PolarHBondContact OG1-N 2.84Å; T5-E7 PolarHBondContact OG1-OE2 3.26Å; T5-E8 HydrophobicContact CG2-CG 4.35Å; T5-E8 PolarHBondContact N-OE2 3.26Å; T5-E8 WeakPolarHBondContact OG1-CG 3.31Å; T5-E8 PolarHBondContact OG1-N 2.95Å; T5-E8 VanDerWaalsContact OG1-N 3.09Å; T5-A9 WeakPolarHBondContact O-CB 3.38Å; T5-A9 PolarHBondContact O-N 2.79Å; T5-A9 VanDerWaalsContact O-N 3.11Å; T5-K42 HydrophobicContact CG2-CD 3.75Å; T5-K42 HydrophobicContact CG2-CG 4.21Å
6	R	57.2	Low	57.9	Low	181 Å²	181	104 Å²	104	68%	0.683	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-33.2	174.4	-170.9	173.7	-178.5	167.6	-0.3	112	L10	R6-L10 HydrophobicContact CG-CD1 4.38Å; R6-L10 WeakPolarHBondContact O-CD1 3.46Å; R6-L10 WeakPolarHBondContact O-CG 3.43Å; R6-L10 PolarHBondContact O-N 3.37Å
7	E	63	Low	58	Low	112 Å²	112	102.9 Å²	102.9	52%	0.523	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-46.8	177.3	-55.1	68	-145.4	0	0	111	T5 A9 L10 Q11	T5-E7 VanDerWaalsContact C-N 3.26Å; T5-E7 WeakPolarHBondContact CB-OE2 3.39Å; T5-E7 PolarHBondContact O-N 2.87Å; T5-E7 PolarHBondContact OG1-N 2.84Å; T5-E7 PolarHBondContact OG1-OE2 3.26Å; E7-A9 VanDerWaalsContact C-N 3.29Å; E7-A9 PolarHBondContact O-N 3.01Å; E7-L10 CarbonylContact O-C 3.37Å; E7-L10 WeakPolarHBondContact O-CA 3.46Å; E7-L10 PolarHBondContact O-N 3.26Å; E7-Q11 WeakPolarHBondContact O-CG 3.47Å; E7-Q11 PolarHBondContact O-N 2.98Å
8	E	62.9	Low	58	Low	76 Å²	76	101.2 Å²	101.2	36%	0.355	50%	0.503	S	S	.	.	H	α-helix	trans	-57.6	-43.2	177.3	-70.6	170.8	168.3	0	0	111.3	F4 T5 L10 Q11 A12 K42	F4-E8 VanDerWaalsContact CA-OE2 3.3Å; F4-E8 WeakPolarHBondContact CA-OE2 3.43Å; F4-E8 HydrophobicContact CB-CB 4.21Å; F4-E8 HydrophobicContact CD1-CB 4.11Å; T5-E8 HydrophobicContact CG2-CG 4.35Å; T5-E8 PolarHBondContact N-OE2 3.26Å; T5-E8 WeakPolarHBondContact OG1-CG 3.31Å; T5-E8 PolarHBondContact OG1-N 2.95Å; T5-E8 VanDerWaalsContact OG1-N 3.09Å; E8-L10 PolarHBondContact O-N 3.37Å; E8-Q11 PolarHBondContact O-N 3.23Å; E8-A12 WeakPolarHBondContact O-CB 3.33Å; E8-A12 PolarHBondContact O-N 3.05Å; E8-K42 IonicContact OE1-NZ 3.77Å; E8-K42 PolarHBondContact OE1-NZ 3.17Å; E8-K42 WeakPolarHBondContact OE2-CE 3.27Å; E8-K42 IonicContact OE2-NZ 2.71Å; E8-K42 PolarHBondContact OE2-NZ 2.71Å
9	A	62.1	Low	58	Low	63 Å²	63	105.7 Å²	105.7	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-68.4	-19	176.2	0	0	0	0	0	114.2	F4 T5 E7	F4-A9 HydrophobicContact CB-CB 4.22Å; T5-A9 WeakPolarHBondContact O-CB 3.38Å; T5-A9 PolarHBondContact O-N 2.79Å; T5-A9 VanDerWaalsContact O-N 3.11Å; E7-A9 VanDerWaalsContact C-N 3.29Å; E7-A9 PolarHBondContact O-N 3.01Å
10	L	61.5	Low	58.7	Low	142 Å²	142	105.2 Å²	105.2	74%	0.743	52%	0.518	S	S	*	.	H	α-helix	trans	-92.8	-21.7	174.9	-73	169	0	0	0	113	R6 E7 E8	R6-L10 HydrophobicContact CG-CD1 4.38Å; R6-L10 WeakPolarHBondContact O-CD1 3.46Å; R6-L10 WeakPolarHBondContact O-CG 3.43Å; R6-L10 PolarHBondContact O-N 3.37Å; E7-L10 CarbonylContact O-C 3.37Å; E7-L10 WeakPolarHBondContact O-CA 3.46Å; E7-L10 PolarHBondContact O-N 3.26Å; E8-L10 PolarHBondContact O-N 3.37Å
11	Q	58.4	Low	58.8	Low	162 Å²	162	103 Å²	103	76%	0.757	52%	0.523	S	S	*	.	H	α-helix	trans	-94.1	-16.7	177.2	-68.6	-178.2	2.1	0	0	113.6	E7 E8 D13	E7-Q11 WeakPolarHBondContact O-CG 3.47Å; E7-Q11 PolarHBondContact O-N 2.98Å; E8-Q11 PolarHBondContact O-N 3.23Å; Q11-D13 PolarHBondContact O-N 2.93Å
12	A	58.3	Low	59.3	Low	53 Å²	53	102.9 Å²	102.9	44%	0.438	54%	0.535	S	S	.	.			trans	-71.3	85.6	178.7	0	0	0	0	0	112.6	E8 K14	E8-A12 WeakPolarHBondContact O-CB 3.33Å; E8-A12 PolarHBondContact O-N 3.05Å; A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 2.87Å
13	D	54.4	Low	59.4	Low	128 Å²	128	100 Å²	100	68%	0.684	53%	0.529	S	S	*	.			trans	-68	86.8	176.8	-174.4	19.2	0	0	0	112	Q11 K15	Q11-D13 PolarHBondContact O-N 2.93Å; D13-K15 PolarHBondContact O-N 3.23Å
14	K	57.1	Low	59.1	Low	207 Å²	207	106.5 Å²	106.5	90%	0.9	57%	0.568	S	S	*	*	S	Bend	trans	58.3	-7.5	169.6	-62.3	168.7	-173.1	161.8	0	117.2	A12	A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 2.87Å
15	K	56.7	Low	58.9	Low	146 Å²	146	106.9 Å²	106.9	64%	0.635	57%	0.572	S	S	*	*			trans	-132.1	117.6	-172.5	-166	-168.9	-171.5	-148.5	0	111.6	D13 N17	D13-K15 PolarHBondContact O-N 3.23Å; K15-N17 WeakPolarHBondContact CE-OD1 3.49Å; K15-N17 PolarHBondContact NZ-OD1 3.5Å
16	L	59.1	Low	58	Low	89 Å²	89	112 Å²	112	47%	0.466	61%	0.606	S	S	.	*			trans	-92	129.9	164.3	-177.4	62.3	0	0	0	109.1	F4 I37	F4-L16 HydrophobicContact CE1-CD1 4Å; F4-L16 HydrophobicContact CZ-CD1 3.83Å; F4-L16 HydrophobicContact CZ-CD2 4.09Å; L16-I37 HydrophobicContact CD2-CD1 3.95Å
17	N	59.7	Low	57.5	Low	86 Å²	86	107.1 Å²	107.1	46%	0.46	61%	0.605	S	S	.	*			trans	-107.4	120.3	169.6	-52	-77.7	0	0	0	108	K15 F19	K15-N17 WeakPolarHBondContact CE-OD1 3.49Å; K15-N17 PolarHBondContact NZ-OD1 3.5Å; N17-F19 HydrophobicContact CB-CE2 3.84Å; N17-F19 HydrophobicContact CB-CZ 4.17Å
18	L	59	Low	56.8	Low	72 Å²	72	104.2 Å²	104.2	38%	0.377	61%	0.605	S	S	.	*			trans	-104.9	122.6	174.3	-173.7	72.5	0	0	0	108.5	F2 I20 V35	F2-L18 HydrophobicContact CE1-CD1 4.35Å; F2-L18 HydrophobicContact CE2-CD1 3.8Å; F2-L18 HydrophobicContact CZ-CD1 3.71Å; L18-I20 HydrophobicContact CD2-CD1 4.04Å; L18-I20 HydrophobicContact CD2-CG1 4.42Å; L18-I20 HydrophobicContact CG-CD1 4.13Å; L18-I20 HydrophobicContact CG-CG1 4.45Å; L18-V35 HydrophobicContact CD2-CG1 4.25Å; L18-V35 HydrophobicContact CD2-CG2 4.2Å
19	F	57.5	Low	56.2	Low	186 Å²	186	104.3 Å²	104.3	82%	0.816	61%	0.611	S	S	*	*			trans	-104.9	129.2	175	-62.1	-84.5	0	0	0	109	N17	N17-F19 HydrophobicContact CB-CE2 3.84Å; N17-F19 HydrophobicContact CB-CZ 4.17Å
20	I	71	Confident	55.9	Low	95 Å²	95	104.4 Å²	104.4	49%	0.487	61%	0.605	S	S	.	*			trans	-116.7	128.4	175.6	-53.7	99.7	0	0	0	107.5	L18 T30 I32	L18-I20 HydrophobicContact CD2-CD1 4.04Å; L18-I20 HydrophobicContact CD2-CG1 4.42Å; L18-I20 HydrophobicContact CG-CD1 4.13Å; L18-I20 HydrophobicContact CG-CG1 4.45Å; I20-T30 HydrophobicContact CG2-CG2 4Å; I20-I32 HydrophobicContact CB-CD1 4.32Å; I20-I32 HydrophobicContact CD1-CD1 3.76Å; I20-I32 HydrophobicContact CG1-CD1 3.72Å; I20-I32 HydrophobicContact CG2-CD1 4.15Å
21	G	61.9	Low	55.5	Low	61 Å²	61	105.5 Å²	105.5	63%	0.629	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-72.4	164.5	175.1	0	0	0	0	0	112.4
22	A	58.4	Low	55.5	Low	95 Å²	95	102.2 Å²	102.2	79%	0.785	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-63.5	138.3	172.9	0	0	0	0	0	111
23	S	57	Low	55.2	Low	49 Å²	49	107.9 Å²	107.9	34%	0.343	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-59.8	146.2	171.8	-173.6	0	0	0	0	111.9	D25 V29 T30	S23-D25 PolarHBondContact O-N 3.48Å; S23-D25 VanDerWaalsContact OG-CB 3.31Å; S23-D25 WeakPolarHBondContact OG-CB 3.43Å; S23-D25 PolarHBondContact OG-N 3.17Å; S23-V29 WeakPolarHBondContact CB-O 3.46Å; S23-V29 PolarHBondContact OG-O 2.91Å; S23-T30 VanDerWaalsContact CB-OG1 3.28Å; S23-T30 WeakPolarHBondContact CB-OG1 3.14Å; S23-T30 PolarHBondContact N-OG1 3.04Å
24	V	48.7	Very low	55.3	Low	151 Å²	151	104.8 Å²	104.8	92%	0.915	61%	0.61	S	S	*	*			trans	-83.5	4.7	173.8	-145.8	0	0	0	0	112.1
25	D	53.4	Low	55.3	Low	60 Å²	60	98.5 Å²	98.5	32%	0.321	59%	0.589	S	S	.	*			trans	-61.5	128.9	172.6	166.1	35.3	0	0	0	111.8	S23 A27 G28 V29	S23-D25 PolarHBondContact O-N 3.48Å; S23-D25 VanDerWaalsContact OG-CB 3.31Å; S23-D25 WeakPolarHBondContact OG-CB 3.43Å; S23-D25 PolarHBondContact OG-N 3.17Å; D25-A27 VanDerWaalsContact CG-N 3.33Å; D25-A27 PolarHBondContact O-N 2.91Å; D25-A27 VanDerWaalsContact O-N 3.14Å; D25-A27 PolarHBondContact OD1-N 2.97Å; D25-A27 WeakPolarHBondContact OD2-CB 3.37Å; D25-A27 PolarHBondContact OD2-N 3.39Å; D25-G28 WeakPolarHBondContact O-CA 3.22Å; D25-G28 PolarHBondContact O-N 3.17Å; D25-G28 PolarHBondContact OD2-N 2.95Å; D25-V29 WeakPolarHBondContact OD2-CB 3.18Å; D25-V29 PolarHBondContact OD2-N 3.09Å
26	P	41.3	Very low	55	Low	137 Å²	137	97.3 Å²	97.3	89%	0.89	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-21.5	173.2	-26.8	35.8	0	0	0	115.7	G28	P26-G28 VanDerWaalsContact C-N 3.35Å
27	A	45.5	Very low	54.9	Low	79 Å²	79	97.8 Å²	97.8	65%	0.653	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-0.5	172.1	0	0	0	0	0	113.7	D25 V29	D25-A27 VanDerWaalsContact CG-N 3.33Å; D25-A27 PolarHBondContact O-N 2.91Å; D25-A27 VanDerWaalsContact O-N 3.14Å; D25-A27 PolarHBondContact OD1-N 2.97Å; D25-A27 WeakPolarHBondContact OD2-CB 3.37Å; D25-A27 PolarHBondContact OD2-N 3.39Å; A27-V29 VanDerWaalsContact C-N 3.25Å; A27-V29 HydrophobicContact CB-CG2 4.08Å; A27-V29 PolarHBondContact O-N 2.9Å
28	G	48.2	Very low	54.5	Low	52 Å²	52	100.1 Å²	100.1	54%	0.536	59%	0.589	S	S	.	*			trans	73	8.6	177.7	0	0	0	0	0	114.9	D25 P26 T30	D25-G28 WeakPolarHBondContact O-CA 3.22Å; D25-G28 PolarHBondContact O-N 3.17Å; D25-G28 PolarHBondContact OD2-N 2.95Å; P26-G28 VanDerWaalsContact C-N 3.35Å; G28-T30 PolarHBondContact O-N 3.45Å
29	V	50.4	Low	54.4	Low	78 Å²	78	100.9 Å²	100.9	47%	0.473	62%	0.615	S	S	.	*			trans	-81.2	115.6	-171.1	-167.9	0	0	0	0	110.4	S23 D25 A27 M31	S23-V29 WeakPolarHBondContact CB-O 3.46Å; S23-V29 PolarHBondContact OG-O 2.91Å; D25-V29 WeakPolarHBondContact OD2-CB 3.18Å; D25-V29 PolarHBondContact OD2-N 3.09Å; A27-V29 VanDerWaalsContact C-N 3.25Å; A27-V29 HydrophobicContact CB-CG2 4.08Å; A27-V29 PolarHBondContact O-N 2.9Å; V29-M31 HydrophobicContact CG1-CG 3.59Å; V29-M31 HydrophobicContact CG1-SD 4.46Å
30	T	56.9	Low	54.4	Low	65 Å²	65	97.6 Å²	97.6	40%	0.399	60%	0.6	S	S	.	*			trans	-101.5	85.5	176.1	-49.7	0	0	0	0	109.4	I20 S23 G28	I20-T30 HydrophobicContact CG2-CG2 4Å; S23-T30 VanDerWaalsContact CB-OG1 3.28Å; S23-T30 WeakPolarHBondContact CB-OG1 3.14Å; S23-T30 PolarHBondContact N-OG1 3.04Å; G28-T30 PolarHBondContact O-N 3.45Å
31	M	52.3	Low	53.8	Low	165 Å²	165	94.7 Å²	94.7	81%	0.813	59%	0.586	S	S	*	*			trans	-84.9	136.6	178.4	-63.1	-152.2	-65.4	0	0	112.1	V29	V29-M31 HydrophobicContact CG1-CG 3.59Å; V29-M31 HydrophobicContact CG1-SD 4.46Å
32	I	59.2	Low	53.7	Low	93 Å²	93	94.2 Å²	94.2	48%	0.477	57%	0.567	S	S	.	*			trans	-127.6	112.6	173	-54.9	172.3	0	0	0	107.1	I20 V35	I20-I32 HydrophobicContact CB-CD1 4.32Å; I20-I32 HydrophobicContact CD1-CD1 3.76Å; I20-I32 HydrophobicContact CG1-CD1 3.72Å; I20-I32 HydrophobicContact CG2-CD1 4.15Å; I32-V35 HydrophobicContact CG2-CG2 3.85Å
33	D	52.1	Low	53.9	Low	171 Å²	171	96.2 Å²	96.2	91%	0.914	56%	0.56	S	S	*	*			trans	-71.5	-54.5	-176.7	177.9	50.3	0	0	0	112
34	A	55.5	Low	54	Low	63 Å²	63	100.3 Å²	100.3	52%	0.521	57%	0.574	S	S	.	*			trans	-153.4	138.3	174.2	0	0	0	0	0	112.5
35	V	57.7	Low	54.4	Low	75 Å²	75	97.6 Å²	97.6	46%	0.455	55%	0.55	S	S	.	.			trans	-99.9	121.7	166.4	-177.6	0	0	0	0	108.7	L18 I32 I37	L18-V35 HydrophobicContact CD2-CG1 4.25Å; L18-V35 HydrophobicContact CD2-CG2 4.2Å; I32-V35 HydrophobicContact CG2-CG2 3.85Å; V35-I37 HydrophobicContact CG1-CG1 4.2Å
36	K	49.5	Very low	54.6	Low	121 Å²	121	97.8 Å²	97.8	53%	0.526	57%	0.566	S	S	.	*			trans	-116.5	125.1	176	-66.3	173.4	-177.3	167.3	0	109.4	Y38	K36-Y38 HydrophobicContact CB-CD2 4.42Å; K36-Y38 HydrophobicContact CB-CE2 3.73Å; K36-Y38 HydrophobicContact CD-CE2 4.45Å
37	I	58.8	Low	55.5	Low	100 Å²	100	96.5 Å²	96.5	51%	0.513	54%	0.544	S	S	.	.			trans	-114.7	127	-178.7	-54.8	172.9	0	0	0	107.5	L16 V35	L16-I37 HydrophobicContact CD2-CD1 3.95Å; V35-I37 HydrophobicContact CG1-CG1 4.2Å
38	Y	50.6	Low	56	Low	134 Å²	134	96.9 Å²	96.9	53%	0.525	54%	0.539	S	S	.	.			trans	-132.6	129.3	-179	-65.3	-69.4	0	0	0	110.1	K36 K40	K36-Y38 HydrophobicContact CB-CD2 4.42Å; K36-Y38 HydrophobicContact CB-CE2 3.73Å; K36-Y38 HydrophobicContact CD-CE2 4.45Å; Y38-K40 VanDerWaalsContact C-N 3.3Å; Y38-K40 PolarHBondContact O-N 3.35Å
39	G	56.1	Low	56.2	Low	89 Å²	89	101.9 Å²	101.9	92%	0.918	55%	0.554	S	S	*	*			trans	-74.4	77.7	175.8	0	0	0	0	0	112.3
40	K	57.5	Low	56.1	Low	117 Å²	117	106 Å²	106	51%	0.509	57%	0.568	S	S	.	*			trans	-127.1	150.3	167.3	-73.9	-170.8	175.4	-173.9	0	109.9	Y38	Y38-K40 VanDerWaalsContact C-N 3.3Å; Y38-K40 PolarHBondContact O-N 3.35Å
41	T	59	Low	55.7	Low	33 Å²	33	108 Å²	108	20%	0.202	58%	0.582	C	S	.	*	B	Isolated β-bridge	trans	-75.5	156.9	175.3	58.3	0	0	0	0	111.8	F4 E43 Q44 F45	F4-T41 CarbonylContact O-C 3.58Å; F4-T41 VanDerWaalsContact O-CA 3.23Å; F4-T41 WeakPolarHBondContact O-CA 3.47Å; T41-E43 WeakPolarHBondContact CB-OE1 3.37Å; T41-E43 WeakPolarHBondContact CB-OE2 3.44Å; T41-E43 PolarHBondContact O-N 3.32Å; T41-E43 PolarHBondContact OG1-OE2 2.86Å; T41-Q44 PolarHBondContact O-N 3.01Å; T41-Q44 VanDerWaalsContact O-N 3.11Å; T41-Q44 WeakPolarHBondContact OG1-CG 3.15Å; T41-F45 PolarHBondContact O-N 2.87Å
42	K	60.6	Low	55.3	Low	52 Å²	52	104.1 Å²	104.1	23%	0.226	57%	0.569	C	S	.	*	H	α-helix	trans	-55.4	-40.4	176.4	-59	-167.4	-173.4	164.8	0	111.9	P3 F4 T5 E8 Q44 F45 G46 W47	P3-K42 HydrophobicContact CB-CB 4.49Å; P3-K42 HydrophobicContact CB-CG 3.99Å; P3-K42 HydrophobicContact CG-CG 4.06Å; P3-K42 WeakPolarHBondContact O-CE 3.46Å; F4-K42 PolarHBondContact O-N 3.38Å; F4-K42 VanDerWaalsContact O-N 3.12Å; T5-K42 HydrophobicContact CG2-CD 3.75Å; T5-K42 HydrophobicContact CG2-CG 4.21Å; E8-K42 IonicContact OE1-NZ 3.77Å; E8-K42 PolarHBondContact OE1-NZ 3.17Å; E8-K42 WeakPolarHBondContact OE2-CE 3.27Å; E8-K42 IonicContact OE2-NZ 2.71Å; E8-K42 PolarHBondContact OE2-NZ 2.71Å; K42-Q44 VanDerWaalsContact C-N 3.34Å; K42-Q44 PolarHBondContact O-N 3.14Å; K42-F45 PolarHBondContact O-N 3.1Å; K42-F45 VanDerWaalsContact O-N 3.17Å; K42-G46 PolarHBondContact O-N 2.6Å; K42-G46 VanDerWaalsContact O-N 3.15Å; K42-W47 HydrophobicContact CB-CB 4.27Å; K42-W47 PolarHBondContact O-N 2.92Å
43	E	60.7	Low	54.8	Low	137 Å²	137	109.2 Å²	109.2	64%	0.64	59%	0.591	S	S	*	*	H	α-helix	trans	-62.6	-37	177.7	-25	83.7	-140.1	0	0	112.8	T41 F45 G46	T41-E43 WeakPolarHBondContact CB-OE1 3.37Å; T41-E43 WeakPolarHBondContact CB-OE2 3.44Å; T41-E43 PolarHBondContact O-N 3.32Å; T41-E43 PolarHBondContact OG1-OE2 2.86Å; E43-F45 VanDerWaalsContact C-N 3.3Å; E43-F45 PolarHBondContact O-N 3.43Å; E43-G46 PolarHBondContact O-N 3.18Å
44	Q	59.9	Low	54.2	Low	135 Å²	135	109.9 Å²	109.9	63%	0.631	59%	0.589	S	S	*	*	H	α-helix	trans	-76.2	-15.1	178.5	-73.4	-173.7	17.7	0	0	114.2	T41 K42	T41-Q44 PolarHBondContact O-N 3.01Å; T41-Q44 VanDerWaalsContact O-N 3.11Å; T41-Q44 WeakPolarHBondContact OG1-CG 3.15Å; K42-Q44 VanDerWaalsContact C-N 3.34Å; K42-Q44 PolarHBondContact O-N 3.14Å
45	F	56.7	Low	53.3	Low	93 Å²	93	114.6 Å²	114.6	41%	0.408	60%	0.597	S	S	.	*	H	α-helix	trans	-94.8	-18.3	175.8	-162.9	-89.9	0	0	0	112.3	D1 P3 T41 K42 E43 W47	D1-F45 HydrophobicContact CB-CE2 3.75Å; D1-F45 HydrophobicContact CB-CZ 3.7Å; D1-F45 WeakPolarHBondContact OD2-CE2 3.37Å; D1-F45 WeakPolarHBondContact OD2-CZ 3.31Å; P3-F45 HydrophobicContact CB-CB 4.17Å; P3-F45 HydrophobicContact CG-CB 4.34Å; P3-F45 HydrophobicContact CG-CG 4.45Å; T41-F45 PolarHBondContact O-N 2.87Å; K42-F45 PolarHBondContact O-N 3.1Å; K42-F45 VanDerWaalsContact O-N 3.17Å; E43-F45 VanDerWaalsContact C-N 3.3Å; E43-F45 PolarHBondContact O-N 3.43Å; F45-W47 VanDerWaalsContact C-N 3.34Å; F45-W47 AromaticContact CD1-CE3 3.74Å; F45-W47 HydrophobicContact CD1-CE3 3.74Å; F45-W47 HydrophobicContact CD1-CZ3 4.43Å; F45-W47 AromaticContact CE1-CE3 3.85Å; F45-W47 HydrophobicContact CE1-CE3 3.85Å; F45-W47 HydrophobicContact CE1-CZ3 4.12Å
46	G	58.4	Low	52.2	Low	64 Å²	64	116.6 Å²	116.6	66%	0.66	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.2	37.9	-170.9	0	0	0	0	0	111.7	K42 E43	K42-G46 PolarHBondContact O-N 2.6Å; K42-G46 VanDerWaalsContact O-N 3.15Å; E43-G46 PolarHBondContact O-N 3.18Å
47	W	59	Low	51.4	Low	111 Å²	111	116.2 Å²	116.2	42%	0.42	62%	0.624	S	S	.	*			trans	-67	136.8	177.6	-164.7	-89.5	0	0	0	110.1	D1 P3 K42 F45 D49	D1-W47 WeakPolarHBondContact O-CZ3 3.37Å; P3-W47 HydrophobicContact CG-CB 4.05Å; P3-W47 HydrophobicContact CG-CD2 3.74Å; P3-W47 HydrophobicContact CG-CE3 3.51Å; P3-W47 HydrophobicContact CG-CG 3.98Å; P3-W47 HydrophobicContact CG-CZ3 4.22Å; K42-W47 HydrophobicContact CB-CB 4.27Å; K42-W47 PolarHBondContact O-N 2.92Å; F45-W47 VanDerWaalsContact C-N 3.34Å; F45-W47 AromaticContact CD1-CE3 3.74Å; F45-W47 HydrophobicContact CD1-CE3 3.74Å; F45-W47 HydrophobicContact CD1-CZ3 4.43Å; F45-W47 AromaticContact CE1-CE3 3.85Å; F45-W47 HydrophobicContact CE1-CE3 3.85Å; F45-W47 HydrophobicContact CE1-CZ3 4.12Å; W47-D49 PolarHBondContact O-N 2.96Å
48	P	56.9	Low	50.1	Low	86 Å²	86	115.9 Å²	115.9	56%	0.558	64%	0.637	S	S	*	*			trans	-64.8	126.9	175.9	-20	32.6	0	0	0	111.2	E50	P48-E50 WeakPolarHBondContact CB-O 3.28Å; P48-E50 PolarHBondContact O-N 3.25Å
49	D	51.8	Low	49.1	Very low	158 Å²	158	114 Å²	114	85%	0.845	64%	0.643	S	S	*	*	S	Bend	trans	-70.9	-20	175.7	-68.2	-51.5	0	0	0	112.5	W47	W47-D49 PolarHBondContact O-N 2.96Å
50	E	48.3	Very low	48.1	Very low	165 Å²	165	117.2 Å²	117.2	77%	0.771	65%	0.645	S	S	*	*	S	Bend	trans	-112.1	130.6	172.3	-66.2	179.4	144.4	0	0	110.4	P48	P48-E50 WeakPolarHBondContact CB-O 3.28Å; P48-E50 PolarHBondContact O-N 3.25Å
51	P	48.4	Very low	46.6	Very low	107 Å²	107	115.7 Å²	115.7	70%	0.695	65%	0.649	S	S	*	*			trans	-71	143.1	169.5	31.1	-33.4	0	0	0	110.1	E53	P51-E53 PolarHBondContact O-N 2.89Å
52	P	45.2	Very low	45.3	Very low	82 Å²	82	121.7 Å²	121.7	53%	0.532	68%	0.68	S	S	.	*			trans	-65.5	134.5	176.3	26.6	-32.5	0	0	0	110.8	E54 F55	P52-E54 PolarHBondContact O-N 3.49Å; P52-F55 HydrophobicContact CG-CD2 4Å; P52-F55 HydrophobicContact CG-CE2 4.05Å; P52-F55 PolarHBondContact O-N 3Å
53	E	47.6	Very low	43.6	Very low	201 Å²	201	126.8 Å²	126.8	94%	0.939	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-7	-173.8	-60.7	-172.8	124.9	0	0	114.6	P51	P51-E53 PolarHBondContact O-N 2.89Å
54	E	39.9	Very low	42	Very low	185 Å²	185	125.2 Å²	125.2	86%	0.864	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	4.4	179.4	-63.7	-168.3	141.2	0	0	114.7	P52 P56	P52-E54 PolarHBondContact O-N 3.49Å; E54-P56 WeakPolarHBondContact O-CD 3.46Å
55	F	35.6	Very low	40.5	Very low	161 Å²	161	125 Å²	125	71%	0.706	72%	0.721	S	S	*	*	S	Bend	trans	-82.5	108.8	164.3	-83.8	-77.6	0	0	0	110.3	P52 S57	P52-F55 HydrophobicContact CG-CD2 4Å; P52-F55 HydrophobicContact CG-CE2 4.05Å; P52-F55 PolarHBondContact O-N 3Å; F55-S57 PolarHBondContact O-N 3.07Å
56	P	35.8	Very low	39.1	Very low	118 Å²	118	126.4 Å²	126.4	77%	0.766	74%	0.742	S	S	*	*			trans	-62.7	115.6	173	26.8	-33.7	0	0	0	108.8	E54 A58	E54-P56 WeakPolarHBondContact O-CD 3.46Å; P56-A58 PolarHBondContact O-N 3.33Å
57	S	32	Very low	37.6	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	75%	0.754	S	S	*	*			trans	-63.7	106.5	-178.4	46.3	0	0	0	0	109.8	F55 S59	F55-S57 PolarHBondContact O-N 3.07Å; S57-S59 VanDerWaalsContact C-N 3.26Å; S57-S59 PolarHBondContact O-N 3.28Å
58	A	32.4	Very low	36.1	Very low	94 Å²	94	133.7 Å²	133.7	78%	0.777	77%	0.774	S	S	*	*			trans	-69.4	81.4	-178.8	0	0	0	0	0	110.8	P56 V60	P56-A58 PolarHBondContact O-N 3.33Å; A58-V60 PolarHBondContact O-N 2.87Å; A58-V60 VanDerWaalsContact O-N 3.17Å
59	S	29.3	Very low	34.7	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	79%	0.788	S	S	*	*			trans	-60.1	113.7	175.9	54.8	0	0	0	0	110.2	S57 S61	S57-S59 VanDerWaalsContact C-N 3.26Å; S57-S59 PolarHBondContact O-N 3.28Å; S59-S61 VanDerWaalsContact C-N 3.3Å; S59-S61 PolarHBondContact O-N 3.43Å
60	V	34.5	Very low	33.6	Very low	156 Å²	156	138.5 Å²	138.5	95%	0.945	79%	0.789	S	S	*	*			trans	-75.2	82.9	179.4	-175.6	0	0	0	0	109.4	A58	A58-V60 PolarHBondContact O-N 2.87Å; A58-V60 VanDerWaalsContact O-N 3.17Å
61	S	26	Very low	32.4	Very low	85 Å²	85	136 Å²	136	59%	0.594	79%	0.79	S	S	*	*			trans	-149.6	131.1	180	53.5	0	0	0	0	111.8	S59	S59-S61 VanDerWaalsContact C-N 3.3Å; S59-S61 PolarHBondContact O-N 3.43Å
62	N	31.4	Very low	31.4	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	80%	0.803	S	S	*	*			trans	-58.4	135.9	-173.8	-57	-31.6	0	0	0	113.7
63	I	26.6	Very low	30.6	Very low	160 Å²	160	139.3 Å²	139.3	82%	0.821	82%	0.815	S	S	*	*			trans	-133.7	116.8	156.4	-62.3	-177.4	0	0	0	109
64	C	27	Very low	29.7	Very low	103 Å²	103	136.9 Å²	136.9	70%	0.696	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-86.9	147.5	161.5	-60.5	0	0	0	0	108.8	S66	C64-S66 PolarHBondContact O-N 3.01Å
65	P	28.1	Very low	29.1	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-66.7	124.7	174.8	28.1	-33.7	0	0	0	110.6
66	S	27.9	Very low	28.7	Very low	123 Å²	123	131.5 Å²	131.5	86%	0.86	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.5	137.6	175.4	-51.5	0	0	0	0	111.3	C64	C64-S66 PolarHBondContact O-N 3.01Å
67	N	26.4	Very low	28.4	Very low	168 Å²	168	131 Å²	131	90%	0.898	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69.9	146	170.2	-101.5	-30.8	0	0	0	111.2
68	L	28.1	Very low	28.3	Very low	161 Å²	161	133 Å²	133	84%	0.843	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-84.1	117.8	-179.5	-160.9	78.1	0	0	0	110.5
69	N	26.1	Very low	28.2	Very low	161 Å²	161	134.5 Å²	134.5	86%	0.861	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-103.3	125.3	171.8	-135.9	15.3	0	0	0	108.7
70	Q	28.7	Very low	28.3	Very low	183 Å²	183	135.2 Å²	135.2	86%	0.855	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-84.3	135.4	179.4	-73.7	-175	-8.5	0	0	111.7
71	S	24.5	Very low	28	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	83%	0.825	S	S	*	*			trans	-143.6	146.8	160.9	59.5	0	0	0	0	109.8
72	N	27.6	Very low	28.5	Very low	180 Å²	180	133.9 Å²	133.9	96%	0.963	83%	0.834	S	S	*	*			trans	-72.7	138.3	-171.1	-76.5	-14.1	0	0	0	112.9
73	G	26.5	Very low	28.6	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	83%	0.83	S	S	*	*			trans	-156.2	133.9	166.5	0	0	0	0	0	111.1
74	T	28.9	Very low	29.1	Very low	150 Å²	150	131.4 Å²	131.4	92%	0.92	83%	0.833	S	S	*	*			trans	-102.4	138.7	-171.8	50.5	0	0	0	0	112.9
75	G	27.6	Very low	30	Very low	75 Å²	75	131.2 Å²	131.2	77%	0.773	83%	0.829	S	S	*	*			trans	163.3	92.5	164.8	0	0	0	0	0	117.4
76	D	27.4	Very low	31.2	Very low	158 Å²	158	131 Å²	131	85%	0.845	83%	0.831	S	S	*	*			trans	25.8	140	149.9	-60.3	-19.5	0	0	0	125.1
77	S	30	Very low	33	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	80%	0.802	S	S	*	*			trans	81.5	104	142.2	-69.5	0	0	0	0	122.9
78	D	28.6	Very low	35.7	Very low	153 Å²	153	122.5 Å²	122.5	82%	0.818	79%	0.785	S	S	*	*			trans	43	101.1	131.9	-65	-17.4	0	0	0	121.5
79	S	30.3	Very low	38.4	Very low	126 Å²	126	120 Å²	120	88%	0.881	78%	0.776	S	S	*	*				-167.2	122.5	117.7	-83.6	0	0	0	0	111.9	A81	S79-A81 PolarHBondContact O-N 3.32Å
80	A	32.9	Very low	41.2	Very low	109 Å²	109	118.2 Å²	118.2	90%	0.901	77%	0.765	S	S	*	*			trans	-84.2	106.2	179.2	0	0	0	0	0	112.1
81	A	27.9	Very low	43.9	Very low	90 Å²	90	111.3 Å²	111.3	74%	0.744	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-95.9	130.8	162.9	0	0	0	0	0	109.6	S79	S79-A81 PolarHBondContact O-N 3.32Å
82	P	36.8	Very low	46.8	Very low	122 Å²	122	111.2 Å²	111.2	79%	0.792	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-71.6	138.3	179.9	29.4	-34.2	0	0	0	111
83	T	32.6	Very low	49.7	Very low	123 Å²	123	108 Å²	108	76%	0.755	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-64.5	133.7	176.3	42.5	0	0	0	0	111.3	T85	T83-T85 PolarHBondContact O-N 3.39Å
84	T	37	Very low	52.7	Low	145 Å²	145	106.5 Å²	106.5	89%	0.89	67%	0.673	S	S	*	*			trans	-72.2	88	-179.5	49.1	0	0	0	0	110.9	S86	T84-S86 PolarHBondContact O-N 3.08Å
85	T	47.2	Very low	55.6	Low	99 Å²	99	100.3 Å²	100.3	61%	0.607	64%	0.635	S	S	*	*			trans	-70.8	113.1	175.1	36.4	0	0	0	0	110.8	T83 G87	T83-T85 PolarHBondContact O-N 3.39Å; T85-G87 PolarHBondContact O-N 3.31Å; T85-G87 VanDerWaalsContact O-N 3.09Å
86	S	53.4	Low	58.6	Low	126 Å²	126	100 Å²	100	88%	0.881	62%	0.62	S	S	*	*			trans	-69.7	100.2	178.3	53.8	0	0	0	0	110.9	T84	T84-S86 PolarHBondContact O-N 3.08Å
87	G	65.4	Low	61.7	Low	26 Å²	26	95.7 Å²	95.7	27%	0.268	60%	0.603	S	S	.	*	S	Bend	trans	-177.4	152.1	176.3	0	0	0	0	0	112.3	T85 E91 R92	T85-G87 PolarHBondContact O-N 3.31Å; T85-G87 VanDerWaalsContact O-N 3.09Å; G87-E91 WeakPolarHBondContact CA-OE2 3.36Å; G87-R92 PolarHBondContact O-NE 3.45Å; G87-R92 VanDerWaalsContact O-NE 3.11Å
88	T	82.4	Confident	64.5	Low	86 Å²	86	90.8 Å²	90.8	53%	0.528	57%	0.568	S	S	.	*			trans	-64.6	159.5	-179.5	69.4	0	0	0	0	111.4	L90 E91 R92	T88-L90 PolarHBondContact O-N 3.35Å; T88-E91 PolarHBondContact N-OE2 2.92Å; T88-E91 PolarHBondContact O-N 2.98Å; T88-E91 WeakPolarHBondContact OG1-CB 3.36Å; T88-E91 PolarHBondContact OG1-N 3.13Å; T88-E91 VanDerWaalsContact OG1-N 3.07Å; T88-R92 PolarHBondContact O-N 3.03Å
89	V	85.2	Confident	67.4	Low	108 Å²	108	86.8 Å²	86.8	66%	0.655	55%	0.545	S	S	*	.	H	α-helix	trans	-59.7	-38.7	177.6	-177.6	0	0	0	0	111.2	L93	V89-L93 WeakPolarHBondContact O-CB 3.35Å; V89-L93 PolarHBondContact O-N 2.87Å
90	L	84.1	Confident	70.2	Confident	123 Å²	123	83.4 Å²	83.4	64%	0.644	52%	0.524	S	S	*	.	H	α-helix	trans	-68.2	-43.7	176.9	-179.7	61.6	0	0	0	112	T88 L93 V94	T88-L90 PolarHBondContact O-N 3.35Å; L90-L93 PolarHBondContact O-N 2.83Å; L90-V94 HydrophobicContact CD1-CG2 4.43Å; L90-V94 WeakPolarHBondContact O-CG2 3.36Å; L90-V94 PolarHBondContact O-N 3.22Å
91	E	85.4	Confident	72.8	Confident	38 Å²	38	81 Å²	81	18%	0.178	50%	0.496	C	S	.	.	H	α-helix	trans	-59.4	-49.1	175.9	177.6	-175.3	-176.3	0	0	111.5	G87 T88 L93 V94 V95 P133 S135 V136	G87-E91 WeakPolarHBondContact CA-OE2 3.36Å; T88-E91 PolarHBondContact N-OE2 2.92Å; T88-E91 PolarHBondContact O-N 2.98Å; T88-E91 WeakPolarHBondContact OG1-CB 3.36Å; T88-E91 PolarHBondContact OG1-N 3.13Å; T88-E91 VanDerWaalsContact OG1-N 3.07Å; E91-L93 VanDerWaalsContact C-N 3.33Å; E91-L93 PolarHBondContact O-N 3.48Å; E91-V94 PolarHBondContact O-N 3.5Å; E91-V95 HydrophobicContact CG-CG2 4.47Å; E91-V95 WeakPolarHBondContact O-CB 3.45Å; E91-V95 VanDerWaalsContact O-CG2 3.26Å; E91-V95 WeakPolarHBondContact O-CG2 3.31Å; E91-V95 PolarHBondContact O-N 2.92Å; E91-P133 HydrophobicContact CG-CB 4.3Å; E91-P133 HydrophobicContact CG-CG 4.33Å; E91-P133 WeakPolarHBondContact OE1-CB 3.27Å; E91-S135 WeakPolarHBondContact CG-OG 3.43Å; E91-S135 PolarHBondContact OE1-OG 3.31Å; E91-V136 HydrophobicContact CG-CG2 4.25Å
92	R	85.6	Confident	75.7	Confident	113 Å²	113	78.5 Å²	78.5	43%	0.426	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-39.1	177.1	-71.9	-174.9	-73.8	121.2	-8.5	112.2	G87 T88 S96	G87-R92 PolarHBondContact O-NE 3.45Å; G87-R92 VanDerWaalsContact O-NE 3.11Å; T88-R92 PolarHBondContact O-N 3.03Å; R92-S96 PolarHBondContact O-N 3.14Å
93	L	89.8	Confident	78	Confident	112 Å²	112	76 Å²	76	59%	0.586	45%	0.454	S	S	*	.	H	α-helix	trans	-62.6	-44	173.9	179.2	62.6	0	0	0	112.2	V89 L90 E91 S97	V89-L93 WeakPolarHBondContact O-CB 3.35Å; V89-L93 PolarHBondContact O-N 2.87Å; L90-L93 PolarHBondContact O-N 2.83Å; E91-L93 VanDerWaalsContact C-N 3.33Å; E91-L93 PolarHBondContact O-N 3.48Å; L93-S97 VanDerWaalsContact O-CB 3.29Å; L93-S97 WeakPolarHBondContact O-CB 3.28Å; L93-S97 PolarHBondContact O-N 2.89Å; L93-S97 PolarHBondContact O-OG 3.35Å
94	V	88.8	Confident	80.4	Confident	46 Å²	46	74 Å²	74	28%	0.279	45%	0.445	S	S	.	.	H	α-helix	trans	-66.6	-44.9	177.7	170.6	0	0	0	0	111.2	L90 E91 S97 L98 V136	L90-V94 HydrophobicContact CD1-CG2 4.43Å; L90-V94 WeakPolarHBondContact O-CG2 3.36Å; L90-V94 PolarHBondContact O-N 3.22Å; E91-V94 PolarHBondContact O-N 3.5Å; V94-S97 PolarHBondContact O-N 3.22Å; V94-L98 HydrophobicContact CG1-CD1 4.05Å; V94-L98 WeakPolarHBondContact O-CG 3.45Å; V94-L98 PolarHBondContact O-N 3.01Å; V94-V136 HydrophobicContact CB-CG2 4.41Å; V94-V136 HydrophobicContact CG1-CG1 3.85Å; V94-V136 HydrophobicContact CG1-CG2 3.95Å
95	V	90.4	Very high	82.6	Confident	19 Å²	19	67.9 Å²	67.9	12%	0.115	41%	0.406	C	S	.	.	H	α-helix	trans	-56.7	-54.6	177.4	164.2	0	0	0	0	110.8	E91 S97 L98 E99 V136 Q139	E91-V95 HydrophobicContact CG-CG2 4.47Å; E91-V95 WeakPolarHBondContact O-CB 3.45Å; E91-V95 VanDerWaalsContact O-CG2 3.26Å; E91-V95 WeakPolarHBondContact O-CG2 3.31Å; E91-V95 PolarHBondContact O-N 2.92Å; V95-S97 VanDerWaalsContact C-N 3.29Å; V95-S97 PolarHBondContact O-N 3.12Å; V95-L98 WeakPolarHBondContact O-CB 3.24Å; V95-L98 PolarHBondContact O-N 2.94Å; V95-E99 WeakPolarHBondContact CG1-OE1 3.38Å; V95-E99 WeakPolarHBondContact O-CG 3.42Å; V95-E99 PolarHBondContact O-N 2.84Å; V95-V136 HydrophobicContact CG2-CG2 3.93Å; V95-Q139 HydrophobicContact CG1-CG 4.06Å
96	S	90.3	Very high	84.2	Confident	68 Å²	68	66.2 Å²	66.2	48%	0.476	40%	0.402	S	S	.	.	H	α-helix	trans	-71.9	-20.4	179.8	-60.8	0	0	0	0	114.6	R92 E99 A100	R92-S96 PolarHBondContact O-N 3.14Å; S96-E99 VanDerWaalsContact CA-OE2 3.23Å; S96-E99 WeakPolarHBondContact CA-OE2 3.29Å; S96-E99 PolarHBondContact OG-OE2 2.89Å; S96-A100 WeakPolarHBondContact O-CB 3.42Å; S96-A100 PolarHBondContact O-N 3.33Å; S96-A100 VanDerWaalsContact O-N 3.09Å
97	S	91	Very high	85.5	Confident	69 Å²	69	66.4 Å²	66.4	48%	0.483	40%	0.398	S	S	.	.	H	α-helix	trans	-70.6	-35.4	168.4	-60.2	0	0	0	0	112.1	L93 V94 V95 L101	L93-S97 VanDerWaalsContact O-CB 3.29Å; L93-S97 WeakPolarHBondContact O-CB 3.28Å; L93-S97 PolarHBondContact O-N 2.89Å; L93-S97 PolarHBondContact O-OG 3.35Å; V94-S97 PolarHBondContact O-N 3.22Å; V95-S97 VanDerWaalsContact C-N 3.29Å; V95-S97 PolarHBondContact O-N 3.12Å; S97-L101 WeakPolarHBondContact O-CB 3.37Å; S97-L101 PolarHBondContact O-N 2.96Å; S97-L101 VanDerWaalsContact O-N 3.13Å
98	L	89.6	Confident	85.8	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	40%	0.397	C	S	.	.	H	α-helix	trans	-72.7	-42.2	174.9	-68.4	167.6	0	0	0	111.4	V94 V95 A100 L101 E102 L123 L127 V136 Q139 L143	V94-L98 HydrophobicContact CG1-CD1 4.05Å; V94-L98 WeakPolarHBondContact O-CG 3.45Å; V94-L98 PolarHBondContact O-N 3.01Å; V95-L98 WeakPolarHBondContact O-CB 3.24Å; V95-L98 PolarHBondContact O-N 2.94Å; L98-A100 PolarHBondContact O-N 2.8Å; L98-L101 PolarHBondContact O-N 3.37Å; L98-E102 WeakPolarHBondContact O-CB 3.29Å; L98-E102 PolarHBondContact O-N 2.91Å; L98-L123 HydrophobicContact CD2-CD2 4.07Å; L98-L127 HydrophobicContact CD1-CD1 4.16Å; L98-L127 HydrophobicContact CD2-CD1 3.9Å; L98-V136 HydrophobicContact CD1-CG1 4.17Å; L98-Q139 HydrophobicContact CB-CB 3.75Å; L98-Q139 HydrophobicContact CD1-CB 4.12Å; L98-L143 HydrophobicContact CD2-CD2 3.73Å
99	E	90.2	Very high	85.4	Confident	68 Å²	68	65.9 Å²	65.9	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-58.9	-43.5	174.8	-69.5	161	175.5	0	0	112	V95 S96 S103 Q139	V95-E99 WeakPolarHBondContact CG1-OE1 3.38Å; V95-E99 WeakPolarHBondContact O-CG 3.42Å; V95-E99 PolarHBondContact O-N 2.84Å; S96-E99 VanDerWaalsContact CA-OE2 3.23Å; S96-E99 WeakPolarHBondContact CA-OE2 3.29Å; S96-E99 PolarHBondContact OG-OE2 2.89Å; E99-S103 WeakPolarHBondContact O-CB 3.38Å; E99-S103 PolarHBondContact O-N 2.91Å; E99-S103 PolarHBondContact O-OG 2.78Å; E99-Q139 HydrophobicContact CG-CG 3.95Å; E99-Q139 PolarHBondContact OE1-NE2 2.87Å
100	A	88.8	Confident	84.8	Confident	55 Å²	55	67 Å²	67	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-65.3	-42	175.1	0	0	0	0	0	112	S96 L98 S103 C104	S96-A100 WeakPolarHBondContact O-CB 3.42Å; S96-A100 PolarHBondContact O-N 3.33Å; S96-A100 VanDerWaalsContact O-N 3.09Å; L98-A100 PolarHBondContact O-N 2.8Å; A100-S103 WeakPolarHBondContact O-CB 3.1Å; A100-S103 PolarHBondContact O-N 3.39Å; A100-C104 PolarHBondContact O-N 2.87Å; A100-C104 PolarHBondContact O-SG 3.38Å; A100-C104 VanDerWaalsContact O-SG 3.34Å
101	L	87.5	Confident	84.2	Confident	59 Å²	59	68.1 Å²	68.1	31%	0.309	40%	0.401	S	S	.	.	H	α-helix	trans	-66.4	-42.1	178.6	-173.8	58.7	0	0	0	111.7	S97 L98 C104 F105 L143	S97-L101 WeakPolarHBondContact O-CB 3.37Å; S97-L101 PolarHBondContact O-N 2.96Å; S97-L101 VanDerWaalsContact O-N 3.13Å; L98-L101 PolarHBondContact O-N 3.37Å; L101-C104 WeakPolarHBondContact O-CB 3.45Å; L101-C104 PolarHBondContact O-N 3.02Å; L101-F105 HydrophobicContact CD1-CD2 4.2Å; L101-F105 HydrophobicContact CD1-CE2 3.76Å; L101-F105 HydrophobicContact CG-CD2 4.22Å; L101-F105 HydrophobicContact CG-CE2 4.06Å; L101-F105 VanDerWaalsContact O-CD2 3.26Å; L101-F105 WeakPolarHBondContact O-CD2 3.32Å; L101-F105 PolarHBondContact O-N 3.5Å; L101-F105 VanDerWaalsContact O-N 3.09Å; L101-L143 HydrophobicContact CD2-CD1 4.46Å; L101-L143 HydrophobicContact CD2-CD2 3.77Å; L101-L143 HydrophobicContact CG-CD1 4.07Å; L101-L143 HydrophobicContact CG-CD2 4.21Å
102	E	88.3	Confident	83.5	Confident	38 Å²	38	72 Å²	72	18%	0.178	42%	0.419	C	S	.	.	H	α-helix	trans	-60	-44.7	172.4	178.1	172	-169.5	0	0	111.3	L98 C104 F105 A106 S142 L143	L98-E102 WeakPolarHBondContact O-CB 3.29Å; L98-E102 PolarHBondContact O-N 2.91Å; E102-C104 VanDerWaalsContact C-N 3.26Å; E102-C104 PolarHBondContact O-N 2.94Å; E102-F105 CarbonylContact O-C 3.45Å; E102-F105 WeakPolarHBondContact O-CA 3.43Å; E102-F105 PolarHBondContact O-N 3.48Å; E102-A106 PolarHBondContact O-N 2.91Å; E102-S142 VanDerWaalsContact CD-C 3.47Å; E102-S142 WeakPolarHBondContact OE1-CB 3.49Å; E102-S142 PolarHBondContact OE1-OG 3.37Å; E102-S142 VanDerWaalsContact OE2-CB 3.26Å; E102-S142 WeakPolarHBondContact OE2-CB 3.39Å; E102-S142 PolarHBondContact OE2-OG 2.85Å; E102-L143 HydrophobicContact CB-CB 4.28Å; E102-L143 HydrophobicContact CB-CD1 4.21Å; E102-L143 PolarHBondContact OE2-N 3.41Å
103	S	84.9	Confident	83.1	Confident	69 Å²	69	69.1 Å²	69.1	48%	0.483	41%	0.41	S	S	.	.	H	α-helix	trans	-58.6	-36.7	175.2	-59.4	0	0	0	0	112.3	E99 A100 A106 V107	E99-S103 WeakPolarHBondContact O-CB 3.38Å; E99-S103 PolarHBondContact O-N 2.91Å; E99-S103 PolarHBondContact O-OG 2.78Å; A100-S103 WeakPolarHBondContact O-CB 3.1Å; A100-S103 PolarHBondContact O-N 3.39Å; S103-A106 PolarHBondContact O-N 3.44Å; S103-V107 PolarHBondContact O-N 3.41Å
104	C	84.2	Confident	82.4	Confident	81 Å²	81	70.4 Å²	70.4	55%	0.547	41%	0.413	S	S	.	.	H	α-helix	trans	-66.2	-38.3	171.6	-65.3	0	0	0	0	112.8	A100 L101 E102 G108 K113	A100-C104 PolarHBondContact O-N 2.87Å; A100-C104 PolarHBondContact O-SG 3.38Å; A100-C104 VanDerWaalsContact O-SG 3.34Å; L101-C104 WeakPolarHBondContact O-CB 3.45Å; L101-C104 PolarHBondContact O-N 3.02Å; E102-C104 VanDerWaalsContact C-N 3.26Å; E102-C104 PolarHBondContact O-N 2.94Å; C104-G108 WeakPolarHBondContact O-CA 3.38Å; C104-G108 PolarHBondContact O-N 3.32Å; C104-K113 WeakPolarHBondContact O-CE 3.49Å
105	F	83	Confident	82	Confident	17 Å²	17	78.4 Å²	78.4	8%	0.075	44%	0.438	C	S	.	.	H	α-helix	trans	-76.7	-19.8	175.2	-77.3	-73.4	0	0	0	114.1	L101 E102 K113 N116 K117 A120 L143 L147	L101-F105 HydrophobicContact CD1-CD2 4.2Å; L101-F105 HydrophobicContact CD1-CE2 3.76Å; L101-F105 HydrophobicContact CG-CD2 4.22Å; L101-F105 HydrophobicContact CG-CE2 4.06Å; L101-F105 VanDerWaalsContact O-CD2 3.26Å; L101-F105 WeakPolarHBondContact O-CD2 3.32Å; L101-F105 PolarHBondContact O-N 3.5Å; L101-F105 VanDerWaalsContact O-N 3.09Å; E102-F105 CarbonylContact O-C 3.45Å; E102-F105 WeakPolarHBondContact O-CA 3.43Å; E102-F105 PolarHBondContact O-N 3.48Å; F105-K113 VanDerWaalsContact C-CE 3.47Å; F105-K113 HydrophobicContact CD1-CB 4.1Å; F105-K113 HydrophobicContact CD1-CG 3.98Å; F105-K113 HydrophobicContact CE1-CB 4.22Å; F105-K113 HydrophobicContact CE1-CG 4.46Å; F105-K113 WeakPolarHBondContact O-CE 3.47Å; F105-K113 PolarHBondContact O-NZ 3.44Å; F105-N116 HydrophobicContact CZ-CB 4Å; F105-K117 HydrophobicContact CE1-CB 4.49Å; F105-A120 HydrophobicContact CD2-CB 4.34Å; F105-A120 HydrophobicContact CE2-CB 3.36Å; F105-A120 HydrophobicContact CZ-CB 3.53Å; F105-L143 HydrophobicContact CD2-CD1 3.83Å; F105-L143 HydrophobicContact CE2-CD1 4.47Å; F105-L147 HydrophobicContact CB-CD2 4.44Å; F105-L147 HydrophobicContact CD1-CD2 3.42Å; F105-L147 VanDerWaalsContact CD1-CD2 3.42Å; F105-L147 HydrophobicContact CD2-CD2 3.94Å; F105-L147 HydrophobicContact CE1-CD2 3.48Å; F105-L147 VanDerWaalsContact CE1-CD2 3.48Å; F105-L147 HydrophobicContact CE2-CD2 4.01Å; F105-L147 HydrophobicContact CG-CD2 3.67Å; F105-L147 HydrophobicContact CZ-CD2 3.79Å
106	A	80.4	Confident	81.6	Confident	64 Å²	64	81.6 Å²	81.6	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-74.6	-56.9	166.3	0	0	0	0	0	111.4	E102 S103 K113	E102-A106 PolarHBondContact O-N 2.91Å; S103-A106 PolarHBondContact O-N 3.44Å; A106-K113 PolarHBondContact O-NZ 3.08Å
107	V	79.8	Confident	81.3	Confident	130 Å²	130	81 Å²	81	79%	0.788	44%	0.443	S	S	*	.	H	α-helix	trans	-97.5	-21.4	-164.8	-173.4	0	0	0	0	114.7	S103	S103-V107 PolarHBondContact O-N 3.41Å
108	G	73	Confident	80.9	Confident	25 Å²	25	82.9 Å²	82.9	26%	0.258	45%	0.448	S	S	.	.	S	Bend	trans	-68.6	170.8	-170	0	0	0	0	0	117.1	C104 K113	C104-G108 WeakPolarHBondContact O-CA 3.38Å; C104-G108 PolarHBondContact O-N 3.32Å; G108-K113 WeakPolarHBondContact O-CE 3.29Å; G108-K113 PolarHBondContact O-NZ 3.25Å
109	P	74.1	Confident	80.7	Confident	75 Å²	75	85.7 Å²	85.7	49%	0.487	47%	0.472	S	S	.	.			trans	-72.4	141.6	176.9	30.4	-34.2	0	0	0	112.1	I111 E112 K113	P109-I111 VanDerWaalsContact C-N 3.27Å; P109-I111 PolarHBondContact O-N 2.97Å; P109-I111 VanDerWaalsContact O-N 3.16Å; P109-E112 HydrophobicContact CG-CB 4.12Å; P109-E112 HydrophobicContact CG-CG 3.93Å; P109-E112 VanDerWaalsContact CG-OE2 3.28Å; P109-E112 WeakPolarHBondContact CG-OE2 3.49Å; P109-E112 PolarHBondContact O-N 2.96Å; P109-E112 VanDerWaalsContact O-N 3.08Å; P109-K113 PolarHBondContact O-N 3.13Å; P109-K113 VanDerWaalsContact O-N 3.12Å
110	I	72.8	Confident	80.5	Confident	132 Å²	132	82.9 Å²	82.9	68%	0.677	46%	0.46	S	S	*	.	H	α-helix	trans	-53.7	-41.1	-173.1	-58.3	174.3	0	0	0	112.5	E112 K113 E114	I110-E112 VanDerWaalsContact C-N 3.32Å; I110-E112 PolarHBondContact O-N 3.49Å; I110-K113 PolarHBondContact O-N 2.97Å; I110-E114 WeakPolarHBondContact O-CB 3.46Å; I110-E114 PolarHBondContact O-N 3.49Å
111	I	71.4	Confident	80.4	Confident	147 Å²	147	81.7 Å²	81.7	75%	0.754	45%	0.446	S	S	*	.	H	α-helix	trans	-62.5	-37.2	-177.5	-61.1	168.3	0	0	0	112	P109 R115	P109-I111 VanDerWaalsContact C-N 3.27Å; P109-I111 PolarHBondContact O-N 2.97Å; P109-I111 VanDerWaalsContact O-N 3.16Å; I111-R115 WeakPolarHBondContact O-CB 3.35Å; I111-R115 PolarHBondContact O-N 3.14Å
112	E	70.8	Confident	80.3	Confident	119 Å²	119	85.9 Å²	85.9	56%	0.556	46%	0.463	S	S	*	.	H	α-helix	trans	-81.4	-35.4	178.9	-62.5	-172.9	145.2	0	0	111.6	P109 I110 R115 N116	P109-E112 HydrophobicContact CG-CB 4.12Å; P109-E112 HydrophobicContact CG-CG 3.93Å; P109-E112 VanDerWaalsContact CG-OE2 3.28Å; P109-E112 WeakPolarHBondContact CG-OE2 3.49Å; P109-E112 PolarHBondContact O-N 2.96Å; P109-E112 VanDerWaalsContact O-N 3.08Å; I110-E112 VanDerWaalsContact C-N 3.32Å; I110-E112 PolarHBondContact O-N 3.49Å; E112-R115 PolarHBondContact O-N 3.33Å; E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 3.49Å; E112-N116 VanDerWaalsContact O-N 3.08Å; E112-N116 PolarHBondContact O-ND2 3.44Å
113	K	75.3	Confident	80.3	Confident	53 Å²	53	88 Å²	88	23%	0.23	48%	0.475	C	S	.	.	H	α-helix	trans	-56.5	-54.9	170.4	-69	179.5	177	178.5	0	110.3	C104 F105 A106 G108 P109 I110 R115 N116 K117	C104-K113 WeakPolarHBondContact O-CE 3.49Å; F105-K113 VanDerWaalsContact C-CE 3.47Å; F105-K113 HydrophobicContact CD1-CB 4.1Å; F105-K113 HydrophobicContact CD1-CG 3.98Å; F105-K113 HydrophobicContact CE1-CB 4.22Å; F105-K113 HydrophobicContact CE1-CG 4.46Å; F105-K113 WeakPolarHBondContact O-CE 3.47Å; F105-K113 PolarHBondContact O-NZ 3.44Å; A106-K113 PolarHBondContact O-NZ 3.08Å; G108-K113 WeakPolarHBondContact O-CE 3.29Å; G108-K113 PolarHBondContact O-NZ 3.25Å; P109-K113 PolarHBondContact O-N 3.13Å; P109-K113 VanDerWaalsContact O-N 3.12Å; I110-K113 PolarHBondContact O-N 2.97Å; K113-R115 VanDerWaalsContact C-N 3.3Å; K113-R115 PolarHBondContact O-N 3.49Å; K113-N116 PolarHBondContact O-N 2.94Å; K113-K117 WeakPolarHBondContact O-CA 3.43Å; K113-K117 WeakPolarHBondContact O-CB 3.49Å; K113-K117 PolarHBondContact O-N 2.91Å
114	E	76.4	Confident	80.3	Confident	138 Å²	138	84.7 Å²	84.7	65%	0.645	45%	0.452	S	S	*	.	H	α-helix	trans	-63.3	-35.8	-176.2	-165.8	136.5	-118.8	0	0	112.6	I110	I110-E114 WeakPolarHBondContact O-CB 3.46Å; I110-E114 PolarHBondContact O-N 3.49Å
115	R	79.6	Confident	80.5	Confident	214 Å²	214	82.1 Å²	82.1	81%	0.808	43%	0.434	S	S	*	.	H	α-helix	trans	-66.4	-38.7	175.5	-172.5	175.1	-171.3	154.4	3.8	113.7	I111 E112 K113	I111-R115 WeakPolarHBondContact O-CB 3.35Å; I111-R115 PolarHBondContact O-N 3.14Å; E112-R115 PolarHBondContact O-N 3.33Å; K113-R115 VanDerWaalsContact C-N 3.3Å; K113-R115 PolarHBondContact O-N 3.49Å
116	N	82.8	Confident	80.6	Confident	87 Å²	87	86.1 Å²	86.1	47%	0.465	46%	0.456	S	S	.	.	H	α-helix	trans	-97.8	-12.5	-174.6	-64.6	-27.8	0	0	0	113.5	F105 E112 K113 N118 A119 A120	F105-N116 HydrophobicContact CZ-CB 4Å; E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 3.49Å; E112-N116 VanDerWaalsContact O-N 3.08Å; E112-N116 PolarHBondContact O-ND2 3.44Å; K113-N116 PolarHBondContact O-N 2.94Å; N116-N118 PolarHBondContact O-N 3.25Å; N116-A119 PolarHBondContact O-N 2.98Å; N116-A120 PolarHBondContact O-N 2.98Å; N116-A120 VanDerWaalsContact O-N 3.08Å
117	K	83.1	Confident	80.8	Confident	54 Å²	54	85 Å²	85	24%	0.235	44%	0.441	C	S	.	.	H	α-helix	trans	-49.7	-49.5	-175.7	170.8	162.9	174.6	159.3	0	113.2	F105 K113 A119 A120 Q121 L147	F105-K117 HydrophobicContact CE1-CB 4.49Å; K113-K117 WeakPolarHBondContact O-CA 3.43Å; K113-K117 WeakPolarHBondContact O-CB 3.49Å; K113-K117 PolarHBondContact O-N 2.91Å; K117-A119 PolarHBondContact O-N 2.93Å; K117-A120 PolarHBondContact O-N 3.36Å; K117-Q121 WeakPolarHBondContact O-CB 3.29Å; K117-Q121 PolarHBondContact O-N 2.99Å; K117-L147 HydrophobicContact CB-CD2 4.45Å; K117-L147 WeakPolarHBondContact CE-O 3.29Å; K117-L147 HydrophobicContact CG-CD2 4.24Å; K117-L147 PolarHBondContact NZ-O 3.05Å
118	N	83.8	Confident	81	Confident	110 Å²	110	79.2 Å²	79.2	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-62.5	-43.3	-177.1	-65.7	-7.9	0	0	0	112	N116 Q121 E122	N116-N118 PolarHBondContact O-N 3.25Å; N118-Q121 PolarHBondContact O-N 3.03Å; N118-E122 WeakPolarHBondContact O-CB 3.3Å; N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 3.02Å
119	A	85.3	Confident	81.3	Confident	65 Å²	65	79.5 Å²	79.5	54%	0.537	40%	0.404	S	S	.	.	H	α-helix	trans	-68.4	-39.2	179.3	0	0	0	0	0	112.4	N116 K117 L123	N116-A119 PolarHBondContact O-N 2.98Å; K117-A119 PolarHBondContact O-N 2.93Å; A119-L123 VanDerWaalsContact O-CB 3.32Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 3.11Å
120	A	85.6	Confident	81.7	Confident	8 Å²	8	79.9 Å²	79.9	7%	0.066	40%	0.401	C	S	.	.	H	α-helix	trans	-67.6	-39	174.4	0	0	0	0	0	112	F105 N116 K117 L123 A124 L147	F105-A120 HydrophobicContact CD2-CB 4.34Å; F105-A120 HydrophobicContact CE2-CB 3.36Å; F105-A120 HydrophobicContact CZ-CB 3.53Å; N116-A120 PolarHBondContact O-N 2.98Å; N116-A120 VanDerWaalsContact O-N 3.08Å; K117-A120 PolarHBondContact O-N 3.36Å; A120-L123 PolarHBondContact O-N 2.68Å; A120-A124 VanDerWaalsContact O-CB 3.26Å; A120-A124 WeakPolarHBondContact O-CB 3.37Å; A120-A124 PolarHBondContact O-N 3.11Å; A120-L147 HydrophobicContact CB-CD1 3.99Å; A120-L147 HydrophobicContact CB-CD2 4.12Å
121	Q	86.5	Confident	81.8	Confident	31 Å²	31	78.4 Å²	78.4	15%	0.145	40%	0.4	C	S	.	.	H	α-helix	trans	-64.9	-45.9	176	-176.3	174.5	-29.2	0	0	111.2	K117 N118 T125 L144 L147 H148 H157	K117-Q121 WeakPolarHBondContact O-CB 3.29Å; K117-Q121 PolarHBondContact O-N 2.99Å; N118-Q121 PolarHBondContact O-N 3.03Å; Q121-T125 WeakPolarHBondContact O-CB 3.45Å; Q121-T125 PolarHBondContact O-N 2.86Å; Q121-T125 PolarHBondContact O-OG1 2.58Å; Q121-L144 HydrophobicContact CG-CD2 4.34Å; Q121-L147 HydrophobicContact CB-CD1 4.16Å; Q121-H148 PolarHBondContact NE2-CE1 3.31Å; Q121-H157 VanDerWaalsContact CG-CE1 3.41Å; Q121-H157 WeakPolarHBondContact CG-CE1 3.22Å; Q121-H157 PolarHBondContact NE2-CD2 2.95Å; Q121-H157 PolarHBondContact NE2-CE1 3.03Å; Q121-H157 VanDerWaalsContact NE2-CE1 3.27Å; Q121-H157 PolarHBondContact NE2-NE2 3.33Å
122	E	86.1	Confident	82.3	Confident	146 Å²	146	72.9 Å²	72.9	68%	0.682	38%	0.376	S	S	*	.	H	α-helix	trans	-60.5	-47.9	173.7	-77.1	177.5	-174	0	0	112.1	N118 T125 L126	N118-E122 WeakPolarHBondContact O-CB 3.3Å; N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 3.02Å; E122-T125 PolarHBondContact O-N 3.25Å; E122-L126 WeakPolarHBondContact O-CB 3.18Å; E122-L126 PolarHBondContact O-N 2.95Å
123	L	87.1	Confident	82.9	Confident	82 Å²	82	70.2 Å²	70.2	43%	0.429	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-47.9	179.7	177.4	143.2	0	0	0	112.1	L98 A119 A120 T125 L126 L127	L98-L123 HydrophobicContact CD2-CD2 4.07Å; A119-L123 VanDerWaalsContact O-CB 3.32Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 3.11Å; A120-L123 PolarHBondContact O-N 2.68Å; L123-T125 VanDerWaalsContact C-N 3.33Å; L123-T125 PolarHBondContact O-N 3.35Å; L123-L126 PolarHBondContact O-N 3.48Å; L123-L127 HydrophobicContact CD2-CD1 3.75Å; L123-L127 HydrophobicContact CG-CD1 4.38Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.38Å
124	A	86.3	Confident	83.2	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-69.8	-33	-179.4	0	0	0	0	0	111.7	A120 L128 L143 L144	A120-A124 VanDerWaalsContact O-CB 3.26Å; A120-A124 WeakPolarHBondContact O-CB 3.37Å; A120-A124 PolarHBondContact O-N 3.11Å; A124-L128 VanDerWaalsContact O-CB 3.25Å; A124-L128 WeakPolarHBondContact O-CB 3.36Å; A124-L128 PolarHBondContact O-N 3.03Å; A124-L143 HydrophobicContact CB-CD2 3.89Å; A124-L143 HydrophobicContact CB-CG 4.19Å; A124-L144 HydrophobicContact CB-CD1 4.3Å; A124-L144 HydrophobicContact CB-CD2 3.97Å; A124-L144 HydrophobicContact CB-CG 3.66Å
125	T	86.9	Confident	83.6	Confident	27 Å²	27	66.8 Å²	66.8	17%	0.166	37%	0.373	C	S	.	.	H	α-helix	trans	-66.5	-40.6	170.3	-73	0	0	0	0	112.6	Q121 E122 L123 L128 S129 H157 A161	Q121-T125 WeakPolarHBondContact O-CB 3.45Å; Q121-T125 PolarHBondContact O-N 2.86Å; Q121-T125 PolarHBondContact O-OG1 2.58Å; E122-T125 PolarHBondContact O-N 3.25Å; L123-T125 VanDerWaalsContact C-N 3.33Å; L123-T125 PolarHBondContact O-N 3.35Å; T125-L128 PolarHBondContact O-N 3.06Å; T125-S129 WeakPolarHBondContact O-CB 3.38Å; T125-S129 PolarHBondContact O-N 2.94Å; T125-H157 PolarHBondContact OG1-CE1 3.38Å; T125-A161 HydrophobicContact CG2-CB 3.58Å
126	L	85.1	Confident	84	Confident	102 Å²	102	57 Å²	57	53%	0.534	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-50.1	175.3	179.1	62.7	0	0	0	110.6	E122 L123 L128 S129 L130	E122-L126 WeakPolarHBondContact O-CB 3.18Å; E122-L126 PolarHBondContact O-N 2.95Å; L123-L126 PolarHBondContact O-N 3.48Å; L126-L128 VanDerWaalsContact C-N 3.35Å; L126-L128 PolarHBondContact O-N 3.25Å; L126-S129 PolarHBondContact O-N 2.95Å; L126-S129 VanDerWaalsContact O-N 3.08Å; L126-S129 PolarHBondContact O-OG 2.87Å; L126-L130 HydrophobicContact CD1-CD1 4.29Å; L126-L130 HydrophobicContact CG-CD1 4.18Å; L126-L130 WeakPolarHBondContact O-CG 3.46Å; L126-L130 PolarHBondContact O-N 3.49Å
127	L	85.6	Confident	84.2	Confident	41 Å²	41	54.3 Å²	54.3	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-41.5	177	-69.1	172.4	0	0	0	112.5	L98 L123 S129 L130 Q137 S140	L98-L127 HydrophobicContact CD1-CD1 4.16Å; L98-L127 HydrophobicContact CD2-CD1 3.9Å; L123-L127 HydrophobicContact CD2-CD1 3.75Å; L123-L127 HydrophobicContact CG-CD1 4.38Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.38Å; L127-S129 VanDerWaalsContact C-N 3.27Å; L127-S129 PolarHBondContact O-N 2.97Å; L127-L130 PolarHBondContact O-N 3.12Å; L127-Q137 PolarHBondContact O-NE2 3.32Å; L127-S140 WeakPolarHBondContact CB-OG 3.31Å
128	L	84.3	Confident	84.5	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-35.1	174.2	-170	83.6	0	0	0	112.4	A124 T125 L126 L130 Q137 K141 L144 K158 L162	A124-L128 VanDerWaalsContact O-CB 3.25Å; A124-L128 WeakPolarHBondContact O-CB 3.36Å; A124-L128 PolarHBondContact O-N 3.03Å; T125-L128 PolarHBondContact O-N 3.06Å; L126-L128 VanDerWaalsContact C-N 3.35Å; L126-L128 PolarHBondContact O-N 3.25Å; L128-L130 VanDerWaalsContact C-N 3.3Å; L128-L130 PolarHBondContact O-N 3.44Å; L128-Q137 PolarHBondContact O-NE2 2.73Å; L128-K141 HydrophobicContact CD1-CD 4.25Å; L128-K141 HydrophobicContact CD1-CG 3.51Å; L128-L144 HydrophobicContact CB-CD1 4.44Å; L128-L144 HydrophobicContact CD2-CD1 4.04Å; L128-K158 HydrophobicContact CD2-CG 3.56Å; L128-L162 HydrophobicContact CD2-CD1 4.17Å; L128-L162 HydrophobicContact CD2-CD2 4.09Å; L128-L162 HydrophobicContact CD2-CG 4.01Å; L128-L162 HydrophobicContact CG-CD2 4.18Å
129	S	79.3	Confident	84.7	Confident	32 Å²	32	54.2 Å²	54.2	22%	0.224	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.9	-178.4	78.9	0	0	0	0	114.8	T125 L126 L127	T125-S129 WeakPolarHBondContact O-CB 3.38Å; T125-S129 PolarHBondContact O-N 2.94Å; L126-S129 PolarHBondContact O-N 2.95Å; L126-S129 VanDerWaalsContact O-N 3.08Å; L126-S129 PolarHBondContact O-OG 2.87Å; L127-S129 VanDerWaalsContact C-N 3.27Å; L127-S129 PolarHBondContact O-N 2.97Å
130	L	81	Confident	84.9	Confident	83 Å²	83	51.1 Å²	51.1	44%	0.435	29%	0.292	S	S	.	.	S	Bend	trans	-103.8	151.9	-177.2	-71.2	168.6	0	0	0	111.8	L126 L127 L128 A132 Q137	L126-L130 HydrophobicContact CD1-CD1 4.29Å; L126-L130 HydrophobicContact CG-CD1 4.18Å; L126-L130 WeakPolarHBondContact O-CG 3.46Å; L126-L130 PolarHBondContact O-N 3.49Å; L127-L130 PolarHBondContact O-N 3.12Å; L128-L130 VanDerWaalsContact C-N 3.3Å; L128-L130 PolarHBondContact O-N 3.44Å; L130-A132 VanDerWaalsContact C-N 3.27Å; L130-A132 PolarHBondContact O-N 3.22Å; L130-Q137 PolarHBondContact O-NE2 3.12Å; L130-Q137 VanDerWaalsContact O-NE2 3.12Å
131	P	75.4	Confident	85.1	Confident	101 Å²	101	54.4 Å²	54.4	66%	0.656	31%	0.305	S	S	*	.			trans	-71.3	83.9	170.3	31.3	-34.2	0	0	0	109.9
132	A	81.1	Confident	85.2	Confident	30 Å²	30	55.1 Å²	55.1	25%	0.248	31%	0.313	C	S	.	.			trans	-111.1	158.2	179.6	0	0	0	0	0	111.6	L130 V136 Q137	L130-A132 VanDerWaalsContact C-N 3.27Å; L130-A132 PolarHBondContact O-N 3.22Å; A132-V136 HydrophobicContact CB-CB 4.32Å; A132-V136 HydrophobicContact CB-CG1 4.13Å; A132-Q137 HydrophobicContact CB-CG 4.23Å
133	P	83.5	Confident	85.3	Confident	63 Å²	63	48.1 Å²	48.1	41%	0.409	28%	0.281	S	S	.	.			trans	-54.5	152.6	177.8	-27.2	35.9	0	0	0	113.5	E91 S135 V136 Q137	E91-P133 HydrophobicContact CG-CB 4.3Å; E91-P133 HydrophobicContact CG-CG 4.33Å; E91-P133 WeakPolarHBondContact OE1-CB 3.27Å; P133-S135 PolarHBondContact O-N 2.69Å; P133-V136 HydrophobicContact CB-CG2 4.48Å; P133-V136 PolarHBondContact O-N 2.76Å; P133-V136 VanDerWaalsContact O-N 3.16Å; P133-Q137 WeakPolarHBondContact O-CB 3.46Å; P133-Q137 PolarHBondContact O-N 2.93Å
134	A	82.4	Confident	85.3	Confident	84 Å²	84	44.2 Å²	44.2	69%	0.694	26%	0.26	S	S	*	.	H	α-helix	trans	-55.8	-36.4	-176.8	0	0	0	0	0	113.1	Q137 Q138	A134-Q137 CarbonylContact O-C 3.5Å; A134-Q137 PolarHBondContact O-N 3.3Å; A134-Q138 WeakPolarHBondContact O-CB 3.48Å; A134-Q138 PolarHBondContact O-N 3.49Å
135	S	85.8	Confident	85.4	Confident	36 Å²	36	46.2 Å²	46.2	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-58.8	-56.6	174.1	55.8	0	0	0	0	112.7	E91 P133 Q137 Q138 Q139	E91-S135 WeakPolarHBondContact CG-OG 3.43Å; E91-S135 PolarHBondContact OE1-OG 3.31Å; P133-S135 PolarHBondContact O-N 2.69Å; S135-Q137 VanDerWaalsContact C-N 3.3Å; S135-Q137 PolarHBondContact O-N 2.81Å; S135-Q138 WeakPolarHBondContact O-CB 3.32Å; S135-Q138 PolarHBondContact O-N 2.94Å; S135-Q139 PolarHBondContact O-N 2.88Å; S135-Q139 VanDerWaalsContact O-N 3.07Å
136	V	87.9	Confident	85.4	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-41	175.9	179	0	0	0	0	110.7	E91 V94 V95 L98 A132 P133 Q138 S140	E91-V136 HydrophobicContact CG-CG2 4.25Å; V94-V136 HydrophobicContact CB-CG2 4.41Å; V94-V136 HydrophobicContact CG1-CG1 3.85Å; V94-V136 HydrophobicContact CG1-CG2 3.95Å; V95-V136 HydrophobicContact CG2-CG2 3.93Å; L98-V136 HydrophobicContact CD1-CG1 4.17Å; A132-V136 HydrophobicContact CB-CB 4.32Å; A132-V136 HydrophobicContact CB-CG1 4.13Å; P133-V136 HydrophobicContact CB-CG2 4.48Å; P133-V136 PolarHBondContact O-N 2.76Å; P133-V136 VanDerWaalsContact O-N 3.16Å; V136-Q138 VanDerWaalsContact C-N 3.25Å; V136-Q138 PolarHBondContact O-N 3.43Å; V136-S140 VanDerWaalsContact O-CB 3.26Å; V136-S140 WeakPolarHBondContact O-CB 3.4Å; V136-S140 PolarHBondContact O-N 2.84Å; V136-S140 PolarHBondContact O-OG 3Å
137	Q	86.9	Confident	85.4	Confident	31 Å²	31	42.4 Å²	42.4	15%	0.145	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-21.5	174.8	-87.4	-80.5	-17.9	0	0	113.3	L127 L128 L130 A132 P133 A134 S135 K141	L127-Q137 PolarHBondContact O-NE2 3.32Å; L128-Q137 PolarHBondContact O-NE2 2.73Å; L130-Q137 PolarHBondContact O-NE2 3.12Å; L130-Q137 VanDerWaalsContact O-NE2 3.12Å; A132-Q137 HydrophobicContact CB-CG 4.23Å; P133-Q137 WeakPolarHBondContact O-CB 3.46Å; P133-Q137 PolarHBondContact O-N 2.93Å; A134-Q137 CarbonylContact O-C 3.5Å; A134-Q137 PolarHBondContact O-N 3.3Å; S135-Q137 VanDerWaalsContact C-N 3.3Å; S135-Q137 PolarHBondContact O-N 2.81Å; Q137-K141 WeakPolarHBondContact O-CD 3.34Å; Q137-K141 VanDerWaalsContact O-CE 3.24Å; Q137-K141 WeakPolarHBondContact O-CE 3.45Å; Q137-K141 WeakPolarHBondContact O-CG 3.28Å; Q137-K141 PolarHBondContact O-NZ 3.35Å
138	Q	88.5	Confident	85.4	Confident	129 Å²	129	42.4 Å²	42.4	60%	0.603	26%	0.258	S	S	*	.	H	α-helix	trans	-81.4	-52.7	174.1	179.9	169.2	-27	0	0	110.3	A134 S135 V136 S140 K141 S142	A134-Q138 WeakPolarHBondContact O-CB 3.48Å; A134-Q138 PolarHBondContact O-N 3.49Å; S135-Q138 WeakPolarHBondContact O-CB 3.32Å; S135-Q138 PolarHBondContact O-N 2.94Å; V136-Q138 VanDerWaalsContact C-N 3.25Å; V136-Q138 PolarHBondContact O-N 3.43Å; Q138-S140 VanDerWaalsContact C-N 3.3Å; Q138-S140 PolarHBondContact O-N 3.05Å; Q138-K141 WeakPolarHBondContact O-CA 3.46Å; Q138-K141 WeakPolarHBondContact O-CB 3.28Å; Q138-K141 PolarHBondContact O-N 3.4Å; Q138-S142 PolarHBondContact O-N 3.38Å
139	Q	89.1	Confident	85.3	Confident	34 Å²	34	49 Å²	49	16%	0.159	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-28.7	-180	-50.8	-50.8	36	0	0	112.8	V95 L98 E99 S135 K141 S142 L143	V95-Q139 HydrophobicContact CG1-CG 4.06Å; L98-Q139 HydrophobicContact CB-CB 3.75Å; L98-Q139 HydrophobicContact CD1-CB 4.12Å; E99-Q139 HydrophobicContact CG-CG 3.95Å; E99-Q139 PolarHBondContact OE1-NE2 2.87Å; S135-Q139 PolarHBondContact O-N 2.88Å; S135-Q139 VanDerWaalsContact O-N 3.07Å; Q139-K141 VanDerWaalsContact C-N 3.25Å; Q139-K141 PolarHBondContact O-N 2.87Å; Q139-S142 PolarHBondContact O-N 3.4Å; Q139-L143 VanDerWaalsContact O-CB 3.28Å; Q139-L143 WeakPolarHBondContact O-CB 3.41Å; Q139-L143 PolarHBondContact O-N 3.42Å
140	S	88.9	Confident	85.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-30.4	169.4	-57.1	0	0	0	0	112.8	L127 V136 Q138 L144	L127-S140 WeakPolarHBondContact CB-OG 3.31Å; V136-S140 VanDerWaalsContact O-CB 3.26Å; V136-S140 WeakPolarHBondContact O-CB 3.4Å; V136-S140 PolarHBondContact O-N 2.84Å; V136-S140 PolarHBondContact O-OG 3Å; Q138-S140 VanDerWaalsContact C-N 3.3Å; Q138-S140 PolarHBondContact O-N 3.05Å; S140-L144 WeakPolarHBondContact O-CB 3.02Å; S140-L144 WeakPolarHBondContact O-CD1 3.32Å; S140-L144 VanDerWaalsContact O-CG 3.28Å; S140-L144 WeakPolarHBondContact O-CG 3.49Å; S140-L144 PolarHBondContact O-N 2.82Å
141	K	89.6	Confident	86	Confident	77 Å²	77	55.7 Å²	55.7	34%	0.335	32%	0.322	S	S	.	.	H	α-helix	trans	-78.9	-35.7	175.5	-71.4	168.3	-166.9	118.4	0	111.9	L128 Q137 Q138 Q139 A145 Y154	L128-K141 HydrophobicContact CD1-CD 4.25Å; L128-K141 HydrophobicContact CD1-CG 3.51Å; Q137-K141 WeakPolarHBondContact O-CD 3.34Å; Q137-K141 VanDerWaalsContact O-CE 3.24Å; Q137-K141 WeakPolarHBondContact O-CE 3.45Å; Q137-K141 WeakPolarHBondContact O-CG 3.28Å; Q137-K141 PolarHBondContact O-NZ 3.35Å; Q138-K141 WeakPolarHBondContact O-CA 3.46Å; Q138-K141 WeakPolarHBondContact O-CB 3.28Å; Q138-K141 PolarHBondContact O-N 3.4Å; Q139-K141 VanDerWaalsContact C-N 3.25Å; Q139-K141 PolarHBondContact O-N 2.87Å; K141-A145 PolarHBondContact O-N 3.45Å; K141-Y154 WeakPolarHBondContact CB-OH 3.28Å; K141-Y154 PolarHBondContact O-OH 3.44Å
142	S	87.9	Confident	86.5	Confident	45 Å²	45	55.2 Å²	55.2	32%	0.315	32%	0.321	S	S	.	.	H	α-helix	trans	-73	-48.1	-179.7	-151	0	0	0	0	111.2	E102 Q138 Q139 L144 A145 S146	E102-S142 VanDerWaalsContact CD-C 3.47Å; E102-S142 WeakPolarHBondContact OE1-CB 3.49Å; E102-S142 PolarHBondContact OE1-OG 3.37Å; E102-S142 VanDerWaalsContact OE2-CB 3.26Å; E102-S142 WeakPolarHBondContact OE2-CB 3.39Å; E102-S142 PolarHBondContact OE2-OG 2.85Å; Q138-S142 PolarHBondContact O-N 3.38Å; Q139-S142 PolarHBondContact O-N 3.4Å; S142-L144 VanDerWaalsContact C-N 3.34Å; S142-L144 PolarHBondContact O-N 3.09Å; S142-A145 WeakPolarHBondContact O-CA 3.4Å; S142-A145 WeakPolarHBondContact O-CB 3.17Å; S142-A145 PolarHBondContact O-N 3.14Å; S142-S146 PolarHBondContact O-N 2.98Å
143	L	88.7	Confident	86.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-52.4	-47.7	166.8	175	59.6	0	0	0	112.2	L98 L101 E102 F105 A124 Q139 A145 S146 L147	L98-L143 HydrophobicContact CD2-CD2 3.73Å; L101-L143 HydrophobicContact CD2-CD1 4.46Å; L101-L143 HydrophobicContact CD2-CD2 3.77Å; L101-L143 HydrophobicContact CG-CD1 4.07Å; L101-L143 HydrophobicContact CG-CD2 4.21Å; E102-L143 HydrophobicContact CB-CB 4.28Å; E102-L143 HydrophobicContact CB-CD1 4.21Å; E102-L143 PolarHBondContact OE2-N 3.41Å; F105-L143 HydrophobicContact CD2-CD1 3.83Å; F105-L143 HydrophobicContact CE2-CD1 4.47Å; A124-L143 HydrophobicContact CB-CD2 3.89Å; A124-L143 HydrophobicContact CB-CG 4.19Å; Q139-L143 VanDerWaalsContact O-CB 3.28Å; Q139-L143 WeakPolarHBondContact O-CB 3.41Å; Q139-L143 PolarHBondContact O-N 3.42Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.26Å; L143-S146 PolarHBondContact O-N 3.3Å; L143-S146 PolarHBondContact O-OG 2.96Å; L143-L147 HydrophobicContact CD1-CD1 4.28Å; L143-L147 HydrophobicContact CD1-CG 4.47Å; L143-L147 HydrophobicContact CG-CD1 4.28Å; L143-L147 WeakPolarHBondContact O-CG 3.5Å; L143-L147 PolarHBondContact O-N 3.23Å
144	L	88.1	Confident	87	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-34.5	174.7	-82.8	171.3	0	0	0	112.9	Q121 A124 L128 S140 S142 L147 H148 Y154	Q121-L144 HydrophobicContact CG-CD2 4.34Å; A124-L144 HydrophobicContact CB-CD1 4.3Å; A124-L144 HydrophobicContact CB-CD2 3.97Å; A124-L144 HydrophobicContact CB-CG 3.66Å; L128-L144 HydrophobicContact CB-CD1 4.44Å; L128-L144 HydrophobicContact CD2-CD1 4.04Å; S140-L144 WeakPolarHBondContact O-CB 3.02Å; S140-L144 WeakPolarHBondContact O-CD1 3.32Å; S140-L144 VanDerWaalsContact O-CG 3.28Å; S140-L144 WeakPolarHBondContact O-CG 3.49Å; S140-L144 PolarHBondContact O-N 2.82Å; S142-L144 VanDerWaalsContact C-N 3.34Å; S142-L144 PolarHBondContact O-N 3.09Å; L144-L147 PolarHBondContact O-N 2.88Å; L144-H148 PolarHBondContact O-CD2 3.01Å; L144-H148 VanDerWaalsContact O-CD2 3.27Å; L144-Y154 HydrophobicContact CB-CD2 4.05Å; L144-Y154 HydrophobicContact CB-CE2 3.66Å
145	A	87.7	Confident	87.4	Confident	41 Å²	41	51.6 Å²	51.6	34%	0.339	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-44.6	175.3	0	0	0	0	0	111.3	K141 S142 L143 L147 H148 Y154	K141-A145 PolarHBondContact O-N 3.45Å; S142-A145 WeakPolarHBondContact O-CA 3.4Å; S142-A145 WeakPolarHBondContact O-CB 3.17Å; S142-A145 PolarHBondContact O-N 3.14Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.26Å; A145-L147 PolarHBondContact O-N 3.26Å; A145-L147 VanDerWaalsContact O-N 3.16Å; A145-H148 PolarHBondContact O-N 3.47Å; A145-Y154 HydrophobicContact CB-CD1 4.48Å; A145-Y154 HydrophobicContact CB-CD2 4.35Å; A145-Y154 HydrophobicContact CB-CE1 4.39Å; A145-Y154 HydrophobicContact CB-CE2 4.3Å; A145-Y154 HydrophobicContact CB-CG 4.46Å
146	S	85.8	Confident	87.6	Confident	42 Å²	42	51.7 Å²	51.7	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-24.1	177.7	77.9	0	0	0	0	114.4	S142 L143	S142-S146 PolarHBondContact O-N 2.98Å; L143-S146 PolarHBondContact O-N 3.3Å; L143-S146 PolarHBondContact O-OG 2.96Å
147	L	85.9	Confident	87.6	Confident	7 Å²	7	53 Å²	53	4%	0.037	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-16.2	-178.1	-70.3	166.8	0	0	0	113.7	F105 K117 A120 Q121 L143 L144 A145	F105-L147 HydrophobicContact CB-CD2 4.44Å; F105-L147 HydrophobicContact CD1-CD2 3.42Å; F105-L147 VanDerWaalsContact CD1-CD2 3.42Å; F105-L147 HydrophobicContact CD2-CD2 3.94Å; F105-L147 HydrophobicContact CE1-CD2 3.48Å; F105-L147 VanDerWaalsContact CE1-CD2 3.48Å; F105-L147 HydrophobicContact CE2-CD2 4.01Å; F105-L147 HydrophobicContact CG-CD2 3.67Å; F105-L147 HydrophobicContact CZ-CD2 3.79Å; K117-L147 HydrophobicContact CB-CD2 4.45Å; K117-L147 WeakPolarHBondContact CE-O 3.29Å; K117-L147 HydrophobicContact CG-CD2 4.24Å; K117-L147 PolarHBondContact NZ-O 3.05Å; A120-L147 HydrophobicContact CB-CD1 3.99Å; A120-L147 HydrophobicContact CB-CD2 4.12Å; Q121-L147 HydrophobicContact CB-CD1 4.16Å; L143-L147 HydrophobicContact CD1-CD1 4.28Å; L143-L147 HydrophobicContact CD1-CG 4.47Å; L143-L147 HydrophobicContact CG-CD1 4.28Å; L143-L147 WeakPolarHBondContact O-CG 3.5Å; L143-L147 PolarHBondContact O-N 3.23Å; L144-L147 PolarHBondContact O-N 2.88Å; A145-L147 PolarHBondContact O-N 3.26Å; A145-L147 VanDerWaalsContact O-N 3.16Å
148	H	85.7	Confident	87.8	Confident	42 Å²	42	53 Å²	53	19%	0.194	29%	0.289	C	S	.	.			trans	-112.8	131	-175.6	-75.2	-73.6	0	0	0	111.9	Q121 L144 A145 S150 A153 H157	Q121-H148 PolarHBondContact NE2-CE1 3.31Å; L144-H148 PolarHBondContact O-CD2 3.01Å; L144-H148 VanDerWaalsContact O-CD2 3.27Å; A145-H148 PolarHBondContact O-N 3.47Å; H148-S150 PolarHBondContact O-N 3.07Å; H148-A153 HydrophobicContact CB-CB 4.44Å; H148-H157 AromaticContact CE1-CG 3.59Å; H148-H157 WeakPolarHBondContact NE2-CB 3.5Å; H148-H157 AromaticContact NE2-CE1 3.37Å; H148-H157 PolarHBondContact NE2-CE1 2.98Å; H148-H157 AromaticContact NE2-CG 3.09Å; H148-H157 AromaticContact NE2-ND1 2.6Å; H148-H157 PolarHBondContact NE2-ND1 3.3Å
149	T	81.6	Confident	88	Confident	145 Å²	145	46.8 Å²	46.8	89%	0.89	26%	0.261	S	S	*	.	S	Bend	trans	-74.1	-6.8	-178.6	48.6	0	0	0	0	114.4
150	S	88	Confident	88	Confident	56 Å²	56	48.4 Å²	48.4	39%	0.392	27%	0.268	S	S	.	.	S	Bend	trans	-144.8	147.1	172.2	81	0	0	0	0	112.2	H148 S152 A153 Y154	H148-S150 PolarHBondContact O-N 3.07Å; S150-S152 PolarHBondContact O-N 2.61Å; S150-A153 PolarHBondContact O-N 3.18Å; S150-A153 VanDerWaalsContact O-N 3.13Å; S150-A153 WeakPolarHBondContact OG-CB 3.33Å; S150-A153 PolarHBondContact OG-N 2.92Å; S150-A153 VanDerWaalsContact OG-N 3.15Å; S150-Y154 PolarHBondContact O-N 2.67Å
151	R	87.2	Confident	88	Confident	199 Å²	199	49.2 Å²	49.2	75%	0.751	28%	0.275	S	S	*	.	H	α-helix	trans	-59.9	-31.3	177.2	-172.1	172.6	-179.6	162.8	-1.2	112.5	H155	R151-H155 WeakPolarHBondContact O-CB 3.3Å; R151-H155 VanDerWaalsContact O-CG 3.32Å; R151-H155 PolarHBondContact O-N 3.17Å
152	S	86.2	Confident	88	Confident	91 Å²	91	47.2 Å²	47.2	64%	0.636	27%	0.267	S	S	*	.	H	α-helix	trans	-67.1	-47.8	173.8	-173.5	0	0	0	0	111.7	S150 Y154 H155 S156	S150-S152 PolarHBondContact O-N 2.61Å; S152-Y154 PolarHBondContact O-N 2.79Å; S152-H155 PolarHBondContact O-N 2.71Å; S152-S156 VanDerWaalsContact O-CB 3.22Å; S152-S156 WeakPolarHBondContact O-CB 3.45Å; S152-S156 PolarHBondContact O-N 3.12Å
153	A	85.9	Confident	88.1	Confident	34 Å²	34	45.1 Å²	45.1	28%	0.281	25%	0.253	S	S	.	.	H	α-helix	trans	-61.7	-43.6	176.7	0	0	0	0	0	112.2	H148 S150 S156 H157	H148-A153 HydrophobicContact CB-CB 4.44Å; S150-A153 PolarHBondContact O-N 3.18Å; S150-A153 VanDerWaalsContact O-N 3.13Å; S150-A153 WeakPolarHBondContact OG-CB 3.33Å; S150-A153 PolarHBondContact OG-N 2.92Å; S150-A153 VanDerWaalsContact OG-N 3.15Å; A153-S156 PolarHBondContact O-N 3.29Å; A153-H157 WeakPolarHBondContact O-CB 3.33Å; A153-H157 PolarHBondContact O-N 3.18Å
154	Y	90.1	Very high	88	Confident	30 Å²	30	46.6 Å²	46.6	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-55.7	-53.2	172.5	164.4	-119.5	0	0	0	112.2	K141 L144 A145 S150 S152 K158	K141-Y154 WeakPolarHBondContact CB-OH 3.28Å; K141-Y154 PolarHBondContact O-OH 3.44Å; L144-Y154 HydrophobicContact CB-CD2 4.05Å; L144-Y154 HydrophobicContact CB-CE2 3.66Å; A145-Y154 HydrophobicContact CB-CD1 4.48Å; A145-Y154 HydrophobicContact CB-CD2 4.35Å; A145-Y154 HydrophobicContact CB-CE1 4.39Å; A145-Y154 HydrophobicContact CB-CE2 4.3Å; A145-Y154 HydrophobicContact CB-CG 4.46Å; S150-Y154 PolarHBondContact O-N 2.67Å; S152-Y154 PolarHBondContact O-N 2.79Å; Y154-K158 HydrophobicContact CE2-CB 4.37Å; Y154-K158 HydrophobicContact CE2-CD 4.38Å; Y154-K158 WeakPolarHBondContact O-CB 3.48Å; Y154-K158 PolarHBondContact O-N 2.91Å
155	H	89.6	Confident	87.9	Confident	37 Å²	37	50.4 Å²	50.4	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-41.1	-179.4	-76.9	-9.9	0	0	0	112.6	R151 S152 D159	R151-H155 WeakPolarHBondContact O-CB 3.3Å; R151-H155 VanDerWaalsContact O-CG 3.32Å; R151-H155 PolarHBondContact O-N 3.17Å; S152-H155 PolarHBondContact O-N 2.71Å; H155-D159 VanDerWaalsContact O-CB 3.29Å; H155-D159 WeakPolarHBondContact O-CB 3.3Å; H155-D159 PolarHBondContact O-N 2.82Å
156	S	89.6	Confident	88	Confident	39 Å²	39	48.9 Å²	48.9	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-54.4	175.5	-178.3	0	0	0	0	111.5	S152 A153 K158 D159 Q160 F206	S152-S156 VanDerWaalsContact O-CB 3.22Å; S152-S156 WeakPolarHBondContact O-CB 3.45Å; S152-S156 PolarHBondContact O-N 3.12Å; A153-S156 PolarHBondContact O-N 3.29Å; S156-K158 PolarHBondContact O-N 3.29Å; S156-D159 PolarHBondContact O-N 2.93Å; S156-Q160 VanDerWaalsContact O-CB 3.23Å; S156-Q160 WeakPolarHBondContact O-CB 3.1Å; S156-Q160 PolarHBondContact O-N 3.41Å; S156-F206 WeakPolarHBondContact O-CE2 3.41Å; S156-F206 WeakPolarHBondContact OG-CZ 3.49Å
157	H	88.9	Confident	88	Confident	33 Å²	33	47.3 Å²	47.3	15%	0.153	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-44.4	178.7	178.1	-106.7	0	0	0	112.8	Q121 T125 H148 A153 Q160 A161	Q121-H157 VanDerWaalsContact CG-CE1 3.41Å; Q121-H157 WeakPolarHBondContact CG-CE1 3.22Å; Q121-H157 PolarHBondContact NE2-CD2 2.95Å; Q121-H157 PolarHBondContact NE2-CE1 3.03Å; Q121-H157 VanDerWaalsContact NE2-CE1 3.27Å; Q121-H157 PolarHBondContact NE2-NE2 3.33Å; T125-H157 PolarHBondContact OG1-CE1 3.38Å; H148-H157 AromaticContact CE1-CG 3.59Å; H148-H157 WeakPolarHBondContact NE2-CB 3.5Å; H148-H157 AromaticContact NE2-CE1 3.37Å; H148-H157 PolarHBondContact NE2-CE1 2.98Å; H148-H157 AromaticContact NE2-CG 3.09Å; H148-H157 AromaticContact NE2-ND1 2.6Å; H148-H157 PolarHBondContact NE2-ND1 3.3Å; A153-H157 WeakPolarHBondContact O-CB 3.33Å; A153-H157 PolarHBondContact O-N 3.18Å; H157-Q160 PolarHBondContact O-N 3.41Å; H157-A161 WeakPolarHBondContact O-CB 3.48Å; H157-A161 PolarHBondContact O-N 3.31Å
158	K	90.7	Very high	88.1	Confident	31 Å²	31	51.9 Å²	51.9	14%	0.135	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-46.1	179.4	-176	-149.3	69.5	-178.5	0	111.7	L128 Y154 S156 A161 L162	L128-K158 HydrophobicContact CD2-CG 3.56Å; Y154-K158 HydrophobicContact CE2-CB 4.37Å; Y154-K158 HydrophobicContact CE2-CD 4.38Å; Y154-K158 WeakPolarHBondContact O-CB 3.48Å; Y154-K158 PolarHBondContact O-N 2.91Å; S156-K158 PolarHBondContact O-N 3.29Å; K158-A161 PolarHBondContact O-N 2.84Å; K158-L162 HydrophobicContact CG-CD1 4.3Å; K158-L162 WeakPolarHBondContact O-CG 3.39Å; K158-L162 PolarHBondContact O-N 3.38Å; K158-L162 VanDerWaalsContact O-N 3.17Å
159	D	92.1	Very high	88.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-41.9	178	-64.2	-11.2	0	0	0	110.9	H155 S156 A161 L162 L163 I195 R199 N202	H155-D159 VanDerWaalsContact O-CB 3.29Å; H155-D159 WeakPolarHBondContact O-CB 3.3Å; H155-D159 PolarHBondContact O-N 2.82Å; S156-D159 PolarHBondContact O-N 2.93Å; D159-A161 VanDerWaalsContact C-N 3.32Å; D159-A161 PolarHBondContact O-N 2.87Å; D159-L162 PolarHBondContact O-N 2.92Å; D159-L163 WeakPolarHBondContact O-CB 3.43Å; D159-L163 WeakPolarHBondContact O-CG 3.49Å; D159-L163 PolarHBondContact O-N 3.21Å; D159-I195 HydrophobicContact CB-CD1 3.96Å; D159-I195 HydrophobicContact CB-CG1 4.31Å; D159-I195 HydrophobicContact CB-CG2 4.09Å; D159-R199 VanDerWaalsContact CG-NH2 3.28Å; D159-R199 IonicContact OD1-CZ 3.21Å; D159-R199 IonicContact OD1-NE 2.71Å; D159-R199 IonicContact OD1-NH2 3.35Å; D159-R199 PolarHBondContact OD1-NH2 2.94Å; D159-R199 IonicContact OD2-CZ 3.66Å; D159-R199 IonicContact OD2-NE 3.79Å; D159-R199 PolarHBondContact OD2-NE 2.75Å; D159-R199 IonicContact OD2-NH2 3.12Å; D159-R199 PolarHBondContact OD2-NH2 2.88Å; D159-N202 HydrophobicContact CB-CB 4.22Å; D159-N202 PolarHBondContact OD2-ND2 3.38Å
160	Q	90.2	Very high	88.3	Confident	67 Å²	67	44.1 Å²	44.1	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-55.7	-46	174.7	-175.4	-177.8	48.3	0	0	111.6	S156 H157 S164 F206	S156-Q160 VanDerWaalsContact O-CB 3.23Å; S156-Q160 WeakPolarHBondContact O-CB 3.1Å; S156-Q160 PolarHBondContact O-N 3.41Å; H157-Q160 PolarHBondContact O-N 3.41Å; Q160-S164 WeakPolarHBondContact O-CB 3.38Å; Q160-S164 PolarHBondContact O-N 3.21Å; Q160-S164 PolarHBondContact O-OG 3.15Å; Q160-F206 HydrophobicContact CB-CD1 3.93Å; Q160-F206 HydrophobicContact CB-CD2 3.77Å; Q160-F206 HydrophobicContact CB-CE1 3.86Å; Q160-F206 HydrophobicContact CB-CE2 3.73Å; Q160-F206 HydrophobicContact CB-CG 3.89Å; Q160-F206 HydrophobicContact CB-CZ 3.77Å; Q160-F206 HydrophobicContact CG-CD1 3.6Å; Q160-F206 HydrophobicContact CG-CD2 4.35Å; Q160-F206 HydrophobicContact CG-CE1 3.72Å; Q160-F206 HydrophobicContact CG-CE2 4.46Å; Q160-F206 HydrophobicContact CG-CG 3.94Å; Q160-F206 HydrophobicContact CG-CZ 4.17Å
161	A	87.7	Confident	88.1	Confident	18 Å²	18	43.1 Å²	43.1	15%	0.149	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-47.4	179.7	0	0	0	0	0	112.2	T125 H157 K158 D159 S164 K165	T125-A161 HydrophobicContact CG2-CB 3.58Å; H157-A161 WeakPolarHBondContact O-CB 3.48Å; H157-A161 PolarHBondContact O-N 3.31Å; K158-A161 PolarHBondContact O-N 2.84Å; D159-A161 VanDerWaalsContact C-N 3.32Å; D159-A161 PolarHBondContact O-N 2.87Å; A161-S164 PolarHBondContact O-N 2.81Å; A161-K165 PolarHBondContact O-N 3.27Å
162	L	89.5	Confident	87.9	Confident	34 Å²	34	36.5 Å²	36.5	18%	0.178	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-43.9	179.2	-70.8	170.2	0	0	0	112	L128 K158 D159 K165 A166 T191 I195	L128-L162 HydrophobicContact CD2-CD1 4.17Å; L128-L162 HydrophobicContact CD2-CD2 4.09Å; L128-L162 HydrophobicContact CD2-CG 4.01Å; L128-L162 HydrophobicContact CG-CD2 4.18Å; K158-L162 HydrophobicContact CG-CD1 4.3Å; K158-L162 WeakPolarHBondContact O-CG 3.39Å; K158-L162 PolarHBondContact O-N 3.38Å; K158-L162 VanDerWaalsContact O-N 3.17Å; D159-L162 PolarHBondContact O-N 2.92Å; L162-K165 PolarHBondContact O-N 3.02Å; L162-A166 PolarHBondContact O-N 2.7Å; L162-T191 HydrophobicContact CB-CG2 3.87Å; L162-T191 HydrophobicContact CD1-CG2 4.01Å; L162-T191 HydrophobicContact CD2-CG2 4.15Å; L162-T191 HydrophobicContact CG-CG2 4.23Å; L162-I195 HydrophobicContact CB-CD1 4.19Å
163	L	90.1	Very high	87.6	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-38.2	176.4	-67.6	170.2	0	0	0	112.2	D159 K165 A166 V167 I195 L203 F206 T207	D159-L163 WeakPolarHBondContact O-CB 3.43Å; D159-L163 WeakPolarHBondContact O-CG 3.49Å; D159-L163 PolarHBondContact O-N 3.21Å; L163-K165 VanDerWaalsContact C-N 3.26Å; L163-K165 PolarHBondContact O-N 3.11Å; L163-A166 WeakPolarHBondContact O-CB 3.41Å; L163-A166 PolarHBondContact O-N 3.35Å; L163-V167 WeakPolarHBondContact O-CB 3.18Å; L163-V167 VanDerWaalsContact O-CG2 3.31Å; L163-V167 WeakPolarHBondContact O-CG2 3.17Å; L163-V167 PolarHBondContact O-N 2.85Å; L163-I195 HydrophobicContact CD1-CD1 4.12Å; L163-I195 HydrophobicContact CD1-CG2 4.2Å; L163-I195 HydrophobicContact CD2-CD1 4Å; L163-I195 HydrophobicContact CG-CD1 3.73Å; L163-L203 HydrophobicContact CD1-CD1 4.33Å; L163-L203 HydrophobicContact CD2-CD1 3.72Å; L163-F206 HydrophobicContact CB-CB 4.34Å; L163-F206 HydrophobicContact CD1-CB 3.95Å; L163-F206 HydrophobicContact CD1-CD2 4.44Å; L163-T207 HydrophobicContact CD2-CG2 4.44Å
164	S	87.6	Confident	87.1	Confident	32 Å²	32	34.1 Å²	34.1	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-38.5	173.3	-58.8	0	0	0	0	111.3	Q160 A161 Q168 K210	Q160-S164 WeakPolarHBondContact O-CB 3.38Å; Q160-S164 PolarHBondContact O-N 3.21Å; Q160-S164 PolarHBondContact O-OG 3.15Å; A161-S164 PolarHBondContact O-N 2.81Å; S164-Q168 WeakPolarHBondContact O-CB 3.5Å; S164-Q168 PolarHBondContact O-N 2.69Å; S164-K210 PolarHBondContact OG-NZ 3.22Å
165	K	86.7	Confident	86.3	Confident	80 Å²	80	40.3 Å²	40.3	35%	0.348	21%	0.214	S	C	.	.	H	α-helix	trans	-69.5	-41.3	175	-172.4	63.8	-174.2	174.8	0	112	A161 L162 L163 Q168 C169	A161-K165 PolarHBondContact O-N 3.27Å; L162-K165 PolarHBondContact O-N 3.02Å; L163-K165 VanDerWaalsContact C-N 3.26Å; L163-K165 PolarHBondContact O-N 3.11Å; K165-Q168 WeakPolarHBondContact O-CB 3.27Å; K165-Q168 PolarHBondContact O-N 3.05Å; K165-C169 PolarHBondContact O-N 2.99Å; K165-C169 PolarHBondContact O-SG 2.92Å
166	A	88.2	Confident	85.4	Confident	9 Å²	9	44 Å²	44	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-51	174.7	0	0	0	0	0	111.9	L162 L163 Q168 C169 L170 L188 F264	L162-A166 PolarHBondContact O-N 2.7Å; L163-A166 WeakPolarHBondContact O-CB 3.41Å; L163-A166 PolarHBondContact O-N 3.35Å; A166-Q168 VanDerWaalsContact C-N 3.31Å; A166-Q168 PolarHBondContact O-N 3.06Å; A166-C169 PolarHBondContact O-N 3.29Å; A166-L170 WeakPolarHBondContact O-CG 3.19Å; A166-L170 PolarHBondContact O-N 3.36Å; A166-L170 VanDerWaalsContact O-N 3.08Å; A166-L188 HydrophobicContact CB-CD1 4.02Å; A166-L188 HydrophobicContact CB-CD2 3.84Å; A166-L188 HydrophobicContact CB-CG 3.65Å; A166-F264 HydrophobicContact CB-CE2 4.12Å; A166-F264 HydrophobicContact CB-CZ 4.25Å
167	V	87.4	Confident	84.2	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-39.6	175.3	171.7	0	0	0	0	111.2	L163 N171 T207 L211 F264	L163-V167 WeakPolarHBondContact O-CB 3.18Å; L163-V167 VanDerWaalsContact O-CG2 3.31Å; L163-V167 WeakPolarHBondContact O-CG2 3.17Å; L163-V167 PolarHBondContact O-N 2.85Å; V167-N171 VanDerWaalsContact CG1-ND2 3.35Å; V167-N171 WeakPolarHBondContact CG1-ND2 3.24Å; V167-N171 WeakPolarHBondContact O-CB 3.48Å; V167-N171 PolarHBondContact O-N 3.37Å; V167-N171 VanDerWaalsContact O-N 3.13Å; V167-N171 PolarHBondContact O-ND2 2.98Å; V167-T207 HydrophobicContact CG2-CG2 4.26Å; V167-L211 HydrophobicContact CG1-CD1 3.75Å; V167-L211 HydrophobicContact CG1-CG 4.34Å; V167-L211 HydrophobicContact CG2-CD1 4.33Å; V167-F264 HydrophobicContact CG2-CD2 3.66Å; V167-F264 HydrophobicContact CG2-CE2 3.89Å
168	Q	86.4	Confident	83.2	Confident	103 Å²	103	49.7 Å²	49.7	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-50.8	174.2	-172.5	-172.7	46	0	0	111.3	S164 K165 A166 L170 N171 T172	S164-Q168 WeakPolarHBondContact O-CB 3.5Å; S164-Q168 PolarHBondContact O-N 2.69Å; K165-Q168 WeakPolarHBondContact O-CB 3.27Å; K165-Q168 PolarHBondContact O-N 3.05Å; A166-Q168 VanDerWaalsContact C-N 3.31Å; A166-Q168 PolarHBondContact O-N 3.06Å; Q168-L170 PolarHBondContact O-N 2.86Å; Q168-N171 PolarHBondContact O-N 3.26Å; Q168-T172 PolarHBondContact O-N 3.44Å; Q168-T172 PolarHBondContact O-OG1 3.19Å; Q168-T172 VanDerWaalsContact O-OG1 3.05Å
169	C	86.4	Confident	82.2	Confident	24 Å²	24	53.6 Å²	53.6	16%	0.162	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-48.2	-177.3	-71	0	0	0	0	112.6	K165 A166 N171 T172 S173 L180 L188	K165-C169 PolarHBondContact O-N 2.99Å; K165-C169 PolarHBondContact O-SG 2.92Å; A166-C169 PolarHBondContact O-N 3.29Å; C169-N171 VanDerWaalsContact C-N 3.35Å; C169-N171 PolarHBondContact O-N 3.2Å; C169-T172 WeakPolarHBondContact CA-OG1 3.39Å; C169-T172 PolarHBondContact O-N 3.2Å; C169-T172 PolarHBondContact O-OG1 2.95Å; C169-S173 PolarHBondContact O-N 3.22Å; C169-S173 PolarHBondContact O-OG 2.98Å; C169-L180 HydrophobicContact CB-CD1 4.35Å; C169-L188 HydrophobicContact CB-CD1 4.01Å
170	L	85.3	Confident	81.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-37.9	178.5	-62.5	172	0	0	0	112.3	A166 Q168 S173 S174 F185 L188 F264 Q267 L268	A166-L170 WeakPolarHBondContact O-CG 3.19Å; A166-L170 PolarHBondContact O-N 3.36Å; A166-L170 VanDerWaalsContact O-N 3.08Å; Q168-L170 PolarHBondContact O-N 2.86Å; L170-S173 PolarHBondContact O-OG 2.91Å; L170-S173 VanDerWaalsContact O-OG 3.1Å; L170-S174 WeakPolarHBondContact O-CB 3.42Å; L170-S174 PolarHBondContact O-N 2.97Å; L170-F185 HydrophobicContact CD2-CE2 4.47Å; L170-L188 HydrophobicContact CD1-CD2 4.42Å; L170-L188 HydrophobicContact CD2-CD1 4.14Å; L170-L188 HydrophobicContact CG-CD1 4.02Å; L170-F264 HydrophobicContact CD1-CD2 3.85Å; L170-F264 HydrophobicContact CD1-CE2 3.56Å; L170-F264 HydrophobicContact CD1-CZ 4.42Å; L170-Q267 HydrophobicContact CB-CB 4.44Å; L170-Q267 VanDerWaalsContact CB-OE1 3.26Å; L170-Q267 HydrophobicContact CD1-CB 4.21Å; L170-L268 HydrophobicContact CD1-CD2 3.75Å; L170-L268 HydrophobicContact CD1-CG 4.09Å; L170-L268 HydrophobicContact CD2-CD2 4.28Å
171	N	84.1	Confident	81.3	Confident	35 Å²	35	55.2 Å²	55.2	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-70.4	-33.2	175.5	-79.3	-58.6	0	0	0	112.4	V167 Q168 C169 K175 Q267	V167-N171 VanDerWaalsContact CG1-ND2 3.35Å; V167-N171 WeakPolarHBondContact CG1-ND2 3.24Å; V167-N171 WeakPolarHBondContact O-CB 3.48Å; V167-N171 PolarHBondContact O-N 3.37Å; V167-N171 VanDerWaalsContact O-N 3.13Å; V167-N171 PolarHBondContact O-ND2 2.98Å; Q168-N171 PolarHBondContact O-N 3.26Å; C169-N171 VanDerWaalsContact C-N 3.35Å; C169-N171 PolarHBondContact O-N 3.2Å; N171-K175 WeakPolarHBondContact O-CB 3.5Å; N171-K175 VanDerWaalsContact O-CG 3.24Å; N171-K175 WeakPolarHBondContact O-CG 3.5Å; N171-K175 PolarHBondContact O-N 3.02Å; N171-Q267 PolarHBondContact OD1-NE2 3.07Å
172	T	84.1	Confident	81.1	Confident	60 Å²	60	56.1 Å²	56.1	37%	0.368	31%	0.306	S	S	.	.	H	α-helix	trans	-69.9	-46.1	175.4	42.8	0	0	0	0	112.6	Q168 C169 S174 K175 E176	Q168-T172 PolarHBondContact O-N 3.44Å; Q168-T172 PolarHBondContact O-OG1 3.19Å; Q168-T172 VanDerWaalsContact O-OG1 3.05Å; C169-T172 WeakPolarHBondContact CA-OG1 3.39Å; C169-T172 PolarHBondContact O-N 3.2Å; C169-T172 PolarHBondContact O-OG1 2.95Å; T172-S174 VanDerWaalsContact C-N 3.34Å; T172-S174 PolarHBondContact O-N 2.89Å; T172-K175 PolarHBondContact O-N 3.21Å; T172-E176 WeakPolarHBondContact O-CB 3.42Å; T172-E176 WeakPolarHBondContact O-CG 3.41Å; T172-E176 PolarHBondContact O-N 3.47Å
173	S	79.2	Confident	80.8	Confident	7 Å²	7	60.2 Å²	60.2	5%	0.049	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-41.4	175.2	49.6	0	0	0	0	112	C169 L170 K175 G177 K178 H271	C169-S173 PolarHBondContact O-N 3.22Å; C169-S173 PolarHBondContact O-OG 2.98Å; L170-S173 PolarHBondContact O-OG 2.91Å; L170-S173 VanDerWaalsContact O-OG 3.1Å; S173-K175 PolarHBondContact O-N 3.19Å; S173-G177 PolarHBondContact O-N 3.11Å; S173-G177 VanDerWaalsContact O-N 3.14Å; S173-K178 WeakPolarHBondContact CB-O 3.4Å; S173-H271 PolarHBondContact OG-NE2 3.44Å
174	S	75.1	Confident	80.6	Confident	67 Å²	67	62.5 Å²	62.5	47%	0.469	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-41	176.8	-164	0	0	0	0	112.6	L170 T172	L170-S174 WeakPolarHBondContact O-CB 3.42Å; L170-S174 PolarHBondContact O-N 2.97Å; T172-S174 VanDerWaalsContact C-N 3.34Å; T172-S174 PolarHBondContact O-N 2.89Å
175	K	72.6	Confident	80.6	Confident	160 Å²	160	61 Å²	61	70%	0.696	33%	0.327	S	S	*	.	H	α-helix	trans	-79.4	-34.9	-179.6	-73.1	176.2	-178.2	-176	0	114.4	N171 T172 S173 G177	N171-K175 WeakPolarHBondContact O-CB 3.5Å; N171-K175 VanDerWaalsContact O-CG 3.24Å; N171-K175 WeakPolarHBondContact O-CG 3.5Å; N171-K175 PolarHBondContact O-N 3.02Å; T172-K175 PolarHBondContact O-N 3.21Å; S173-K175 PolarHBondContact O-N 3.19Å; K175-G177 VanDerWaalsContact C-N 3.35Å
176	E	71.1	Confident	80.7	Confident	114 Å²	114	59 Å²	59	53%	0.533	32%	0.319	S	S	.	.	H	α-helix	trans	-84.3	-9.7	-179.1	-69	-174.9	-143.5	0	0	113.4	T172 K178	T172-E176 WeakPolarHBondContact O-CB 3.42Å; T172-E176 WeakPolarHBondContact O-CG 3.41Å; T172-E176 PolarHBondContact O-N 3.47Å; E176-K178 HydrophobicContact CB-CD 4.17Å; E176-K178 HydrophobicContact CB-CG 4.22Å; E176-K178 PolarHBondContact O-N 3.38Å; E176-K178 VanDerWaalsContact O-N 3.16Å; E176-K178 VanDerWaalsContact OE2-CE 3.32Å; E176-K178 WeakPolarHBondContact OE2-CE 3.46Å; E176-K178 IonicContact OE2-NZ 3.4Å; E176-K178 PolarHBondContact OE2-NZ 3.08Å
177	G	63.8	Low	80.6	Confident	63 Å²	63	63.5 Å²	63.5	65%	0.649	33%	0.334	S	S	*	.			trans	68	7.8	-177.8	0	0	0	0	0	114.3	S173 K175	S173-G177 PolarHBondContact O-N 3.11Å; S173-G177 VanDerWaalsContact O-N 3.14Å; K175-G177 VanDerWaalsContact C-N 3.35Å
178	K	69	Low	80.7	Confident	130 Å²	130	63.7 Å²	63.7	57%	0.565	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-86.5	136	176.7	-63.5	171.4	-173.2	164.6	0	109.5	S173 E176	S173-K178 WeakPolarHBondContact CB-O 3.4Å; E176-K178 HydrophobicContact CB-CD 4.17Å; E176-K178 HydrophobicContact CB-CG 4.22Å; E176-K178 PolarHBondContact O-N 3.38Å; E176-K178 VanDerWaalsContact O-N 3.16Å; E176-K178 VanDerWaalsContact OE2-CE 3.32Å; E176-K178 WeakPolarHBondContact OE2-CE 3.46Å; E176-K178 IonicContact OE2-NZ 3.4Å; E176-K178 PolarHBondContact OE2-NZ 3.08Å
179	D	68.9	Low	81	Confident	112 Å²	112	58.9 Å²	58.9	60%	0.599	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-63.3	137.6	169.3	-69.3	-50.1	0	0	0	110.4
180	L	81.3	Confident	81.2	Confident	20 Å²	20	62 Å²	62	11%	0.105	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-79.9	134.4	177.4	-163.9	110.7	0	0	0	108.9	C169 V184 F185 L275	C169-L180 HydrophobicContact CB-CD1 4.35Å; L180-V184 HydrophobicContact CD2-CB 4.17Å; L180-V184 HydrophobicContact CD2-CG1 4.01Å; L180-V184 HydrophobicContact CG-CG1 4.41Å; L180-F185 HydrophobicContact CD2-CB 3.71Å; L180-F185 HydrophobicContact CD2-CD2 4.24Å; L180-F185 HydrophobicContact CD2-CG 4.49Å; L180-L275 WeakPolarHBondContact O-CD2 3.06Å
181	D	82.6	Confident	81.4	Confident	82 Å²	82	64.1 Å²	64.1	44%	0.439	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-48.6	125.8	176	170.3	7	0	0	0	111.5	E183 V184 F185	D181-E183 PolarHBondContact O-N 3.18Å; D181-E183 PolarHBondContact OD1-N 2.92Å; D181-V184 HydrophobicContact CB-CB 4.1Å; D181-V184 HydrophobicContact CB-CG2 3.91Å; D181-V184 PolarHBondContact O-N 2.92Å; D181-V184 WeakPolarHBondContact OD2-CG2 3.4Å; D181-F185 PolarHBondContact O-N 3.38Å
182	P	82.8	Confident	81.9	Confident	36 Å²	36	62.5 Å²	62.5	23%	0.234	33%	0.331	C	S	.	.	H	α-helix	trans	-49.7	-37.6	176.4	-28.6	34.9	0	0	0	114.6	F185 Q186 L275 G292	P182-F185 PolarHBondContact O-N 3.3Å; P182-Q186 WeakPolarHBondContact O-CB 3.17Å; P182-Q186 PolarHBondContact O-N 3.39Å; P182-L275 HydrophobicContact CG-CD2 4.39Å; P182-G292 WeakPolarHBondContact CG-O 3.45Å
183	E	83.3	Confident	82.3	Confident	120 Å²	120	63.7 Å²	63.7	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-67.6	-43.4	176.5	-80.5	-161.3	-154.9	0	0	112.1	D181 F185 Q186 R187	D181-E183 PolarHBondContact O-N 3.18Å; D181-E183 PolarHBondContact OD1-N 2.92Å; E183-F185 VanDerWaalsContact C-N 3.3Å; E183-F185 PolarHBondContact O-N 3.39Å; E183-Q186 PolarHBondContact O-N 3.28Å; E183-R187 WeakPolarHBondContact O-CB 3.45Å; E183-R187 PolarHBondContact O-N 3.27Å; E183-R187 IonicContact OE2-CZ 2.69Å; E183-R187 IonicContact OE2-NH2 3.96Å; E183-R187 PolarHBondContact OE2-NH2 3.2Å
184	V	85.9	Confident	83	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.297	35%	0.35	S	S	.	.	H	α-helix	trans	-64.9	-38.6	177.3	178.9	0	0	0	0	110	L180 D181 L188	L180-V184 HydrophobicContact CD2-CB 4.17Å; L180-V184 HydrophobicContact CD2-CG1 4.01Å; L180-V184 HydrophobicContact CG-CG1 4.41Å; D181-V184 HydrophobicContact CB-CB 4.1Å; D181-V184 HydrophobicContact CB-CG2 3.91Å; D181-V184 PolarHBondContact O-N 2.92Å; D181-V184 WeakPolarHBondContact OD2-CG2 3.4Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 PolarHBondContact O-N 3.44Å
185	F	89.1	Confident	83.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-50.1	174.6	-173.8	-108.1	0	0	0	111.6	L170 L180 D181 P182 E183 R187 L188 V189 L268 H271 F272 L275 L293 T299	L170-F185 HydrophobicContact CD2-CE2 4.47Å; L180-F185 HydrophobicContact CD2-CB 3.71Å; L180-F185 HydrophobicContact CD2-CD2 4.24Å; L180-F185 HydrophobicContact CD2-CG 4.49Å; D181-F185 PolarHBondContact O-N 3.38Å; P182-F185 PolarHBondContact O-N 3.3Å; E183-F185 VanDerWaalsContact C-N 3.3Å; E183-F185 PolarHBondContact O-N 3.39Å; F185-R187 PolarHBondContact O-N 3.31Å; F185-L188 PolarHBondContact O-N 3.44Å; F185-V189 HydrophobicContact CD1-CG2 4.17Å; F185-V189 HydrophobicContact CD2-CG2 4.35Å; F185-V189 HydrophobicContact CE1-CG2 3.76Å; F185-V189 HydrophobicContact CE2-CG2 3.94Å; F185-V189 HydrophobicContact CG-CG2 4.46Å; F185-V189 HydrophobicContact CZ-CG2 3.63Å; F185-V189 WeakPolarHBondContact O-CB 3.44Å; F185-V189 WeakPolarHBondContact O-CG2 3.44Å; F185-V189 PolarHBondContact O-N 3.34Å; F185-L268 HydrophobicContact CE2-CD2 4.06Å; F185-L268 WeakPolarHBondContact CZ-O 3.44Å; F185-H271 HydrophobicContact CD2-CB 3.94Å; F185-H271 HydrophobicContact CE2-CB 3.53Å; F185-H271 HydrophobicContact CZ-CB 4.19Å; F185-F272 HydrophobicContact CE1-CB 4.03Å; F185-F272 HydrophobicContact CZ-CB 3.9Å; F185-L275 HydrophobicContact CB-CD1 3.68Å; F185-L275 HydrophobicContact CD1-CD1 3.9Å; F185-L275 HydrophobicContact CD2-CD1 4.41Å; F185-L275 HydrophobicContact CG-CD1 3.73Å; F185-L293 HydrophobicContact CD1-CD2 4.1Å; F185-T299 HydrophobicContact CD1-CG2 4.44Å; F185-T299 HydrophobicContact CE1-CG2 3.86Å
186	Q	87.8	Confident	84.7	Confident	38 Å²	38	56.3 Å²	56.3	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-41.9	-179.8	-175.7	175.1	-24.2	0	0	111.5	P182 E183 V189 I190 H295	P182-Q186 WeakPolarHBondContact O-CB 3.17Å; P182-Q186 PolarHBondContact O-N 3.39Å; E183-Q186 PolarHBondContact O-N 3.28Å; Q186-V189 PolarHBondContact O-N 3.09Å; Q186-I190 HydrophobicContact CG-CD1 3.86Å; Q186-I190 WeakPolarHBondContact O-CB 3.46Å; Q186-I190 VanDerWaalsContact O-CG1 3.24Å; Q186-I190 WeakPolarHBondContact O-CG1 3.23Å; Q186-I190 PolarHBondContact O-N 2.94Å; Q186-H295 PolarHBondContact NE2-CD2 3.35Å; Q186-H295 PolarHBondContact OE1-CD2 3.17Å
187	R	86.2	Confident	85.7	Confident	104 Å²	104	55.3 Å²	55.3	39%	0.392	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-47.1	175.4	-169.1	177.8	-64.4	108	1.5	111.3	E183 F185 I190 T191	E183-R187 WeakPolarHBondContact O-CB 3.45Å; E183-R187 PolarHBondContact O-N 3.27Å; E183-R187 IonicContact OE2-CZ 2.69Å; E183-R187 IonicContact OE2-NH2 3.96Å; E183-R187 PolarHBondContact OE2-NH2 3.2Å; F185-R187 PolarHBondContact O-N 3.31Å; R187-I190 PolarHBondContact O-N 2.76Å; R187-T191 PolarHBondContact O-N 3.1Å; R187-T191 PolarHBondContact O-OG1 3.44Å; R187-T191 VanDerWaalsContact O-OG1 3.05Å
188	L	90.4	Very high	86.9	Confident	14 Å²	14	58 Å²	58	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-47.7	176.6	-174.6	166.4	0	0	0	111.8	A166 C169 L170 V184 F185 I190 T191 A192 L268	A166-L188 HydrophobicContact CB-CD1 4.02Å; A166-L188 HydrophobicContact CB-CD2 3.84Å; A166-L188 HydrophobicContact CB-CG 3.65Å; C169-L188 HydrophobicContact CB-CD1 4.01Å; L170-L188 HydrophobicContact CD1-CD2 4.42Å; L170-L188 HydrophobicContact CD2-CD1 4.14Å; L170-L188 HydrophobicContact CG-CD1 4.02Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 PolarHBondContact O-N 3.44Å; F185-L188 PolarHBondContact O-N 3.44Å; L188-I190 PolarHBondContact O-N 3.49Å; L188-T191 PolarHBondContact O-N 3.38Å; L188-A192 PolarHBondContact O-N 2.6Å; L188-L268 HydrophobicContact CD2-CD2 3.59Å
189	V	91.6	Very high	88	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-42.2	177.5	166.2	0	0	0	0	111.4	F185 Q186 T191 A192 R193 L268 T299 A302 L303 I306	F185-V189 HydrophobicContact CD1-CG2 4.17Å; F185-V189 HydrophobicContact CD2-CG2 4.35Å; F185-V189 HydrophobicContact CE1-CG2 3.76Å; F185-V189 HydrophobicContact CE2-CG2 3.94Å; F185-V189 HydrophobicContact CG-CG2 4.46Å; F185-V189 HydrophobicContact CZ-CG2 3.63Å; F185-V189 WeakPolarHBondContact O-CB 3.44Å; F185-V189 WeakPolarHBondContact O-CG2 3.44Å; F185-V189 PolarHBondContact O-N 3.34Å; Q186-V189 PolarHBondContact O-N 3.09Å; V189-T191 PolarHBondContact O-N 3.11Å; V189-A192 PolarHBondContact O-N 2.67Å; V189-R193 WeakPolarHBondContact O-CB 3.48Å; V189-R193 PolarHBondContact O-N 3.12Å; V189-L268 HydrophobicContact CG2-CD2 4.01Å; V189-T299 HydrophobicContact CG1-CG2 4.41Å; V189-A302 HydrophobicContact CG1-CB 3.41Å; V189-A302 VanDerWaalsContact CG1-CB 3.41Å; V189-L303 HydrophobicContact CG1-CD2 4.49Å; V189-L303 HydrophobicContact CG1-CG 4.48Å; V189-L303 HydrophobicContact CG2-CD2 4.31Å; V189-I306 HydrophobicContact CG1-CD1 4.28Å
190	I	90.8	Very high	89	Confident	91 Å²	91	50.5 Å²	50.5	47%	0.467	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-40.1	175.3	-70.5	167.1	0	0	0	111.4	Q186 R187 L188 S194	Q186-I190 HydrophobicContact CG-CD1 3.86Å; Q186-I190 WeakPolarHBondContact O-CB 3.46Å; Q186-I190 VanDerWaalsContact O-CG1 3.24Å; Q186-I190 WeakPolarHBondContact O-CG1 3.23Å; Q186-I190 PolarHBondContact O-N 2.94Å; R187-I190 PolarHBondContact O-N 2.76Å; L188-I190 PolarHBondContact O-N 3.49Å; I190-S194 WeakPolarHBondContact O-CB 3.33Å; I190-S194 PolarHBondContact O-N 3.46Å
191	T	90.4	Very high	89.4	Confident	43 Å²	43	55 Å²	55	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-63.9	-49.3	175.1	-58.9	0	0	0	0	111.8	L162 R187 L188 V189 R193 S194 I195	L162-T191 HydrophobicContact CB-CG2 3.87Å; L162-T191 HydrophobicContact CD1-CG2 4.01Å; L162-T191 HydrophobicContact CD2-CG2 4.15Å; L162-T191 HydrophobicContact CG-CG2 4.23Å; R187-T191 PolarHBondContact O-N 3.1Å; R187-T191 PolarHBondContact O-OG1 3.44Å; R187-T191 VanDerWaalsContact O-OG1 3.05Å; L188-T191 PolarHBondContact O-N 3.38Å; V189-T191 PolarHBondContact O-N 3.11Å; T191-R193 VanDerWaalsContact C-N 3.33Å; T191-R193 PolarHBondContact O-N 2.77Å; T191-S194 WeakPolarHBondContact O-CB 3.43Å; T191-S194 PolarHBondContact O-N 2.57Å; T191-I195 HydrophobicContact CG2-CD1 4.44Å; T191-I195 PolarHBondContact O-N 3.35Å
192	A	93.1	Very high	89.7	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-42.2	177.7	0	0	0	0	0	111.6	L188 V189 S194 I195 A196 F264 I306	L188-A192 PolarHBondContact O-N 2.6Å; V189-A192 PolarHBondContact O-N 2.67Å; A192-S194 PolarHBondContact O-N 3.11Å; A192-I195 PolarHBondContact O-N 3.33Å; A192-A196 WeakPolarHBondContact O-CB 3.32Å; A192-A196 PolarHBondContact O-N 3.31Å; A192-F264 HydrophobicContact CB-CE1 4.32Å; A192-F264 HydrophobicContact CB-CZ 4.27Å; A192-I306 HydrophobicContact CB-CD1 3.69Å; A192-I306 HydrophobicContact CB-CG1 4.19Å
193	R	94.3	Very high	90.1	Very high	86 Å²	86	50.9 Å²	50.9	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-45	173.2	-174.8	-156.3	-173.7	-126.7	-9.8	112.6	V189 T191 I195 A196 I197 A302 D305 I306	V189-R193 WeakPolarHBondContact O-CB 3.48Å; V189-R193 PolarHBondContact O-N 3.12Å; T191-R193 VanDerWaalsContact C-N 3.33Å; T191-R193 PolarHBondContact O-N 2.77Å; R193-I195 VanDerWaalsContact C-N 3.26Å; R193-I195 PolarHBondContact O-N 3.28Å; R193-A196 PolarHBondContact O-N 3.09Å; R193-I197 HydrophobicContact CG-CD1 3.86Å; R193-I197 HydrophobicContact CG-CG1 4.5Å; R193-I197 WeakPolarHBondContact O-CG1 3.38Å; R193-I197 PolarHBondContact O-N 2.91Å; R193-A302 HydrophobicContact CB-CB 4.09Å; R193-A302 HydrophobicContact CG-CB 4.03Å; R193-D305 HydrophobicContact CG-CB 3.83Å; R193-D305 IonicContact CZ-OD2 3.42Å; R193-D305 IonicContact NE-OD2 2.68Å; R193-D305 PolarHBondContact NE-OD2 3.21Å; R193-D305 IonicContact NH2-OD2 2.71Å; R193-D305 PolarHBondContact NH2-OD2 3.44Å; R193-I306 HydrophobicContact CB-CD1 4.36Å; R193-I306 HydrophobicContact CB-CG1 4.19Å
194	S	92.9	Very high	90.2	Very high	70 Å²	70	45.5 Å²	45.5	49%	0.49	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-35.8	179.4	-174.8	0	0	0	0	112	I190 T191 A192 M198	I190-S194 WeakPolarHBondContact O-CB 3.33Å; I190-S194 PolarHBondContact O-N 3.46Å; T191-S194 WeakPolarHBondContact O-CB 3.43Å; T191-S194 PolarHBondContact O-N 2.57Å; A192-S194 PolarHBondContact O-N 3.11Å; S194-M198 VanDerWaalsContact O-CB 3.23Å; S194-M198 WeakPolarHBondContact O-CB 3.43Å; S194-M198 PolarHBondContact O-N 3.12Å
195	I	92.6	Very high	90.2	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-75.3	-43.4	175.1	-58.5	168.1	0	0	0	110.5	D159 L162 L163 T191 A192 R193 I197 M198 R199 N202 L203	D159-I195 HydrophobicContact CB-CD1 3.96Å; D159-I195 HydrophobicContact CB-CG1 4.31Å; D159-I195 HydrophobicContact CB-CG2 4.09Å; L162-I195 HydrophobicContact CB-CD1 4.19Å; L163-I195 HydrophobicContact CD1-CD1 4.12Å; L163-I195 HydrophobicContact CD1-CG2 4.2Å; L163-I195 HydrophobicContact CD2-CD1 4Å; L163-I195 HydrophobicContact CG-CD1 3.73Å; T191-I195 HydrophobicContact CG2-CD1 4.44Å; T191-I195 PolarHBondContact O-N 3.35Å; A192-I195 PolarHBondContact O-N 3.33Å; R193-I195 VanDerWaalsContact C-N 3.26Å; R193-I195 PolarHBondContact O-N 3.28Å; I195-I197 PolarHBondContact O-N 3.01Å; I195-M198 PolarHBondContact O-N 3.14Å; I195-R199 CarbonylContact O-C 3.23Å; I195-R199 VanDerWaalsContact O-C 3.23Å; I195-R199 WeakPolarHBondContact O-CA 3.24Å; I195-R199 PolarHBondContact O-N 3.39Å; I195-N202 HydrophobicContact CG2-CB 4.25Å; I195-L203 HydrophobicContact CG2-CB 4.36Å
196	A	91.9	Very high	90	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.033	25%	0.245	C	C	.	.	H	α-helix	trans	-55.3	-45.8	177.6	0	0	0	0	0	113.2	A192 R193 P200 L203 I306	A192-A196 WeakPolarHBondContact O-CB 3.32Å; A192-A196 PolarHBondContact O-N 3.31Å; R193-A196 PolarHBondContact O-N 3.09Å; A196-P200 WeakPolarHBondContact O-CB 3.28Å; A196-P200 WeakPolarHBondContact O-CD 3.45Å; A196-L203 HydrophobicContact CB-CD2 3.68Å; A196-I306 HydrophobicContact CB-CG1 4.24Å
197	I	90.6	Very high	89.7	Confident	93 Å²	93	47.4 Å²	47.4	48%	0.477	24%	0.236	S	C	.	.	H	α-helix	trans	-72.2	-35.2	-179.2	-66.1	171.3	0	0	0	111.7	R193 I195 D305	R193-I197 HydrophobicContact CG-CD1 3.86Å; R193-I197 HydrophobicContact CG-CG1 4.5Å; R193-I197 WeakPolarHBondContact O-CG1 3.38Å; R193-I197 PolarHBondContact O-N 2.91Å; I195-I197 PolarHBondContact O-N 3.01Å; I197-D305 HydrophobicContact CD1-CB 4.14Å; I197-D305 HydrophobicContact CG1-CB 4.19Å
198	M	90.3	Very high	88.9	Confident	120 Å²	120	44.8 Å²	44.8	59%	0.591	23%	0.228	S	C	*	.	H	α-helix	trans	-94.5	-36.3	-169	-160.8	69	63.2	0	0	113.6	S194 I195	S194-M198 VanDerWaalsContact O-CB 3.23Å; S194-M198 WeakPolarHBondContact O-CB 3.43Å; S194-M198 PolarHBondContact O-N 3.12Å; I195-M198 PolarHBondContact O-N 3.14Å
199	R	91.8	Very high	87.3	Confident	54 Å²	54	47.8 Å²	47.8	20%	0.204	25%	0.251	C	S	.	.			trans	-151.5	69.1	-175.3	-71.5	178.9	-63.7	-69.5	-11.4	110	D159 I195 N201 N202	D159-R199 VanDerWaalsContact CG-NH2 3.28Å; D159-R199 IonicContact OD1-CZ 3.21Å; D159-R199 IonicContact OD1-NE 2.71Å; D159-R199 IonicContact OD1-NH2 3.35Å; D159-R199 PolarHBondContact OD1-NH2 2.94Å; D159-R199 IonicContact OD2-CZ 3.66Å; D159-R199 IonicContact OD2-NE 3.79Å; D159-R199 PolarHBondContact OD2-NE 2.75Å; D159-R199 IonicContact OD2-NH2 3.12Å; D159-R199 PolarHBondContact OD2-NH2 2.88Å; I195-R199 CarbonylContact O-C 3.23Å; I195-R199 VanDerWaalsContact O-C 3.23Å; I195-R199 WeakPolarHBondContact O-CA 3.24Å; I195-R199 PolarHBondContact O-N 3.39Å; R199-N201 PolarHBondContact O-N 3.23Å; R199-N202 HydrophobicContact CB-CB 4.23Å; R199-N202 WeakPolarHBondContact O-CB 3.3Å; R199-N202 PolarHBondContact O-N 3.04Å
200	P	89	Confident	85.4	Confident	31 Å²	31	52.3 Å²	52.3	20%	0.201	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-29.8	-175.1	24.9	-34.5	0	0	0	113.3	A196 N202 L203 V204 C313	A196-P200 WeakPolarHBondContact O-CB 3.28Å; A196-P200 WeakPolarHBondContact O-CD 3.45Å; P200-N202 VanDerWaalsContact C-N 3.27Å; P200-N202 PolarHBondContact O-N 2.98Å; P200-L203 VanDerWaalsContact O-CB 3.28Å; P200-L203 WeakPolarHBondContact O-CB 3.2Å; P200-L203 PolarHBondContact O-N 3.38Å; P200-V204 PolarHBondContact O-N 2.88Å; P200-C313 VanDerWaalsContact CB-SG 3.6Å
201	N	89.1	Confident	83.4	Confident	113 Å²	113	49.4 Å²	49.4	60%	0.604	26%	0.256	S	S	*	.	H	α-helix	trans	-58.3	-36.9	173.5	-66.2	-32.8	0	0	0	112.8	R199 L203 H205 C313	R199-N201 PolarHBondContact O-N 3.23Å; N201-L203 VanDerWaalsContact C-N 3.34Å; N201-H205 VanDerWaalsContact O-CB 3.23Å; N201-H205 WeakPolarHBondContact O-CB 3.42Å; N201-H205 PolarHBondContact O-N 3.43Å; N201-H205 VanDerWaalsContact O-N 3.15Å; N201-C313 PolarHBondContact N-SG 3.34Å; N201-C313 VanDerWaalsContact N-SG 3.44Å; N201-C313 PolarHBondContact OD1-SG 3.49Å
202	N	89.9	Confident	80.9	Confident	32 Å²	32	52.3 Å²	52.3	17%	0.171	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-33.9	176.8	-72.3	3.6	0	0	0	111.7	D159 I195 R199 P200 F206	D159-N202 HydrophobicContact CB-CB 4.22Å; D159-N202 PolarHBondContact OD2-ND2 3.38Å; I195-N202 HydrophobicContact CG2-CB 4.25Å; R199-N202 HydrophobicContact CB-CB 4.23Å; R199-N202 WeakPolarHBondContact O-CB 3.3Å; R199-N202 PolarHBondContact O-N 3.04Å; P200-N202 VanDerWaalsContact C-N 3.27Å; P200-N202 PolarHBondContact O-N 2.98Å; N202-F206 HydrophobicContact CB-CD2 4.11Å; N202-F206 HydrophobicContact CB-CE2 4.1Å; N202-F206 WeakPolarHBondContact O-CB 3.45Å; N202-F206 WeakPolarHBondContact O-CD2 3.48Å; N202-F206 WeakPolarHBondContact O-CG 3.1Å; N202-F206 PolarHBondContact O-N 3.25Å; N202-F206 VanDerWaalsContact O-N 3.16Å
203	L	90.2	Very high	78.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-59.1	177.7	178.1	72.5	0	0	0	110.2	L163 I195 A196 P200 N201 H205 F206 T207 F264 I306 Y310	L163-L203 HydrophobicContact CD1-CD1 4.33Å; L163-L203 HydrophobicContact CD2-CD1 3.72Å; I195-L203 HydrophobicContact CG2-CB 4.36Å; A196-L203 HydrophobicContact CB-CD2 3.68Å; P200-L203 VanDerWaalsContact O-CB 3.28Å; P200-L203 WeakPolarHBondContact O-CB 3.2Å; P200-L203 PolarHBondContact O-N 3.38Å; N201-L203 VanDerWaalsContact C-N 3.34Å; L203-H205 PolarHBondContact O-N 3.32Å; L203-F206 PolarHBondContact O-N 3.4Å; L203-T207 WeakPolarHBondContact O-CG2 3.43Å; L203-T207 PolarHBondContact O-N 3.14Å; L203-T207 PolarHBondContact O-OG1 3Å; L203-F264 HydrophobicContact CD1-CE1 4.41Å; L203-I306 HydrophobicContact CD2-CG2 4.3Å; L203-Y310 HydrophobicContact CD1-CE2 4.28Å; L203-Y310 HydrophobicContact CD2-CD2 3.66Å; L203-Y310 HydrophobicContact CD2-CE2 3.37Å; L203-Y310 HydrophobicContact CG-CD2 4.36Å; L203-Y310 HydrophobicContact CG-CE2 3.66Å
204	V	86	Confident	75.3	Confident	8 Å²	8	64.2 Å²	64.2	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-60.3	-50.1	-177.6	-172.5	0	0	0	0	111.2	P200 F206 T207 E208 Y310 C313 E314	P200-V204 PolarHBondContact O-N 2.88Å; V204-F206 VanDerWaalsContact C-N 3.3Å; V204-F206 PolarHBondContact O-N 3.03Å; V204-T207 PolarHBondContact O-N 3.3Å; V204-E208 PolarHBondContact O-N 3.16Å; V204-Y310 HydrophobicContact CB-CD1 4.3Å; V204-Y310 HydrophobicContact CB-CE1 4.24Å; V204-Y310 HydrophobicContact CG1-CD1 4.23Å; V204-Y310 HydrophobicContact CG1-CE1 4.28Å; V204-Y310 HydrophobicContact CG2-CD1 3.59Å; V204-Y310 HydrophobicContact CG2-CE1 3.93Å; V204-Y310 HydrophobicContact CG2-CG 4.16Å; V204-C313 HydrophobicContact CG2-CB 3.59Å; V204-E314 VanDerWaalsContact CG1-CD 3.43Å; V204-E314 HydrophobicContact CG1-CG 4.15Å; V204-E314 WeakPolarHBondContact CG1-OE1 3.33Å
205	H	86.6	Confident	72.4	Confident	120 Å²	120	68.7 Å²	68.7	56%	0.556	35%	0.349	S	S	*	.	H	α-helix	trans	-59.9	-36.2	-176.7	179.1	-99.9	0	0	0	113.3	N201 L203 S209	N201-H205 VanDerWaalsContact O-CB 3.23Å; N201-H205 WeakPolarHBondContact O-CB 3.42Å; N201-H205 PolarHBondContact O-N 3.43Å; N201-H205 VanDerWaalsContact O-N 3.15Å; L203-H205 PolarHBondContact O-N 3.32Å; H205-S209 VanDerWaalsContact O-CB 3.28Å; H205-S209 WeakPolarHBondContact O-CB 3.46Å; H205-S209 PolarHBondContact O-OG 2.82Å
206	F	85.1	Confident	69.6	Low	6 Å²	6	72.8 Å²	72.8	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-95.2	-8.8	-176.2	-63.2	-48.5	0	0	0	115.5	S156 Q160 L163 N202 L203 V204	S156-F206 WeakPolarHBondContact O-CE2 3.41Å; S156-F206 WeakPolarHBondContact OG-CZ 3.49Å; Q160-F206 HydrophobicContact CB-CD1 3.93Å; Q160-F206 HydrophobicContact CB-CD2 3.77Å; Q160-F206 HydrophobicContact CB-CE1 3.86Å; Q160-F206 HydrophobicContact CB-CE2 3.73Å; Q160-F206 HydrophobicContact CB-CG 3.89Å; Q160-F206 HydrophobicContact CB-CZ 3.77Å; Q160-F206 HydrophobicContact CG-CD1 3.6Å; Q160-F206 HydrophobicContact CG-CD2 4.35Å; Q160-F206 HydrophobicContact CG-CE1 3.72Å; Q160-F206 HydrophobicContact CG-CE2 4.46Å; Q160-F206 HydrophobicContact CG-CG 3.94Å; Q160-F206 HydrophobicContact CG-CZ 4.17Å; L163-F206 HydrophobicContact CB-CB 4.34Å; L163-F206 HydrophobicContact CD1-CB 3.95Å; L163-F206 HydrophobicContact CD1-CD2 4.44Å; N202-F206 HydrophobicContact CB-CD2 4.11Å; N202-F206 HydrophobicContact CB-CE2 4.1Å; N202-F206 WeakPolarHBondContact O-CB 3.45Å; N202-F206 WeakPolarHBondContact O-CD2 3.48Å; N202-F206 WeakPolarHBondContact O-CG 3.1Å; N202-F206 PolarHBondContact O-N 3.25Å; N202-F206 VanDerWaalsContact O-N 3.16Å; L203-F206 PolarHBondContact O-N 3.4Å; V204-F206 VanDerWaalsContact C-N 3.3Å; V204-F206 PolarHBondContact O-N 3.03Å
207	T	80.9	Confident	66.5	Low	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-90.4	-56.5	171.1	63	0	0	0	0	111.9	L163 V167 L203 V204 S209 K210 L211 F264 Y310	L163-T207 HydrophobicContact CD2-CG2 4.44Å; V167-T207 HydrophobicContact CG2-CG2 4.26Å; L203-T207 WeakPolarHBondContact O-CG2 3.43Å; L203-T207 PolarHBondContact O-N 3.14Å; L203-T207 PolarHBondContact O-OG1 3Å; V204-T207 PolarHBondContact O-N 3.3Å; T207-S209 VanDerWaalsContact C-N 3.3Å; T207-S209 PolarHBondContact O-N 3.26Å; T207-K210 PolarHBondContact O-N 3.49Å; T207-L211 VanDerWaalsContact O-CD1 3.25Å; T207-L211 WeakPolarHBondContact O-CD1 3.23Å; T207-F264 HydrophobicContact CG2-CB 3.98Å; T207-F264 HydrophobicContact CG2-CD1 3.67Å; T207-F264 HydrophobicContact CG2-CD2 4.04Å; T207-F264 HydrophobicContact CG2-CE1 4.05Å; T207-F264 HydrophobicContact CG2-CE2 4.4Å; T207-F264 HydrophobicContact CG2-CG 3.64Å; T207-F264 HydrophobicContact CG2-CZ 4.39Å; T207-Y310 WeakPolarHBondContact CB-OH 3.15Å; T207-Y310 VanDerWaalsContact CG2-OH 3.31Å; T207-Y310 WeakPolarHBondContact CG2-OH 3.07Å; T207-Y310 PolarHBondContact OG1-OH 3.09Å
208	E	69.5	Low	63.8	Low	49 Å²	49	79.1 Å²	79.1	23%	0.229	42%	0.415	C	S	.	.	H	α-helix	trans	-73	-24.5	-170.3	-53.1	-43	109.4	0	0	112.3	V204 K210 S263	V204-E208 PolarHBondContact O-N 3.16Å; E208-K210 PolarHBondContact O-N 3.15Å; E208-K210 VanDerWaalsContact O-N 3.13Å; E208-S263 WeakPolarHBondContact OE2-CB 3.43Å; E208-S263 PolarHBondContact OE2-N 2.8Å; E208-S263 PolarHBondContact OE2-OG 2.88Å
209	S	57	Low	61	Low	78 Å²	78	81.6 Å²	81.6	55%	0.545	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-2.6	173.7	62.9	0	0	0	0	115.1	H205 T207	H205-S209 VanDerWaalsContact O-CB 3.28Å; H205-S209 WeakPolarHBondContact O-CB 3.46Å; H205-S209 PolarHBondContact O-OG 2.82Å; T207-S209 VanDerWaalsContact C-N 3.3Å; T207-S209 PolarHBondContact O-N 3.26Å
210	K	51.7	Low	58.3	Low	96 Å²	96	82.5 Å²	82.5	42%	0.417	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-1.1	-172.1	-67	-165.2	177.6	-166.3	0	116.1	S164 T207 E208	S164-K210 PolarHBondContact OG-NZ 3.22Å; T207-K210 PolarHBondContact O-N 3.49Å; E208-K210 PolarHBondContact O-N 3.15Å; E208-K210 VanDerWaalsContact O-N 3.13Å
211	L	48	Very low	55.6	Low	30 Å²	30	82.7 Å²	82.7	16%	0.157	43%	0.429	C	S	.	.			trans	-100.3	134.7	172.8	-77.6	90.9	0	0	0	111.2	V167 T207	V167-L211 HydrophobicContact CG1-CD1 3.75Å; V167-L211 HydrophobicContact CG1-CG 4.34Å; V167-L211 HydrophobicContact CG2-CD1 4.33Å; T207-L211 VanDerWaalsContact O-CD1 3.25Å; T207-L211 WeakPolarHBondContact O-CD1 3.23Å
212	P	38.6	Very low	53	Low	104 Å²	104	89.4 Å²	89.4	68%	0.675	45%	0.446	S	S	*	.			trans	-62.7	147.5	163.2	-16.3	30.1	0	0	0	110.2	M214	P212-M214 PolarHBondContact O-N 3Å
213	Q	35	Very low	50.4	Low	201 Å²	201	89.4 Å²	89.4	94%	0.939	45%	0.448	S	S	*	.			trans	-66.7	82.1	161.1	-72.8	-179.2	-25.8	0	0	109.4
214	M	35.3	Very low	47.6	Very low	135 Å²	135	93.6 Å²	93.6	67%	0.665	48%	0.483	S	S	*	.			trans	-79.5	123.9	158.4	-70.5	-167.8	66.9	0	0	107.5	P212 T216	P212-M214 PolarHBondContact O-N 3Å; M214-T216 PolarHBondContact O-N 2.93Å; M214-T216 PolarHBondContact O-OG1 3.42Å
215	E	31.2	Very low	45.3	Very low	165 Å²	165	96.8 Å²	96.8	77%	0.771	51%	0.505	S	S	*	.			trans	-59.3	90.8	166.2	-70.7	178.5	155.9	0	0	107.4	D217 K255	E215-D217 VanDerWaalsContact C-N 3.35Å; E215-D217 PolarHBondContact O-N 2.71Å; E215-K255 IonicContact OE1-NZ 2.93Å; E215-K255 PolarHBondContact OE1-NZ 3.49Å
216	T	33.3	Very low	43.2	Very low	89 Å²	89	94.3 Å²	94.3	55%	0.546	49%	0.49	S	S	.	.			trans	-91.3	80.9	-177.8	-54.7	0	0	0	0	106.1	M214 C218	M214-T216 PolarHBondContact O-N 2.93Å; M214-T216 PolarHBondContact O-OG1 3.42Å; T216-C218 PolarHBondContact O-N 2.68Å; T216-C218 VanDerWaalsContact O-N 3.12Å
217	D	28.3	Very low	40.8	Very low	137 Å²	137	98.7 Å²	98.7	73%	0.733	52%	0.522	S	S	*	.			trans	-37.4	124.2	164.7	-88	-34.8	0	0	0	108.2	E215 F219	E215-D217 VanDerWaalsContact C-N 3.35Å; E215-D217 PolarHBondContact O-N 2.71Å; D217-F219 WeakPolarHBondContact O-CB 3.3Å; D217-F219 PolarHBondContact O-N 2.78Å
218	C	32.9	Very low	38.8	Very low	93 Å²	93	106.3 Å²	106.3	63%	0.628	56%	0.562	S	S	*	*			trans	-62.6	82.6	-170.1	-78.9	0	0	0	0	111.2	T216 F220	T216-C218 PolarHBondContact O-N 2.68Å; T216-C218 VanDerWaalsContact O-N 3.12Å; C218-F220 HydrophobicContact CB-CD2 4.23Å; C218-F220 HydrophobicContact CB-CE2 3.79Å; C218-F220 WeakPolarHBondContact O-CD2 3.36Å; C218-F220 PolarHBondContact O-N 3.02Å
219	F	30.6	Very low	37.4	Very low	172 Å²	172	106.6 Å²	106.6	75%	0.754	58%	0.578	S	S	*	*			trans	-85.1	64.5	-166.1	-143.9	-84.8	0	0	0	110.4	D217 P221	D217-F219 WeakPolarHBondContact O-CB 3.3Å; D217-F219 PolarHBondContact O-N 2.78Å; F219-P221 VanDerWaalsContact O-CD 3.3Å; F219-P221 WeakPolarHBondContact O-CD 3.29Å; F219-P221 VanDerWaalsContact O-N 3.11Å
220	F	35.8	Very low	36.7	Very low	74 Å²	74	105.5 Å²	105.5	33%	0.325	57%	0.566	S	S	.	*			trans	-46.5	117.4	174	-69.3	-82.4	0	0	0	109.4	C218 R222 I235	C218-F220 HydrophobicContact CB-CD2 4.23Å; C218-F220 HydrophobicContact CB-CE2 3.79Å; C218-F220 WeakPolarHBondContact O-CD2 3.36Å; C218-F220 PolarHBondContact O-N 3.02Å; F220-R222 PolarHBondContact O-N 2.67Å; F220-R222 VanDerWaalsContact O-N 3.07Å; F220-I235 HydrophobicContact CD2-CD1 3.89Å; F220-I235 HydrophobicContact CE2-CD1 3.92Å; F220-I235 HydrophobicContact CE2-CG1 4.38Å
221	P	33.4	Very low	36	Very low	35 Å²	35	103.5 Å²	103.5	23%	0.227	56%	0.561	C	S	.	*			trans	-56.7	119.2	-178.7	-27.8	35	0	0	0	110.8	F219 C223 W226	F219-P221 VanDerWaalsContact O-CD 3.3Å; F219-P221 WeakPolarHBondContact O-CD 3.29Å; F219-P221 VanDerWaalsContact O-N 3.11Å; P221-C223 PolarHBondContact O-N 2.81Å; P221-W226 HydrophobicContact CB-CZ3 4.24Å; P221-W226 WeakPolarHBondContact O-CZ3 3.46Å
222	R	34.7	Very low	35.5	Very low	254 Å²	254	105 Å²	105	96%	0.958	58%	0.584	S	S	*	*			trans	-72.9	61.6	172.6	-70.5	177.3	109.9	178.2	4.6	110.5	F220	F220-R222 PolarHBondContact O-N 2.67Å; F220-R222 VanDerWaalsContact O-N 3.07Å
223	C	34.3	Very low	35.6	Very low	32 Å²	32	103.6 Å²	103.6	22%	0.216	57%	0.57	C	S	.	*			trans	-68.7	134.1	172.5	-172.1	0	0	0	0	109.7	P221 C225 W226	P221-C223 PolarHBondContact O-N 2.81Å; C223-C225 PolarHBondContact O-N 3.44Å; C223-C225 PolarHBondContact SG-SG 3.3Å; C223-W226 HydrophobicContact CB-CD2 4.28Å; C223-W226 HydrophobicContact CB-CE3 4.3Å; C223-W226 PolarHBondContact O-N 3.02Å
224	A	32	Very low	35.6	Very low	88 Å²	88	97.3 Å²	97.3	73%	0.727	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.5	-177.3	0	0	0	0	0	114.3
225	C	37.3	Very low	35.6	Very low	74 Å²	74	95.4 Å²	95.4	50%	0.5	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-15	169	70.6	0	0	0	0	113.6	C223	C223-C225 PolarHBondContact O-N 3.44Å; C223-C225 PolarHBondContact SG-SG 3.3Å
226	W	42.9	Very low	35.4	Very low	68 Å²	68	90.6 Å²	90.6	26%	0.258	53%	0.529	S	S	.	.	S	Bend	trans	-98.4	3	-179.6	-63.9	-14.9	0	0	0	113.8	P221 C223 L228 V231 W273	P221-W226 HydrophobicContact CB-CZ3 4.24Å; P221-W226 WeakPolarHBondContact O-CZ3 3.46Å; C223-W226 HydrophobicContact CB-CD2 4.28Å; C223-W226 HydrophobicContact CB-CE3 4.3Å; C223-W226 PolarHBondContact O-N 3.02Å; W226-L228 PolarHBondContact O-N 3.23Å; W226-L228 VanDerWaalsContact O-N 3.1Å; W226-V231 HydrophobicContact CB-CG2 4.35Å; W226-W273 HydrophobicContact CH2-CB 3.99Å; W226-W273 AromaticContact CH2-CD2 3.85Å; W226-W273 HydrophobicContact CH2-CD2 3.85Å; W226-W273 HydrophobicContact CH2-CE3 4.29Å; W226-W273 AromaticContact CH2-CG 3.73Å; W226-W273 HydrophobicContact CH2-CG 3.73Å; W226-W273 AromaticContact CZ2-CD2 3.79Å; W226-W273 HydrophobicContact CZ2-CD2 3.79Å; W226-W273 AromaticContact CZ2-CE3 3.77Å; W226-W273 HydrophobicContact CZ2-CE3 3.77Å; W226-W273 HydrophobicContact CZ2-CG 4.15Å; W226-W273 HydrophobicContact CZ2-CZ3 4.24Å
227	S	34.1	Very low	34.9	Very low	99 Å²	99	90.2 Å²	90.2	69%	0.692	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-6.4	173.2	-54.6	0	0	0	0	114
228	L	39.9	Very low	35	Very low	159 Å²	159	90 Å²	90	83%	0.832	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	84.3	175.3	-72.9	166.9	0	0	0	111.6	W226 I230	W226-L228 PolarHBondContact O-N 3.23Å; W226-L228 VanDerWaalsContact O-N 3.1Å; L228-I230 PolarHBondContact O-N 3.08Å
229	G	39.3	Very low	34.7	Very low	55 Å²	55	92.5 Å²	92.5	57%	0.567	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	-24.2	145.8	0	0	0	0	0	119.9	I233	G229-I233 WeakPolarHBondContact O-CD1 3.43Å
230	I	42.8	Very low	34.5	Very low	56 Å²	56	92.4 Å²	92.4	29%	0.287	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-41.7	-168.4	-69.5	175	0	0	0	114.4	L228 G232 I233 L234 V599	L228-I230 PolarHBondContact O-N 3.08Å; I230-G232 VanDerWaalsContact C-N 3.27Å; I230-G232 PolarHBondContact O-N 3.1Å; I230-I233 PolarHBondContact O-N 3.26Å; I230-I233 VanDerWaalsContact O-N 3.08Å; I230-L234 HydrophobicContact CG2-CD1 4.3Å; I230-V599 HydrophobicContact CD1-CG2 4.33Å
231	V	37.3	Very low	34.5	Very low	54 Å²	54	95.5 Å²	95.5	33%	0.327	57%	0.574	S	S	.	*	H	α-helix	trans	-64.2	-33.1	-174.7	-176	0	0	0	0	112.2	W226 I233 L234 I235	W226-V231 HydrophobicContact CB-CG2 4.35Å; V231-I233 PolarHBondContact O-N 3.07Å; V231-L234 PolarHBondContact O-N 3.07Å; V231-I235 PolarHBondContact O-N 3.15Å
232	G	35.4	Very low	34.2	Very low	61 Å²	61	99.7 Å²	99.7	63%	0.629	60%	0.601	S	S	*	*	H	α-helix	trans	-74.2	4.1	176.3	0	0	0	0	0	115.7	I230	I230-G232 VanDerWaalsContact C-N 3.27Å; I230-G232 PolarHBondContact O-N 3.1Å
233	I	40.7	Very low	33.6	Very low	74 Å²	74	92.9 Å²	92.9	38%	0.379	59%	0.593	S	S	.	*	H	α-helix	trans	-104.6	-30.8	172.1	-60.5	175.2	0	0	0	110.5	G229 I230 V231 Q595	G229-I233 WeakPolarHBondContact O-CD1 3.43Å; I230-I233 PolarHBondContact O-N 3.26Å; I230-I233 VanDerWaalsContact O-N 3.08Å; V231-I233 PolarHBondContact O-N 3.07Å; I233-Q595 HydrophobicContact CG2-CG 4.11Å
234	L	36.7	Very low	33.5	Very low	70 Å²	70	97 Å²	97	37%	0.366	62%	0.618	S	S	.	*	H	α-helix	trans	-84	-17.6	179.6	-79.9	160.3	0	0	0	113.9	I230 V231	I230-L234 HydrophobicContact CG2-CD1 4.3Å; V231-L234 PolarHBondContact O-N 3.07Å
235	I	34.6	Very low	33.2	Very low	95 Å²	95	102.6 Å²	102.6	49%	0.487	63%	0.63	S	S	.	*	S	Bend	trans	-122	121.6	167	-55.5	176.7	0	0	0	106.8	F220 V231	F220-I235 HydrophobicContact CD2-CD1 3.89Å; F220-I235 HydrophobicContact CE2-CD1 3.92Å; F220-I235 HydrophobicContact CE2-CG1 4.38Å; V231-I235 PolarHBondContact O-N 3.15Å
236	G	26.8	Very low	32.7	Very low	64 Å²	64	102.9 Å²	102.9	66%	0.66	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-59.2	138.2	-178.5	0	0	0	0	0	112.2
237	A	23.7	Very low	32.1	Very low	81 Å²	81	109 Å²	109	67%	0.669	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-62.2	129.7	179.5	0	0	0	0	0	111	L239	A237-L239 PolarHBondContact O-N 3.04Å
238	P	29.6	Very low	31.7	Very low	133 Å²	133	112.1 Å²	112.1	86%	0.864	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-65.1	116	170.8	-17.8	31	0	0	0	109.5
239	L	27.4	Very low	31.1	Very low	144 Å²	144	113.6 Å²	113.6	75%	0.754	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-80.6	128.8	171	-123.2	89.9	0	0	0	109.9	A237	A237-L239 PolarHBondContact O-N 3.04Å
240	E	26.6	Very low	30.7	Very low	170 Å²	170	114.6 Å²	114.6	79%	0.794	70%	0.702	S	S	*	*			trans	63.2	137.5	156.8	-60.4	-176.3	161.6	0	0	119.6
241	T	34.5	Very low	29.8	Very low	140 Å²	140	121.7 Å²	121.7	86%	0.859	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-88.8	128.6	175	49.1	0	0	0	0	111.5
242	P	27.3	Very low	29.1	Very low	123 Å²	123	128 Å²	128	80%	0.799	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-90.6	142.2	162.1	-2.5	21.9	0	0	0	111.7
243	S	23.1	Very low	28.6	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-73	149.4	162.5	-173.7	0	0	0	0	109.8	E245	S243-E245 PolarHBondContact O-N 3.37Å
244	P	31.5	Very low	27.8	Very low	117 Å²	117	136.5 Å²	136.5	76%	0.76	79%	0.789	S	S	*	*	S	Bend	trans	-76.7	123.5	179.7	29.9	-34.9	0	0	0	112.3
245	E	26.7	Very low	27.3	Very low	206 Å²	206	140.7 Å²	140.7	96%	0.963	80%	0.804	S	S	*	*			trans	-178.1	144.4	142.2	-106.3	170.7	-153.9	0	0	110.2	S243	S243-E245 PolarHBondContact O-N 3.37Å
246	G	26	Very low	26.8	Very low	81 Å²	81	144.1 Å²	144.1	84%	0.835	82%	0.818	S	S	*	*			trans	122	118	174.8	0	0	0	0	0	114.8
247	M	31	Very low	26.8	Very low	197 Å²	197	148.8 Å²	148.8	97%	0.97	83%	0.827	S	S	*	*			trans	-96.4	135.8	166.2	-75.5	160.4	59.4	0	0	109.6
248	D	24.4	Very low	27.4	Very low	164 Å²	164	151.4 Å²	151.4	88%	0.877	83%	0.825	S	S	*	*			trans	-151.2	153.4	147.4	-155.6	0.5	0	0	0	109.6
249	E	27.4	Very low	27.8	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	81%	0.813	S	S	*	*			trans	-104.9	155.9	-178.5	-68.9	-169.9	114.5	0	0	112
250	G	31.3	Very low	28.9	Very low	77 Å²	77	145.8 Å²	145.8	79%	0.794	80%	0.802	S	S	*	*			trans	105.4	73.8	157.8	0	0	0	0	0	117.2
251	K	23.6	Very low	30	Very low	205 Å²	205	140.4 Å²	140.4	89%	0.891	78%	0.783	S	S	*	*			trans	-152.7	127.8	142.3	-115.2	168.6	-172.6	174.3	0	110.6
252	E	22.4	Very low	31.6	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.864	74%	0.742	S	S	*	*			trans	-66.8	135.7	173.5	-62.7	-178.9	125.3	0	0	109.8	Q254	E252-Q254 PolarHBondContact O-N 2.96Å; E252-Q254 VanDerWaalsContact O-N 3.09Å
253	P	25.9	Very low	34.2	Very low	123 Å²	123	129.4 Å²	129.4	80%	0.799	71%	0.714	S	S	*	*			trans	-69.9	107.7	169.4	28.7	-31.8	0	0	0	108.3	K255	P253-K255 PolarHBondContact O-N 3.38Å
254	Q	24	Very low	37.3	Very low	192 Å²	192	124.1 Å²	124.1	90%	0.897	68%	0.677	S	S	*	*			trans	-63.8	94.4	178.2	-173.5	171.4	-3.4	0	0	109.4	E252 Q256	E252-Q254 PolarHBondContact O-N 2.96Å; E252-Q254 VanDerWaalsContact O-N 3.09Å; Q254-Q256 PolarHBondContact O-N 3.37Å; Q254-Q256 VanDerWaalsContact O-N 3.09Å
255	K	25.1	Very low	40	Very low	158 Å²	158	118.6 Å²	118.6	69%	0.687	64%	0.642	S	S	*	*			trans	-57.3	116.8	-171.5	-129.2	-172.6	-176.8	-164.1	0	109.6	E215 P253 L257	E215-K255 IonicContact OE1-NZ 2.93Å; E215-K255 PolarHBondContact OE1-NZ 3.49Å; P253-K255 PolarHBondContact O-N 3.38Å; K255-L257 HydrophobicContact CB-CD1 4.49Å; K255-L257 WeakPolarHBondContact O-CD1 3.37Å; K255-L257 PolarHBondContact O-N 3.5Å
256	Q	25.2	Very low	42.9	Very low	166 Å²	166	111 Å²	111	78%	0.776	61%	0.61	S	S	*	*			trans	-80.8	97.3	179.8	-169.8	169.1	-2.7	0	0	108.5	Q254 E258	Q254-Q256 PolarHBondContact O-N 3.37Å; Q254-Q256 VanDerWaalsContact O-N 3.09Å; Q256-E258 PolarHBondContact O-N 2.9Å
257	L	27	Very low	45.8	Very low	162 Å²	162	108.7 Å²	108.7	85%	0.848	58%	0.577	S	S	*	*			trans	-74.7	72.1	175.5	-78.6	90.1	0	0	0	111.1	K255	K255-L257 HydrophobicContact CB-CD1 4.49Å; K255-L257 WeakPolarHBondContact O-CD1 3.37Å; K255-L257 PolarHBondContact O-N 3.5Å
258	E	35.1	Very low	48.7	Very low	137 Å²	137	99.4 Å²	99.4	64%	0.64	53%	0.531	S	S	*	.			trans	-86.8	112.8	147.4	-69.1	-159.6	153.4	0	0	107.1	Q256	Q256-E258 PolarHBondContact O-N 2.9Å
259	G	37.4	Very low	51.9	Low	58 Å²	58	91.8 Å²	91.8	60%	0.598	49%	0.49	S	S	*	.			trans	-84.5	126.1	176.3	0	0	0	0	0	111.1	C261	G259-C261 PolarHBondContact O-N 2.88Å
260	D	50.4	Low	54.8	Low	101 Å²	101	85.3 Å²	85.3	54%	0.54	46%	0.462	S	S	.	.			trans	-73.9	66.2	176.5	-83.6	-47.2	0	0	0	112.5	C262	D260-C262 PolarHBondContact O-N 3.44Å
261	C	50.1	Low	57.4	Low	56 Å²	56	82 Å²	82	38%	0.378	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	33.7	177.2	-55.6	0	0	0	0	113.7	G259	G259-C261 PolarHBondContact O-N 2.88Å
262	C	68.8	Low	60.7	Low	2 Å²	2	72.2 Å²	72.2	1%	0.014	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.4	25.3	-172.3	-76.7	0	0	0	0	111.7	D260 F264 I265 T266 T320	D260-C262 PolarHBondContact O-N 3.44Å; C262-F264 VanDerWaalsContact C-N 3.3Å; C262-F264 PolarHBondContact O-N 3.43Å; C262-I265 HydrophobicContact CB-CB 4.36Å; C262-I265 HydrophobicContact CB-CD1 4.08Å; C262-I265 HydrophobicContact CB-CG1 4.41Å; C262-I265 WeakPolarHBondContact O-CB 3.11Å; C262-I265 PolarHBondContact O-N 2.69Å; C262-T266 PolarHBondContact O-N 2.98Å; C262-T266 PolarHBondContact O-OG1 2.87Å; C262-T320 HydrophobicContact CB-CG2 3.81Å
263	S	81.3	Confident	63.8	Low	30 Å²	30	63.9 Å²	63.9	21%	0.21	34%	0.344	C	S	.	.	H	α-helix	trans	-57.2	-42	-166.6	66.2	0	0	0	0	112.7	E208 Q267	E208-S263 WeakPolarHBondContact OE2-CB 3.43Å; E208-S263 PolarHBondContact OE2-N 2.8Å; E208-S263 PolarHBondContact OE2-OG 2.88Å; S263-Q267 WeakPolarHBondContact O-CG 3.36Å; S263-Q267 PolarHBondContact O-N 3.37Å; S263-Q267 VanDerWaalsContact O-N 3.16Å
264	F	87.8	Confident	66.7	Low	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-68.1	-39.6	175.5	178	-105.5	0	0	0	113.6	A166 V167 L170 A192 L203 T207 C262 T266 Q267 L268 Y310	A166-F264 HydrophobicContact CB-CE2 4.12Å; A166-F264 HydrophobicContact CB-CZ 4.25Å; V167-F264 HydrophobicContact CG2-CD2 3.66Å; V167-F264 HydrophobicContact CG2-CE2 3.89Å; L170-F264 HydrophobicContact CD1-CD2 3.85Å; L170-F264 HydrophobicContact CD1-CE2 3.56Å; L170-F264 HydrophobicContact CD1-CZ 4.42Å; A192-F264 HydrophobicContact CB-CE1 4.32Å; A192-F264 HydrophobicContact CB-CZ 4.27Å; L203-F264 HydrophobicContact CD1-CE1 4.41Å; T207-F264 HydrophobicContact CG2-CB 3.98Å; T207-F264 HydrophobicContact CG2-CD1 3.67Å; T207-F264 HydrophobicContact CG2-CD2 4.04Å; T207-F264 HydrophobicContact CG2-CE1 4.05Å; T207-F264 HydrophobicContact CG2-CE2 4.4Å; T207-F264 HydrophobicContact CG2-CG 3.64Å; T207-F264 HydrophobicContact CG2-CZ 4.39Å; C262-F264 VanDerWaalsContact C-N 3.3Å; C262-F264 PolarHBondContact O-N 3.43Å; F264-T266 PolarHBondContact O-N 3.01Å; F264-Q267 PolarHBondContact O-N 3.24Å; F264-L268 HydrophobicContact CD1-CD1 3.95Å; F264-L268 HydrophobicContact CD1-CG 4.45Å; F264-L268 HydrophobicContact CE1-CD1 3.48Å; F264-L268 VanDerWaalsContact CE1-CD1 3.48Å; F264-L268 HydrophobicContact CE1-CG 4.15Å; F264-L268 HydrophobicContact CZ-CD1 3.89Å; F264-L268 HydrophobicContact CZ-CD2 4.39Å; F264-L268 HydrophobicContact CZ-CG 4.19Å; F264-L268 PolarHBondContact O-N 2.68Å; F264-Y310 HydrophobicContact CD1-CE2 4.45Å; F264-Y310 VanDerWaalsContact CD1-OH 3.27Å; F264-Y310 WeakPolarHBondContact CD1-OH 3.47Å
265	I	89.4	Confident	69.6	Low	2 Å²	2	53 Å²	53	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-48	177.2	-52.6	-179.4	0	0	0	110	C262 Q267 L268 V269 I307 Y310 I324	C262-I265 HydrophobicContact CB-CB 4.36Å; C262-I265 HydrophobicContact CB-CD1 4.08Å; C262-I265 HydrophobicContact CB-CG1 4.41Å; C262-I265 WeakPolarHBondContact O-CB 3.11Å; C262-I265 PolarHBondContact O-N 2.69Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.04Å; I265-L268 WeakPolarHBondContact O-CB 3.44Å; I265-L268 PolarHBondContact O-N 3.02Å; I265-L268 VanDerWaalsContact O-N 3.13Å; I265-V269 HydrophobicContact CG2-CG2 4.3Å; I265-V269 WeakPolarHBondContact O-CG2 3.3Å; I265-V269 PolarHBondContact O-N 3.18Å; I265-I307 HydrophobicContact CG2-CD1 4.29Å; I265-I307 HydrophobicContact CG2-CG1 3.66Å; I265-Y310 HydrophobicContact CD1-CD1 4.05Å; I265-Y310 HydrophobicContact CD1-CD2 3.47Å; I265-Y310 VanDerWaalsContact CD1-CD2 3.47Å; I265-Y310 HydrophobicContact CD1-CE1 4.47Å; I265-Y310 HydrophobicContact CD1-CE2 3.94Å; I265-Y310 HydrophobicContact CD1-CG 3.56Å; I265-Y310 HydrophobicContact CG1-CD1 4.49Å; I265-Y310 HydrophobicContact CG1-CD2 3.72Å; I265-Y310 HydrophobicContact CG1-CE1 4.43Å; I265-Y310 HydrophobicContact CG1-CE2 3.63Å; I265-Y310 HydrophobicContact CG1-CG 4.18Å; I265-I324 HydrophobicContact CG2-CD1 3.67Å
266	T	87.1	Confident	72.5	Confident	47 Å²	47	47.1 Å²	47.1	29%	0.288	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-39.5	179.4	-60.7	0	0	0	0	111.1	C262 F264 N270	C262-T266 PolarHBondContact O-N 2.98Å; C262-T266 PolarHBondContact O-OG1 2.87Å; F264-T266 PolarHBondContact O-N 3.01Å; T266-N270 VanDerWaalsContact O-CB 3.27Å; T266-N270 WeakPolarHBondContact O-CB 3.42Å; T266-N270 PolarHBondContact O-N 3.33Å; T266-N270 PolarHBondContact O-ND2 2.79Å
267	Q	87.6	Confident	75.3	Confident	32 Å²	32	41.7 Å²	41.7	15%	0.15	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-42.4	172.5	-71.5	-167.3	11.3	0	0	113	L170 N171 S263 F264 I265 H271	L170-Q267 HydrophobicContact CB-CB 4.44Å; L170-Q267 VanDerWaalsContact CB-OE1 3.26Å; L170-Q267 HydrophobicContact CD1-CB 4.21Å; N171-Q267 PolarHBondContact OD1-NE2 3.07Å; S263-Q267 WeakPolarHBondContact O-CG 3.36Å; S263-Q267 PolarHBondContact O-N 3.37Å; S263-Q267 VanDerWaalsContact O-N 3.16Å; F264-Q267 PolarHBondContact O-N 3.24Å; I265-Q267 VanDerWaalsContact C-N 3.31Å; I265-Q267 PolarHBondContact O-N 3.04Å; Q267-H271 PolarHBondContact O-N 3.13Å; Q267-H271 VanDerWaalsContact O-N 3.14Å; Q267-H271 PolarHBondContact O-ND1 3.45Å
268	L	91.1	Very high	77.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-49.7	176.5	-76.5	178	0	0	0	112.1	L170 F185 L188 V189 F264 I265 N270 H271 F272 L303 I306	L170-L268 HydrophobicContact CD1-CD2 3.75Å; L170-L268 HydrophobicContact CD1-CG 4.09Å; L170-L268 HydrophobicContact CD2-CD2 4.28Å; F185-L268 HydrophobicContact CE2-CD2 4.06Å; F185-L268 WeakPolarHBondContact CZ-O 3.44Å; L188-L268 HydrophobicContact CD2-CD2 3.59Å; V189-L268 HydrophobicContact CG2-CD2 4.01Å; F264-L268 HydrophobicContact CD1-CD1 3.95Å; F264-L268 HydrophobicContact CD1-CG 4.45Å; F264-L268 HydrophobicContact CE1-CD1 3.48Å; F264-L268 VanDerWaalsContact CE1-CD1 3.48Å; F264-L268 HydrophobicContact CE1-CG 4.15Å; F264-L268 HydrophobicContact CZ-CD1 3.89Å; F264-L268 HydrophobicContact CZ-CD2 4.39Å; F264-L268 HydrophobicContact CZ-CG 4.19Å; F264-L268 PolarHBondContact O-N 2.68Å; I265-L268 WeakPolarHBondContact O-CB 3.44Å; I265-L268 PolarHBondContact O-N 3.02Å; I265-L268 VanDerWaalsContact O-N 3.13Å; L268-N270 VanDerWaalsContact C-N 3.35Å; L268-N270 PolarHBondContact O-N 2.85Å; L268-H271 PolarHBondContact O-N 2.94Å; L268-F272 PolarHBondContact O-N 2.77Å; L268-L303 HydrophobicContact CB-CD2 3.93Å; L268-L303 HydrophobicContact CD1-CD2 4.3Å; L268-I306 HydrophobicContact CD1-CD1 4.07Å; L268-I306 HydrophobicContact CD1-CG2 4.18Å
269	V	91.1	Very high	79.4	Confident	4 Å²	4	34 Å²	34	2%	0.024	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-37.8	-177.7	173.6	0	0	0	0	111.4	I265 F272 W273 I324 M328	I265-V269 HydrophobicContact CG2-CG2 4.3Å; I265-V269 WeakPolarHBondContact O-CG2 3.3Å; I265-V269 PolarHBondContact O-N 3.18Å; V269-F272 WeakPolarHBondContact O-CB 3.46Å; V269-F272 PolarHBondContact O-N 3.38Å; V269-W273 PolarHBondContact O-N 3.35Å; V269-I324 HydrophobicContact CG1-CG2 4.18Å; V269-I324 HydrophobicContact CG2-CD1 4.17Å; V269-I324 HydrophobicContact CG2-CG1 4.46Å; V269-I324 HydrophobicContact CG2-CG2 3.85Å; V269-M328 HydrophobicContact CG1-CE 4.38Å; V269-M328 HydrophobicContact CG2-CE 4.22Å
270	N	88.3	Confident	80.8	Confident	53 Å²	53	33.2 Å²	33.2	28%	0.283	19%	0.188	S	C	.	.	H	α-helix	trans	-65.1	-38.8	174.6	-76.1	-22.4	0	0	0	112.8	T266 L268 K274	T266-N270 VanDerWaalsContact O-CB 3.27Å; T266-N270 WeakPolarHBondContact O-CB 3.42Å; T266-N270 PolarHBondContact O-N 3.33Å; T266-N270 PolarHBondContact O-ND2 2.79Å; L268-N270 VanDerWaalsContact C-N 3.35Å; L268-N270 PolarHBondContact O-N 2.85Å; N270-K274 WeakPolarHBondContact O-CG 3.48Å; N270-K274 PolarHBondContact O-N 3.01Å; N270-K274 VanDerWaalsContact O-N 3.14Å
271	H	87.8	Confident	81.2	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.032	21%	0.206	C	C	.	.	H	α-helix	trans	-70.4	-38.6	174	-75.6	90.6	0	0	0	112.1	S173 F185 Q267 L268 W273 K274 L275	S173-H271 PolarHBondContact OG-NE2 3.44Å; F185-H271 HydrophobicContact CD2-CB 3.94Å; F185-H271 HydrophobicContact CE2-CB 3.53Å; F185-H271 HydrophobicContact CZ-CB 4.19Å; Q267-H271 PolarHBondContact O-N 3.13Å; Q267-H271 VanDerWaalsContact O-N 3.14Å; Q267-H271 PolarHBondContact O-ND1 3.45Å; L268-H271 PolarHBondContact O-N 2.94Å; H271-W273 PolarHBondContact O-N 3.06Å; H271-K274 PolarHBondContact O-N 3.21Å; H271-L275 WeakPolarHBondContact O-CG 3.27Å; H271-L275 PolarHBondContact O-N 3.18Å
272	F	91	Very high	81.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-55.8	-49.8	171.9	166.7	-97.8	0	0	0	111.8	F185 L268 V269 K274 L275 H276 L293 T299 V300 L303 M328 V336	F185-F272 HydrophobicContact CE1-CB 4.03Å; F185-F272 HydrophobicContact CZ-CB 3.9Å; L268-F272 PolarHBondContact O-N 2.77Å; V269-F272 WeakPolarHBondContact O-CB 3.46Å; V269-F272 PolarHBondContact O-N 3.38Å; F272-K274 PolarHBondContact O-N 2.84Å; F272-L275 PolarHBondContact O-N 3.04Å; F272-H276 WeakPolarHBondContact O-CB 3.47Å; F272-H276 PolarHBondContact O-N 3.39Å; F272-L293 HydrophobicContact CD2-CD1 3.47Å; F272-L293 VanDerWaalsContact CD2-CD1 3.47Å; F272-L293 HydrophobicContact CE2-CD1 3.72Å; F272-L293 HydrophobicContact CG-CD1 4.39Å; F272-T299 HydrophobicContact CD2-CG2 3.83Å; F272-T299 HydrophobicContact CE2-CG2 4.28Å; F272-V300 HydrophobicContact CE1-CG2 4.48Å; F272-V300 HydrophobicContact CE2-CG2 3.64Å; F272-V300 HydrophobicContact CZ-CG2 3.48Å; F272-V300 VanDerWaalsContact CZ-CG2 3.48Å; F272-L303 HydrophobicContact CB-CD1 3.77Å; F272-L303 HydrophobicContact CD1-CD1 4.24Å; F272-L303 HydrophobicContact CD2-CD1 3.71Å; F272-L303 HydrophobicContact CE2-CD1 4.4Å; F272-L303 HydrophobicContact CG-CD1 3.63Å; F272-M328 HydrophobicContact CD1-CE 4.27Å; F272-M328 HydrophobicContact CE1-CE 4.31Å; F272-V336 HydrophobicContact CE1-CG1 4.42Å; F272-V336 HydrophobicContact CZ-CG1 4.21Å; F272-V336 HydrophobicContact CZ-CG2 4.12Å
273	W	89.3	Confident	80.8	Confident	11 Å²	11	42.2 Å²	42.2	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-66.2	-34.9	179.8	-71.5	129.2	0	0	0	113.3	W226 V269 H271 H276 A277 Q327 M328 C331 V336	W226-W273 HydrophobicContact CH2-CB 3.99Å; W226-W273 AromaticContact CH2-CD2 3.85Å; W226-W273 HydrophobicContact CH2-CD2 3.85Å; W226-W273 HydrophobicContact CH2-CE3 4.29Å; W226-W273 AromaticContact CH2-CG 3.73Å; W226-W273 HydrophobicContact CH2-CG 3.73Å; W226-W273 AromaticContact CZ2-CD2 3.79Å; W226-W273 HydrophobicContact CZ2-CD2 3.79Å; W226-W273 AromaticContact CZ2-CE3 3.77Å; W226-W273 HydrophobicContact CZ2-CE3 3.77Å; W226-W273 HydrophobicContact CZ2-CG 4.15Å; W226-W273 HydrophobicContact CZ2-CZ3 4.24Å; V269-W273 PolarHBondContact O-N 3.35Å; H271-W273 PolarHBondContact O-N 3.06Å; W273-H276 HydrophobicContact CE3-CB 4.45Å; W273-H276 PolarHBondContact O-N 3.24Å; W273-A277 VanDerWaalsContact O-CB 3.25Å; W273-A277 WeakPolarHBondContact O-CB 3.47Å; W273-A277 PolarHBondContact O-N 3.38Å; W273-Q327 HydrophobicContact CZ2-CB 4.12Å; W273-M328 HydrophobicContact CH2-CG 4.45Å; W273-M328 HydrophobicContact CZ2-CG 4.01Å; W273-C331 HydrophobicContact CH2-CB 4.25Å; W273-V336 HydrophobicContact CH2-CG1 3.94Å; W273-V336 HydrophobicContact CZ3-CG1 4.33Å
274	K	85.6	Confident	79.4	Confident	79 Å²	79	48.9 Å²	48.9	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-60.3	-49.2	171.2	-74.6	177	178.6	-173.6	0	111.8	N270 H271 F272 H276 A277 S278	N270-K274 WeakPolarHBondContact O-CG 3.48Å; N270-K274 PolarHBondContact O-N 3.01Å; N270-K274 VanDerWaalsContact O-N 3.14Å; H271-K274 PolarHBondContact O-N 3.21Å; F272-K274 PolarHBondContact O-N 2.84Å; K274-H276 VanDerWaalsContact C-N 3.31Å; K274-H276 PolarHBondContact O-N 3.02Å; K274-A277 PolarHBondContact O-N 3.41Å; K274-S278 PolarHBondContact O-N 3.1Å; K274-S278 VanDerWaalsContact O-N 3.14Å
275	L	85.5	Confident	77.6	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-77.2	-14.8	-177.7	-60.9	176.2	0	0	0	113.8	L180 P182 F185 H271 F272 S278 G292 L293	L180-L275 WeakPolarHBondContact O-CD2 3.06Å; P182-L275 HydrophobicContact CG-CD2 4.39Å; F185-L275 HydrophobicContact CB-CD1 3.68Å; F185-L275 HydrophobicContact CD1-CD1 3.9Å; F185-L275 HydrophobicContact CD2-CD1 4.41Å; F185-L275 HydrophobicContact CG-CD1 3.73Å; H271-L275 WeakPolarHBondContact O-CG 3.27Å; H271-L275 PolarHBondContact O-N 3.18Å; F272-L275 PolarHBondContact O-N 3.04Å; L275-S278 PolarHBondContact O-OG 3.14Å; L275-G292 CarbonylContact O-C 3.56Å; L275-G292 WeakPolarHBondContact O-CA 3.4Å; L275-L293 HydrophobicContact CB-CD1 4.06Å; L275-L293 HydrophobicContact CB-CG 3.84Å; L275-L293 PolarHBondContact O-N 3.25Å
276	H	86.2	Confident	75.5	Confident	35 Å²	35	56.7 Å²	56.7	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-78.7	-44	165.8	-174.6	-101.6	0	0	0	110.9	F272 W273 K274 S278 K279 L293 D333	F272-H276 WeakPolarHBondContact O-CB 3.47Å; F272-H276 PolarHBondContact O-N 3.39Å; W273-H276 HydrophobicContact CE3-CB 4.45Å; W273-H276 PolarHBondContact O-N 3.24Å; K274-H276 VanDerWaalsContact C-N 3.31Å; K274-H276 PolarHBondContact O-N 3.02Å; H276-S278 VanDerWaalsContact C-N 3.31Å; H276-S278 PolarHBondContact O-N 3.28Å; H276-K279 VanDerWaalsContact O-CB 3.3Å; H276-K279 WeakPolarHBondContact O-CB 3.45Å; H276-K279 PolarHBondContact O-N 3.23Å; H276-L293 HydrophobicContact CB-CD1 4.49Å; H276-D333 IonicContact CD2-OD2 3.2Å; H276-D333 IonicContact CE1-OD2 3.67Å; H276-D333 IonicContact NE2-OD2 2.7Å; H276-D333 PolarHBondContact NE2-OD2 2.88Å
277	A	83.3	Confident	73.8	Confident	52 Å²	52	58.6 Å²	58.6	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-68.1	-22.6	-179.4	0	0	0	0	0	114.7	W273 K274 K279	W273-A277 VanDerWaalsContact O-CB 3.25Å; W273-A277 WeakPolarHBondContact O-CB 3.47Å; W273-A277 PolarHBondContact O-N 3.38Å; K274-A277 PolarHBondContact O-N 3.41Å; A277-K279 VanDerWaalsContact C-N 3.29Å
278	S	78.3	Confident	71.8	Confident	49 Å²	49	62.7 Å²	62.7	34%	0.343	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-8.6	175.6	58.4	0	0	0	0	114.4	K274 L275 H276 G292	K274-S278 PolarHBondContact O-N 3.1Å; K274-S278 VanDerWaalsContact O-N 3.14Å; L275-S278 PolarHBondContact O-OG 3.14Å; H276-S278 VanDerWaalsContact C-N 3.31Å; H276-S278 PolarHBondContact O-N 3.28Å; S278-G292 VanDerWaalsContact OG-CA 3.31Å; S278-G292 WeakPolarHBondContact OG-CA 3.04Å
279	K	70.8	Confident	69.9	Low	89 Å²	89	67.5 Å²	67.5	39%	0.387	39%	0.386	S	S	.	.	S	Bend	trans	-68.4	132.7	178.2	-172.3	175.8	178.4	177.2	0	111.4	H276 A277 K281 P291 I296	H276-K279 VanDerWaalsContact O-CB 3.3Å; H276-K279 WeakPolarHBondContact O-CB 3.45Å; H276-K279 PolarHBondContact O-N 3.23Å; A277-K279 VanDerWaalsContact C-N 3.29Å; K279-K281 PolarHBondContact O-N 2.91Å; K279-P291 WeakPolarHBondContact CA-O 3.44Å; K279-I296 HydrophobicContact CD-CD1 4.07Å
280	P	65.5	Low	68.2	Low	42 Å²	42	72.1 Å²	72.1	27%	0.273	41%	0.41	S	S	.	.			trans	-67.8	135.4	179.2	27	-33.3	0	0	0	111.2	N282 A286	P280-N282 PolarHBondContact O-N 3.04Å; P280-N282 VanDerWaalsContact O-N 3.08Å; P280-A286 HydrophobicContact CG-CB 3.94Å
281	K	59.7	Low	66.8	Low	211 Å²	211	72.6 Å²	72.6	92%	0.917	42%	0.417	S	S	*	.	S	Bend	trans	-60.6	-19.2	-179	-67.5	-173.5	179.5	-178.1	0	114.5	K279	K279-K281 PolarHBondContact O-N 2.91Å
282	N	57.8	Low	65.8	Low	72 Å²	72	72.6 Å²	72.6	39%	0.385	42%	0.418	S	S	.	.			trans	-124.6	105.9	173.5	-173.9	-10.1	0	0	0	109	P280 F284 L285	P280-N282 PolarHBondContact O-N 3.04Å; P280-N282 VanDerWaalsContact O-N 3.08Å; N282-F284 PolarHBondContact O-N 3.46Å; N282-F284 WeakPolarHBondContact OD1-CB 3.17Å; N282-F284 WeakPolarHBondContact OD1-CD2 3.3Å; N282-F284 PolarHBondContact OD1-N 3.14Å; N282-F284 VanDerWaalsContact OD1-N 3.07Å; N282-L285 HydrophobicContact CB-CB 4.42Å; N282-L285 HydrophobicContact CB-CD1 4.13Å; N282-L285 HydrophobicContact CB-CG 4.28Å; N282-L285 WeakPolarHBondContact ND2-CD1 3.46Å; N282-L285 PolarHBondContact O-N 3.02Å; N282-L285 VanDerWaalsContact O-N 3.15Å
283	A	53.4	Low	65	Low	65 Å²	65	72.9 Å²	72.9	54%	0.537	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-63.6	-27.5	-179.2	0	0	0	0	0	112.9	L285 A286	A283-L285 PolarHBondContact O-N 2.61Å; A283-A286 PolarHBondContact O-N 2.86Å
284	F	51.6	Low	64.4	Low	169 Å²	169	76.2 Å²	76.2	74%	0.741	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-74	-5.9	177.4	-58.3	-79.7	0	0	0	113.8	N282 T738	N282-F284 PolarHBondContact O-N 3.46Å; N282-F284 WeakPolarHBondContact OD1-CB 3.17Å; N282-F284 WeakPolarHBondContact OD1-CD2 3.3Å; N282-F284 PolarHBondContact OD1-N 3.14Å; N282-F284 VanDerWaalsContact OD1-N 3.07Å; F284-T738 HydrophobicContact CZ-CG2 4.46Å
285	L	49.2	Very low	64.4	Low	138 Å²	138	77.7 Å²	77.7	72%	0.723	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-112.6	10	176.3	-61.8	178.5	0	0	0	112.8	N282 A283	N282-L285 HydrophobicContact CB-CB 4.42Å; N282-L285 HydrophobicContact CB-CD1 4.13Å; N282-L285 HydrophobicContact CB-CG 4.28Å; N282-L285 WeakPolarHBondContact ND2-CD1 3.46Å; N282-L285 PolarHBondContact O-N 3.02Å; N282-L285 VanDerWaalsContact O-N 3.15Å; A283-L285 PolarHBondContact O-N 2.61Å
286	A	46	Very low	64.5	Low	29 Å²	29	77.8 Å²	77.8	24%	0.24	45%	0.45	C	S	.	.			trans	-77.6	137.9	177.1	0	0	0	0	0	111.5	P280 A283 L290	P280-A286 HydrophobicContact CG-CB 3.94Å; A283-A286 PolarHBondContact O-N 2.86Å; A286-L290 HydrophobicContact CB-CD2 3.46Å; A286-L290 VanDerWaalsContact CB-CD2 3.46Å; A286-L290 HydrophobicContact CB-CG 4.38Å
287	P	50.3	Low	64.6	Low	87 Å²	87	81.4 Å²	81.4	57%	0.565	47%	0.467	S	S	*	.			trans	-69.5	170.7	169	31.7	-35.2	0	0	0	111.3	C289	P287-C289 CarbonylContact O-C 3.6Å; P287-C289 PolarHBondContact O-N 3.27Å
288	A	45.6	Very low	65	Low	117 Å²	117	81.6 Å²	81.6	97%	0.967	47%	0.468	S	S	*	.	S	Bend	trans	-56	-19.8	-174.2	0	0	0	0	0	115.3
289	C	52.7	Low	65.7	Low	102 Å²	102	79.3 Å²	79.3	69%	0.689	45%	0.453	S	S	*	.	S	Bend	trans	-102.4	104.9	164.8	47.5	0	0	0	0	110.1	P287 P291	P287-C289 CarbonylContact O-C 3.6Å; P287-C289 PolarHBondContact O-N 3.27Å; C289-P291 VanDerWaalsContact O-CD 3.28Å; C289-P291 WeakPolarHBondContact O-CD 3.26Å
290	L	54.5	Low	66.8	Low	101 Å²	101	75.1 Å²	75.1	53%	0.529	43%	0.434	S	S	.	.			trans	-69	117	173.9	-80.7	159.6	0	0	0	110.3	A286	A286-L290 HydrophobicContact CB-CD2 3.46Å; A286-L290 VanDerWaalsContact CB-CD2 3.46Å; A286-L290 HydrophobicContact CB-CG 4.38Å
291	P	58	Low	68.2	Low	64 Å²	64	74.8 Å²	74.8	42%	0.416	43%	0.43	S	S	.	.			trans	-76.9	136.1	171.6	30.9	-30.5	0	0	0	110.2	K279 C289	K279-P291 WeakPolarHBondContact CA-O 3.44Å; C289-P291 VanDerWaalsContact O-CD 3.28Å; C289-P291 WeakPolarHBondContact O-CD 3.26Å
292	G	66.8	Low	69.9	Low	6 Å²	6	64.8 Å²	64.8	6%	0.062	39%	0.387	C	S	.	.	S	Bend	trans	100.7	-167.7	178.4	0	0	0	0	0	114.7	P182 L275 S278 T294	P182-G292 WeakPolarHBondContact CG-O 3.45Å; L275-G292 CarbonylContact O-C 3.56Å; L275-G292 WeakPolarHBondContact O-CA 3.4Å; S278-G292 VanDerWaalsContact OG-CA 3.31Å; S278-G292 WeakPolarHBondContact OG-CA 3.04Å; G292-T294 PolarHBondContact O-N 3.28Å
293	L	76	Confident	71.7	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.031	37%	0.369	C	S	.	.			trans	-71.5	121.2	-175.9	-79.1	162	0	0	0	113.1	F185 F272 L275 H276 I296 T299	F185-L293 HydrophobicContact CD1-CD2 4.1Å; F272-L293 HydrophobicContact CD2-CD1 3.47Å; F272-L293 VanDerWaalsContact CD2-CD1 3.47Å; F272-L293 HydrophobicContact CE2-CD1 3.72Å; F272-L293 HydrophobicContact CG-CD1 4.39Å; L275-L293 HydrophobicContact CB-CD1 4.06Å; L275-L293 HydrophobicContact CB-CG 3.84Å; L275-L293 PolarHBondContact O-N 3.25Å; H276-L293 HydrophobicContact CB-CD1 4.49Å; L293-I296 HydrophobicContact CB-CG1 3.95Å; L293-T299 HydrophobicContact CD2-CG2 4.17Å
294	T	76.7	Confident	73.8	Confident	82 Å²	82	58.4 Å²	58.4	50%	0.503	34%	0.344	S	S	.	.	S	Bend	trans	-73.8	-58.6	171.8	49.5	0	0	0	0	111.2	G292 I296	G292-T294 PolarHBondContact O-N 3.28Å; T294-I296 PolarHBondContact O-N 3.41Å
295	H	83.9	Confident	75.8	Confident	109 Å²	109	50.6 Å²	50.6	51%	0.505	31%	0.31	S	S	.	.			trans	-98.9	67.5	-176.4	-59.1	-82.6	0	0	0	112.3	Q186 E297 A298 T299	Q186-H295 PolarHBondContact NE2-CD2 3.35Å; Q186-H295 PolarHBondContact OE1-CD2 3.17Å; H295-E297 PolarHBondContact O-N 3.43Å; H295-A298 HydrophobicContact CB-CB 4.13Å; H295-A298 PolarHBondContact O-N 3.35Å; H295-T299 WeakPolarHBondContact O-CB 3.23Å; H295-T299 PolarHBondContact O-N 3.47Å; H295-T299 PolarHBondContact O-OG1 3.15Å
296	I	87.5	Confident	78	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-53.1	-53.6	-179.5	-61.2	173.5	0	0	0	111.1	K279 L293 T294 A298 T299 V300 A335 V336	K279-I296 HydrophobicContact CD-CD1 4.07Å; L293-I296 HydrophobicContact CB-CG1 3.95Å; T294-I296 PolarHBondContact O-N 3.41Å; I296-A298 PolarHBondContact O-N 2.71Å; I296-T299 WeakPolarHBondContact O-CB 3.33Å; I296-T299 PolarHBondContact O-N 3.01Å; I296-T299 VanDerWaalsContact O-N 3.12Å; I296-V300 HydrophobicContact CG2-CG2 4.26Å; I296-V300 WeakPolarHBondContact O-CG2 3.27Å; I296-V300 PolarHBondContact O-N 2.69Å; I296-A335 HydrophobicContact CG2-CB 4.38Å; I296-V336 HydrophobicContact CG2-CG2 3.72Å
297	E	90.2	Very high	80.3	Confident	111 Å²	111	42.8 Å²	42.8	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-39.8	-174	-57	-155.9	-149.2	0	0	113.7	H295 N301 A335 S339	H295-E297 PolarHBondContact O-N 3.43Å; E297-N301 WeakPolarHBondContact O-CB 3.47Å; E297-N301 PolarHBondContact O-N 2.9Å; E297-N301 PolarHBondContact O-ND2 3.28Å; E297-A335 HydrophobicContact CG-CB 4.14Å; E297-S339 VanDerWaalsContact CG-OG 3.23Å; E297-S339 WeakPolarHBondContact CG-OG 3.41Å; E297-S339 PolarHBondContact OE2-OG 3.34Å
298	A	90.5	Very high	82.3	Confident	56 Å²	56	40 Å²	40	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-69.4	-37.4	177.3	0	0	0	0	0	111.1	H295 I296 N301 A302	H295-A298 HydrophobicContact CB-CB 4.13Å; H295-A298 PolarHBondContact O-N 3.35Å; I296-A298 PolarHBondContact O-N 2.71Å; A298-N301 PolarHBondContact O-N 3.3Å; A298-A302 VanDerWaalsContact O-CB 3.3Å; A298-A302 WeakPolarHBondContact O-CB 3.47Å; A298-A302 PolarHBondContact O-N 2.99Å
299	T	92.6	Very high	84.5	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-44.1	176	-54.4	0	0	0	0	111	F185 V189 F272 L293 H295 I296 A302 L303	F185-T299 HydrophobicContact CD1-CG2 4.44Å; F185-T299 HydrophobicContact CE1-CG2 3.86Å; V189-T299 HydrophobicContact CG1-CG2 4.41Å; F272-T299 HydrophobicContact CD2-CG2 3.83Å; F272-T299 HydrophobicContact CE2-CG2 4.28Å; L293-T299 HydrophobicContact CD2-CG2 4.17Å; H295-T299 WeakPolarHBondContact O-CB 3.23Å; H295-T299 PolarHBondContact O-N 3.47Å; H295-T299 PolarHBondContact O-OG1 3.15Å; I296-T299 WeakPolarHBondContact O-CB 3.33Å; I296-T299 PolarHBondContact O-N 3.01Å; I296-T299 VanDerWaalsContact O-N 3.12Å; T299-A302 PolarHBondContact O-N 2.89Å; T299-L303 HydrophobicContact CG2-CD1 4.25Å; T299-L303 VanDerWaalsContact O-CG 3.32Å; T299-L303 WeakPolarHBondContact O-CG 3.41Å; T299-L303 PolarHBondContact O-N 2.98Å
300	V	94.9	Very high	86.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-43.4	175.6	173.2	0	0	0	0	111.5	F272 I296 A302 L303 V304 M328 V336 C340	F272-V300 HydrophobicContact CE1-CG2 4.48Å; F272-V300 HydrophobicContact CE2-CG2 3.64Å; F272-V300 HydrophobicContact CZ-CG2 3.48Å; F272-V300 VanDerWaalsContact CZ-CG2 3.48Å; I296-V300 HydrophobicContact CG2-CG2 4.26Å; I296-V300 WeakPolarHBondContact O-CG2 3.27Å; I296-V300 PolarHBondContact O-N 2.69Å; V300-A302 VanDerWaalsContact C-N 3.31Å; V300-A302 PolarHBondContact O-N 3.29Å; V300-L303 PolarHBondContact O-N 3.36Å; V300-V304 WeakPolarHBondContact O-CG2 3.47Å; V300-V304 PolarHBondContact O-N 2.89Å; V300-M328 HydrophobicContact CG1-SD 4.47Å; V300-V336 HydrophobicContact CG2-CG1 4.18Å; V300-C340 HydrophobicContact CG1-CB 3.7Å
301	N	94.4	Very high	88.1	Confident	35 Å²	35	25.1 Å²	25.1	19%	0.187	14%	0.143	C	C	.	.	H	α-helix	trans	-56.5	-45.8	172.4	-92.8	-86.9	0	0	0	112	E297 A298 V304 D305 A343 R346	E297-N301 WeakPolarHBondContact O-CB 3.47Å; E297-N301 PolarHBondContact O-N 2.9Å; E297-N301 PolarHBondContact O-ND2 3.28Å; A298-N301 PolarHBondContact O-N 3.3Å; N301-V304 PolarHBondContact O-N 3.36Å; N301-D305 VanDerWaalsContact O-CG 3.29Å; N301-D305 PolarHBondContact O-N 2.79Å; N301-D305 VanDerWaalsContact O-OD2 3.13Å; N301-A343 HydrophobicContact CB-CB 4.41Å; N301-A343 WeakPolarHBondContact OD1-CB 3.46Å; N301-R346 PolarHBondContact OD1-NH2 3.02Å; N301-R346 VanDerWaalsContact OD1-NH2 3.12Å
302	A	95.3	Very high	89.6	Confident	2 Å²	2	23.8 Å²	23.8	2%	0.017	13%	0.133	C	C	.	.	H	α-helix	trans	-66.5	-39.6	-179.8	0	0	0	0	0	112.8	V189 R193 A298 T299 V300 D305 I306	V189-A302 HydrophobicContact CG1-CB 3.41Å; V189-A302 VanDerWaalsContact CG1-CB 3.41Å; R193-A302 HydrophobicContact CB-CB 4.09Å; R193-A302 HydrophobicContact CG-CB 4.03Å; A298-A302 VanDerWaalsContact O-CB 3.3Å; A298-A302 WeakPolarHBondContact O-CB 3.47Å; A298-A302 PolarHBondContact O-N 2.99Å; T299-A302 PolarHBondContact O-N 2.89Å; V300-A302 VanDerWaalsContact C-N 3.31Å; V300-A302 PolarHBondContact O-N 3.29Å; A302-D305 PolarHBondContact O-N 3.03Å; A302-I306 WeakPolarHBondContact O-CD1 3.21Å; A302-I306 VanDerWaalsContact O-CG1 3.23Å; A302-I306 WeakPolarHBondContact O-CG1 3.37Å; A302-I306 PolarHBondContact O-N 3.27Å
303	L	96.1	Very high	90.6	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-42.9	174.6	-70.9	169.9	0	0	0	111.7	V189 L268 F272 T299 V300 I306 I307 M328	V189-L303 HydrophobicContact CG1-CD2 4.49Å; V189-L303 HydrophobicContact CG1-CG 4.48Å; V189-L303 HydrophobicContact CG2-CD2 4.31Å; L268-L303 HydrophobicContact CB-CD2 3.93Å; L268-L303 HydrophobicContact CD1-CD2 4.3Å; F272-L303 HydrophobicContact CB-CD1 3.77Å; F272-L303 HydrophobicContact CD1-CD1 4.24Å; F272-L303 HydrophobicContact CD2-CD1 3.71Å; F272-L303 HydrophobicContact CE2-CD1 4.4Å; F272-L303 HydrophobicContact CG-CD1 3.63Å; T299-L303 HydrophobicContact CG2-CD1 4.25Å; T299-L303 VanDerWaalsContact O-CG 3.32Å; T299-L303 WeakPolarHBondContact O-CG 3.41Å; T299-L303 PolarHBondContact O-N 2.98Å; V300-L303 PolarHBondContact O-N 3.36Å; L303-I306 PolarHBondContact O-N 3.08Å; L303-I307 WeakPolarHBondContact O-CD1 3.31Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.9Å; L303-M328 HydrophobicContact CB-CE 4.42Å; L303-M328 HydrophobicContact CD1-CE 4.01Å
304	V	96.4	Very high	91.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-40.7	175.6	172	0	0	0	0	111.7	V300 N301 I306 I307 H308 Y325 A343 L344 V347	V300-V304 WeakPolarHBondContact O-CG2 3.47Å; V300-V304 PolarHBondContact O-N 2.89Å; N301-V304 PolarHBondContact O-N 3.36Å; V304-I306 VanDerWaalsContact C-N 3.33Å; V304-I306 PolarHBondContact O-N 3.26Å; V304-I307 PolarHBondContact O-N 3.34Å; V304-H308 WeakPolarHBondContact O-CB 3.06Å; V304-H308 PolarHBondContact O-N 3.15Å; V304-Y325 HydrophobicContact CB-CE1 4.4Å; V304-Y325 HydrophobicContact CG1-CE1 4.17Å; V304-Y325 HydrophobicContact CG2-CD1 4.37Å; V304-Y325 HydrophobicContact CG2-CE1 4.04Å; V304-A343 HydrophobicContact CB-CB 3.68Å; V304-A343 HydrophobicContact CG1-CB 3.69Å; V304-A343 HydrophobicContact CG2-CB 3.99Å; V304-L344 HydrophobicContact CG1-CD2 3.85Å; V304-L344 HydrophobicContact CG1-CG 3.95Å; V304-V347 HydrophobicContact CG1-CG2 4.03Å
305	D	95.1	Very high	91.6	Very high	6 Å²	6	25.4 Å²	25.4	3%	0.032	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-38.7	173.8	-72.2	-37.3	0	0	0	112.3	R193 I197 N301 A302 G309 R346 V347	R193-D305 HydrophobicContact CG-CB 3.83Å; R193-D305 IonicContact CZ-OD2 3.42Å; R193-D305 IonicContact NE-OD2 2.68Å; R193-D305 PolarHBondContact NE-OD2 3.21Å; R193-D305 IonicContact NH2-OD2 2.71Å; R193-D305 PolarHBondContact NH2-OD2 3.44Å; I197-D305 HydrophobicContact CD1-CB 4.14Å; I197-D305 HydrophobicContact CG1-CB 4.19Å; N301-D305 VanDerWaalsContact O-CG 3.29Å; N301-D305 PolarHBondContact O-N 2.79Å; N301-D305 VanDerWaalsContact O-OD2 3.13Å; A302-D305 PolarHBondContact O-N 3.03Å; D305-G309 PolarHBondContact O-N 3.02Å; D305-G309 VanDerWaalsContact O-N 3.1Å; D305-R346 VanDerWaalsContact CG-NH2 3.29Å; D305-R346 IonicContact OD1-CZ 3.02Å; D305-R346 VanDerWaalsContact OD1-CZ 3.25Å; D305-R346 IonicContact OD1-NH1 3.56Å; D305-R346 PolarHBondContact OD1-NH1 3.45Å; D305-R346 IonicContact OD1-NH2 2.67Å; D305-R346 PolarHBondContact OD1-NH2 3.32Å; D305-R346 IonicContact OD2-CZ 3.97Å; D305-R346 IonicContact OD2-NH1 2.81Å; D305-R346 IonicContact OD2-NH2 3.27Å; D305-R346 PolarHBondContact OD2-NH2 3.38Å; D305-V347 WeakPolarHBondContact OD1-CG1 3.36Å
306	I	94.8	Very high	91.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.1	-54	175.2	-70.2	162.5	0	0	0	110.5	V189 A192 R193 A196 L203 L268 A302 L303 V304 H308 G309 Y310	V189-I306 HydrophobicContact CG1-CD1 4.28Å; A192-I306 HydrophobicContact CB-CD1 3.69Å; A192-I306 HydrophobicContact CB-CG1 4.19Å; R193-I306 HydrophobicContact CB-CD1 4.36Å; R193-I306 HydrophobicContact CB-CG1 4.19Å; A196-I306 HydrophobicContact CB-CG1 4.24Å; L203-I306 HydrophobicContact CD2-CG2 4.3Å; L268-I306 HydrophobicContact CD1-CD1 4.07Å; L268-I306 HydrophobicContact CD1-CG2 4.18Å; A302-I306 WeakPolarHBondContact O-CD1 3.21Å; A302-I306 VanDerWaalsContact O-CG1 3.23Å; A302-I306 WeakPolarHBondContact O-CG1 3.37Å; A302-I306 PolarHBondContact O-N 3.27Å; L303-I306 PolarHBondContact O-N 3.08Å; V304-I306 VanDerWaalsContact C-N 3.33Å; V304-I306 PolarHBondContact O-N 3.26Å; I306-H308 VanDerWaalsContact C-N 3.3Å; I306-H308 PolarHBondContact O-N 3.07Å; I306-G309 WeakPolarHBondContact O-CA 3.43Å; I306-G309 PolarHBondContact O-N 3.07Å; I306-Y310 HydrophobicContact CG2-CD2 4.25Å; I306-Y310 HydrophobicContact CG2-CE2 3.93Å; I306-Y310 WeakPolarHBondContact O-CD2 3.29Å; I306-Y310 PolarHBondContact O-N 3.23Å
307	I	94.3	Very high	91.7	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-40.6	-177.5	-61	159.1	0	0	0	110.6	I265 L303 V304 G309 Y310 C311 A321 I324 Y325	I265-I307 HydrophobicContact CG2-CD1 4.29Å; I265-I307 HydrophobicContact CG2-CG1 3.66Å; L303-I307 WeakPolarHBondContact O-CD1 3.31Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.9Å; V304-I307 PolarHBondContact O-N 3.34Å; I307-G309 VanDerWaalsContact C-N 3.33Å; I307-G309 PolarHBondContact O-N 3.07Å; I307-Y310 PolarHBondContact O-N 3.28Å; I307-C311 PolarHBondContact O-N 3.31Å; I307-C311 PolarHBondContact O-SG 2.94Å; I307-C311 VanDerWaalsContact O-SG 3.4Å; I307-A321 HydrophobicContact CG2-CB 3.34Å; I307-I324 HydrophobicContact CD1-CG2 3.77Å; I307-Y325 HydrophobicContact CB-CE1 4.02Å; I307-Y325 WeakPolarHBondContact CB-OH 3.27Å; I307-Y325 HydrophobicContact CD1-CD1 4.46Å; I307-Y325 HydrophobicContact CD1-CE1 3.89Å; I307-Y325 HydrophobicContact CG2-CE1 3.87Å; I307-Y325 HydrophobicContact CG2-CE2 4.22Å; I307-Y325 VanDerWaalsContact CG2-OH 3.23Å; I307-Y325 WeakPolarHBondContact CG2-OH 3.2Å
308	H	93	Very high	91.7	Very high	29 Å²	29	20 Å²	20	13%	0.134	12%	0.115	C	C	.	.	H	α-helix	trans	-60	-42	174	-178.3	76.3	0	0	0	112	V304 I306 Y310 C311 T312 Y325 V347	V304-H308 WeakPolarHBondContact O-CB 3.06Å; V304-H308 PolarHBondContact O-N 3.15Å; I306-H308 VanDerWaalsContact C-N 3.3Å; I306-H308 PolarHBondContact O-N 3.07Å; H308-Y310 PolarHBondContact O-N 3.31Å; H308-C311 PolarHBondContact O-N 3.06Å; H308-C311 VanDerWaalsContact O-N 3.16Å; H308-T312 WeakPolarHBondContact O-CG2 3.3Å; H308-T312 PolarHBondContact O-N 2.95Å; H308-T312 PolarHBondContact O-OG1 3.23Å; H308-Y325 PolarHBondContact N-OH 3.34Å; H308-V347 HydrophobicContact CB-CB 4.3Å; H308-V347 HydrophobicContact CB-CG2 3.98Å
309	G	91.1	Very high	91.6	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-52.5	-49.9	172.8	0	0	0	0	0	112.6	D305 I306 I307 T312 C313	D305-G309 PolarHBondContact O-N 3.02Å; D305-G309 VanDerWaalsContact O-N 3.1Å; I306-G309 WeakPolarHBondContact O-CA 3.43Å; I306-G309 PolarHBondContact O-N 3.07Å; I307-G309 VanDerWaalsContact C-N 3.33Å; I307-G309 PolarHBondContact O-N 3.07Å; G309-T312 PolarHBondContact O-N 3.49Å; G309-T312 PolarHBondContact O-OG1 3.21Å; G309-C313 PolarHBondContact O-N 3.23Å
310	Y	91.3	Very high	91.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.6	-51.3	173.3	-77.1	-92.9	0	0	0	112	L203 V204 T207 F264 I265 I306 I307 H308 T312 C313 E314	L203-Y310 HydrophobicContact CD1-CE2 4.28Å; L203-Y310 HydrophobicContact CD2-CD2 3.66Å; L203-Y310 HydrophobicContact CD2-CE2 3.37Å; L203-Y310 HydrophobicContact CG-CD2 4.36Å; L203-Y310 HydrophobicContact CG-CE2 3.66Å; V204-Y310 HydrophobicContact CB-CD1 4.3Å; V204-Y310 HydrophobicContact CB-CE1 4.24Å; V204-Y310 HydrophobicContact CG1-CD1 4.23Å; V204-Y310 HydrophobicContact CG1-CE1 4.28Å; V204-Y310 HydrophobicContact CG2-CD1 3.59Å; V204-Y310 HydrophobicContact CG2-CE1 3.93Å; V204-Y310 HydrophobicContact CG2-CG 4.16Å; T207-Y310 WeakPolarHBondContact CB-OH 3.15Å; T207-Y310 VanDerWaalsContact CG2-OH 3.31Å; T207-Y310 WeakPolarHBondContact CG2-OH 3.07Å; T207-Y310 PolarHBondContact OG1-OH 3.09Å; F264-Y310 HydrophobicContact CD1-CE2 4.45Å; F264-Y310 VanDerWaalsContact CD1-OH 3.27Å; F264-Y310 WeakPolarHBondContact CD1-OH 3.47Å; I265-Y310 HydrophobicContact CD1-CD1 4.05Å; I265-Y310 HydrophobicContact CD1-CD2 3.47Å; I265-Y310 VanDerWaalsContact CD1-CD2 3.47Å; I265-Y310 HydrophobicContact CD1-CE1 4.47Å; I265-Y310 HydrophobicContact CD1-CE2 3.94Å; I265-Y310 HydrophobicContact CD1-CG 3.56Å; I265-Y310 HydrophobicContact CG1-CD1 4.49Å; I265-Y310 HydrophobicContact CG1-CD2 3.72Å; I265-Y310 HydrophobicContact CG1-CE1 4.43Å; I265-Y310 HydrophobicContact CG1-CE2 3.63Å; I265-Y310 HydrophobicContact CG1-CG 4.18Å; I306-Y310 HydrophobicContact CG2-CD2 4.25Å; I306-Y310 HydrophobicContact CG2-CE2 3.93Å; I306-Y310 WeakPolarHBondContact O-CD2 3.29Å; I306-Y310 PolarHBondContact O-N 3.23Å; I307-Y310 PolarHBondContact O-N 3.28Å; H308-Y310 PolarHBondContact O-N 3.31Å; Y310-T312 PolarHBondContact O-N 3.45Å; Y310-C313 CarbonylContact O-C 3.56Å; Y310-C313 WeakPolarHBondContact O-CA 3.4Å; Y310-C313 PolarHBondContact O-N 2.92Å; Y310-E314 PolarHBondContact O-N 3.11Å
311	C	91.3	Very high	91.2	Very high	4 Å²	4	20.4 Å²	20.4	3%	0.027	11%	0.11	C	C	.	.	H	α-helix	trans	-59.3	-29.6	-179.6	-64.5	0	0	0	0	113.8	I307 H308 C313 I318 A321 V581	I307-C311 PolarHBondContact O-N 3.31Å; I307-C311 PolarHBondContact O-SG 2.94Å; I307-C311 VanDerWaalsContact O-SG 3.4Å; H308-C311 PolarHBondContact O-N 3.06Å; H308-C311 VanDerWaalsContact O-N 3.16Å; C311-C313 VanDerWaalsContact C-N 3.31Å; C311-I318 HydrophobicContact CB-CG1 4.02Å; C311-A321 VanDerWaalsContact SG-CB 3.56Å; C311-V581 HydrophobicContact CB-CG1 4.01Å; C311-V581 HydrophobicContact CB-CG2 4.39Å; C311-V581 VanDerWaalsContact O-CG2 3.24Å; C311-V581 WeakPolarHBondContact O-CG2 3.46Å
312	T	89.6	Confident	91.1	Very high	36 Å²	36	19.2 Å²	19.2	22%	0.221	10%	0.104	C	C	.	.	H	α-helix	trans	-76.1	-16.1	173.9	60.4	0	0	0	0	114.1	H308 G309 Y310 R577	H308-T312 WeakPolarHBondContact O-CG2 3.3Å; H308-T312 PolarHBondContact O-N 2.95Å; H308-T312 PolarHBondContact O-OG1 3.23Å; G309-T312 PolarHBondContact O-N 3.49Å; G309-T312 PolarHBondContact O-OG1 3.21Å; Y310-T312 PolarHBondContact O-N 3.45Å; T312-R577 WeakPolarHBondContact O-CD 3.41Å; T312-R577 PolarHBondContact O-NH1 3.25Å
313	C	88.5	Confident	90.8	Very high	14 Å²	14	24.1 Å²	24.1	10%	0.095	13%	0.125	C	C	.	.	H	α-helix	trans	-100.6	-43.1	178.8	-75.1	0	0	0	0	113	P200 N201 V204 G309 Y310 C311 R577	P200-C313 VanDerWaalsContact CB-SG 3.6Å; N201-C313 PolarHBondContact N-SG 3.34Å; N201-C313 VanDerWaalsContact N-SG 3.44Å; N201-C313 PolarHBondContact OD1-SG 3.49Å; V204-C313 HydrophobicContact CG2-CB 3.59Å; G309-C313 PolarHBondContact O-N 3.23Å; Y310-C313 CarbonylContact O-C 3.56Å; Y310-C313 WeakPolarHBondContact O-CA 3.4Å; Y310-C313 PolarHBondContact O-N 2.92Å; C311-C313 VanDerWaalsContact C-N 3.31Å; C313-R577 VanDerWaalsContact CA-NH1 3.35Å; C313-R577 PolarHBondContact O-NH1 3.12Å; C313-R577 PolarHBondContact O-NH2 3.08Å
314	E	86.7	Confident	90.6	Very high	74 Å²	74	24.5 Å²	24.5	35%	0.346	13%	0.127	S	C	.	.			trans	-134.9	123.6	-176.9	-70.8	-177.8	173.5	0	0	109.9	V204 Y310	V204-E314 VanDerWaalsContact CG1-CD 3.43Å; V204-E314 HydrophobicContact CG1-CG 4.15Å; V204-E314 WeakPolarHBondContact CG1-OE1 3.33Å; Y310-E314 PolarHBondContact O-N 3.11Å
315	L	86.1	Confident	90.5	Very high	40 Å²	40	24.9 Å²	24.9	21%	0.209	13%	0.129	C	C	.	.	S	Bend	trans	-78	-24.4	-175.1	-61.8	177.5	0	0	0	112.2	C317 I318 M580 V581 M584	L315-C317 PolarHBondContact O-N 3.39Å; L315-I318 HydrophobicContact CB-CD1 4.18Å; L315-I318 HydrophobicContact CD2-CD1 3.83Å; L315-I318 VanDerWaalsContact O-CB 3.24Å; L315-I318 WeakPolarHBondContact O-CB 3.48Å; L315-I318 WeakPolarHBondContact O-CD1 3.27Å; L315-I318 WeakPolarHBondContact O-CG1 3.37Å; L315-I318 PolarHBondContact O-N 3.18Å; L315-M580 HydrophobicContact CD1-CE 3.89Å; L315-V581 HydrophobicContact CD2-CG2 3.86Å; L315-M584 HydrophobicContact CB-CE 4.31Å; L315-M584 HydrophobicContact CB-SD 4.32Å; L315-M584 HydrophobicContact CD1-SD 4.35Å
316	D	86.2	Confident	90.3	Very high	112 Å²	112	25 Å²	25	60%	0.599	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.5	178.6	-58.7	-56.8	0	0	0	112.1	I318 N319	D316-I318 PolarHBondContact O-N 2.91Å; D316-I318 VanDerWaalsContact O-N 3.12Å; D316-N319 PolarHBondContact O-N 3.46Å; D316-N319 PolarHBondContact O-ND2 2.96Å
317	C	87.4	Confident	90	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-58.8	-22.2	174	-54.8	0	0	0	0	113.3	L315 N319 T320 A321	L315-C317 PolarHBondContact O-N 3.39Å; C317-N319 PolarHBondContact O-N 3.24Å; C317-T320 PolarHBondContact O-N 3.28Å; C317-T320 VanDerWaalsContact O-N 3.14Å; C317-A321 VanDerWaalsContact O-CB 3.31Å; C317-A321 WeakPolarHBondContact O-CB 3.47Å; C317-A321 PolarHBondContact O-N 3.03Å
318	I	90.1	Very high	89.9	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-31.1	-179.3	-62	168.2	0	0	0	111.4	C311 L315 D316 S322 V581 M584	C311-I318 HydrophobicContact CB-CG1 4.02Å; L315-I318 HydrophobicContact CB-CD1 4.18Å; L315-I318 HydrophobicContact CD2-CD1 3.83Å; L315-I318 VanDerWaalsContact O-CB 3.24Å; L315-I318 WeakPolarHBondContact O-CB 3.48Å; L315-I318 WeakPolarHBondContact O-CD1 3.27Å; L315-I318 WeakPolarHBondContact O-CG1 3.37Å; L315-I318 PolarHBondContact O-N 3.18Å; D316-I318 PolarHBondContact O-N 2.91Å; D316-I318 VanDerWaalsContact O-N 3.12Å; I318-S322 WeakPolarHBondContact O-CB 3.41Å; I318-S322 PolarHBondContact O-N 3.34Å; I318-S322 PolarHBondContact O-OG 3.32Å; I318-V581 HydrophobicContact CD1-CB 4.44Å; I318-V581 HydrophobicContact CD1-CG1 4.5Å; I318-V581 HydrophobicContact CD1-CG2 4.12Å; I318-M584 HydrophobicContact CD1-CB 3.99Å; I318-M584 HydrophobicContact CD1-CE 4Å; I318-M584 HydrophobicContact CD1-SD 3.84Å; I318-M584 HydrophobicContact CG2-CB 4.12Å
319	N	88.7	Confident	89.9	Confident	41 Å²	41	26.2 Å²	26.2	22%	0.219	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-39.3	176.8	-58.3	-52.5	0	0	0	112	D316 C317 S322 K323 R588	D316-N319 PolarHBondContact O-N 3.46Å; D316-N319 PolarHBondContact O-ND2 2.96Å; C317-N319 PolarHBondContact O-N 3.24Å; N319-S322 PolarHBondContact O-OG 2.87Å; N319-S322 VanDerWaalsContact O-OG 3.1Å; N319-K323 WeakPolarHBondContact O-CD 3.26Å; N319-K323 WeakPolarHBondContact O-CG 3.5Å; N319-R588 VanDerWaalsContact OD1-CZ 3.23Å; N319-R588 PolarHBondContact OD1-NE 2.96Å; N319-R588 PolarHBondContact OD1-NH2 3.4Å
320	T	87.8	Confident	90	Very high	24 Å²	24	26.7 Å²	26.7	15%	0.147	14%	0.137	C	C	.	.	H	α-helix	trans	-81.3	-39.3	176.7	-57.2	0	0	0	0	111.3	C262 C317 S322 K323 I324	C262-T320 HydrophobicContact CB-CG2 3.81Å; C317-T320 PolarHBondContact O-N 3.28Å; C317-T320 VanDerWaalsContact O-N 3.14Å; T320-S322 PolarHBondContact O-N 3.07Å; T320-K323 PolarHBondContact O-N 2.88Å; T320-I324 HydrophobicContact CG2-CD1 3.93Å; T320-I324 WeakPolarHBondContact O-CG1 3.44Å; T320-I324 PolarHBondContact O-N 3.3Å; T320-I324 VanDerWaalsContact O-N 3.08Å
321	A	91.1	Very high	89.9	Confident	2 Å²	2	27 Å²	27	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-58.8	-46.4	176.2	0	0	0	0	0	112.5	I307 C311 C317 K323 I324 Y325	I307-A321 HydrophobicContact CG2-CB 3.34Å; C311-A321 VanDerWaalsContact SG-CB 3.56Å; C317-A321 VanDerWaalsContact O-CB 3.31Å; C317-A321 WeakPolarHBondContact O-CB 3.47Å; C317-A321 PolarHBondContact O-N 3.03Å; A321-K323 PolarHBondContact O-N 3.48Å; A321-I324 PolarHBondContact O-N 3.29Å; A321-I324 VanDerWaalsContact O-N 3.17Å; A321-Y325 HydrophobicContact CB-CD2 4.31Å; A321-Y325 HydrophobicContact CB-CE2 3.88Å; A321-Y325 WeakPolarHBondContact O-CB 3.49Å; A321-Y325 VanDerWaalsContact O-CD2 3.24Å; A321-Y325 WeakPolarHBondContact O-CD2 3.37Å; A321-Y325 PolarHBondContact O-N 3.11Å
322	S	91.4	Very high	89.7	Confident	9 Å²	9	31 Å²	31	6%	0.063	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-42.6	177.4	51.1	0	0	0	0	112.7	I318 N319 T320 I324 Y325 M326	I318-S322 WeakPolarHBondContact O-CB 3.41Å; I318-S322 PolarHBondContact O-N 3.34Å; I318-S322 PolarHBondContact O-OG 3.32Å; N319-S322 PolarHBondContact O-OG 2.87Å; N319-S322 VanDerWaalsContact O-OG 3.1Å; T320-S322 PolarHBondContact O-N 3.07Å; S322-I324 VanDerWaalsContact C-N 3.33Å; S322-I324 PolarHBondContact O-N 2.97Å; S322-Y325 PolarHBondContact O-N 3.11Å; S322-M326 WeakPolarHBondContact O-CB 3.39Å; S322-M326 PolarHBondContact O-N 2.85Å
323	K	90.2	Very high	89.6	Confident	105 Å²	105	31.3 Å²	31.3	46%	0.457	17%	0.165	S	C	.	.	H	α-helix	trans	-57.2	-44.2	172.7	-66.8	168.5	-174.2	173.8	0	111.3	N319 T320 A321 Q327	N319-K323 WeakPolarHBondContact O-CD 3.26Å; N319-K323 WeakPolarHBondContact O-CG 3.5Å; T320-K323 PolarHBondContact O-N 2.88Å; A321-K323 PolarHBondContact O-N 3.48Å; K323-Q327 WeakPolarHBondContact O-CG 3.39Å; K323-Q327 PolarHBondContact O-N 3.17Å
324	I	91.3	Very high	89.5	Confident	11 Å²	11	33.9 Å²	33.9	6%	0.056	18%	0.182	C	C	.	.	H	α-helix	trans	-69.2	-48.4	178.9	-66.7	160.8	0	0	0	111.9	I265 V269 I307 T320 A321 S322 M326 Q327 M328	I265-I324 HydrophobicContact CG2-CD1 3.67Å; V269-I324 HydrophobicContact CG1-CG2 4.18Å; V269-I324 HydrophobicContact CG2-CD1 4.17Å; V269-I324 HydrophobicContact CG2-CG1 4.46Å; V269-I324 HydrophobicContact CG2-CG2 3.85Å; I307-I324 HydrophobicContact CD1-CG2 3.77Å; T320-I324 HydrophobicContact CG2-CD1 3.93Å; T320-I324 WeakPolarHBondContact O-CG1 3.44Å; T320-I324 PolarHBondContact O-N 3.3Å; T320-I324 VanDerWaalsContact O-N 3.08Å; A321-I324 PolarHBondContact O-N 3.29Å; A321-I324 VanDerWaalsContact O-N 3.17Å; S322-I324 VanDerWaalsContact C-N 3.33Å; S322-I324 PolarHBondContact O-N 2.97Å; I324-M326 VanDerWaalsContact C-N 3.28Å; I324-M326 PolarHBondContact O-N 3.45Å; I324-Q327 WeakPolarHBondContact O-CB 3.18Å; I324-Q327 PolarHBondContact O-N 3.12Å; I324-Q327 VanDerWaalsContact O-N 3.14Å; I324-M328 HydrophobicContact CG2-CE 3.89Å; I324-M328 HydrophobicContact CG2-SD 4.24Å; I324-M328 PolarHBondContact O-N 3.38Å
325	Y	93.9	Very high	89.6	Confident	7 Å²	7	31.5 Å²	31.5	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-38.8	-179.7	-65.8	-34.2	0	0	0	111.5	V304 I307 H308 A321 S322 M328 L329 L344 L585	V304-Y325 HydrophobicContact CB-CE1 4.4Å; V304-Y325 HydrophobicContact CG1-CE1 4.17Å; V304-Y325 HydrophobicContact CG2-CD1 4.37Å; V304-Y325 HydrophobicContact CG2-CE1 4.04Å; I307-Y325 HydrophobicContact CB-CE1 4.02Å; I307-Y325 WeakPolarHBondContact CB-OH 3.27Å; I307-Y325 HydrophobicContact CD1-CD1 4.46Å; I307-Y325 HydrophobicContact CD1-CE1 3.89Å; I307-Y325 HydrophobicContact CG2-CE1 3.87Å; I307-Y325 HydrophobicContact CG2-CE2 4.22Å; I307-Y325 VanDerWaalsContact CG2-OH 3.23Å; I307-Y325 WeakPolarHBondContact CG2-OH 3.2Å; H308-Y325 PolarHBondContact N-OH 3.34Å; A321-Y325 HydrophobicContact CB-CD2 4.31Å; A321-Y325 HydrophobicContact CB-CE2 3.88Å; A321-Y325 WeakPolarHBondContact O-CB 3.49Å; A321-Y325 VanDerWaalsContact O-CD2 3.24Å; A321-Y325 WeakPolarHBondContact O-CD2 3.37Å; A321-Y325 PolarHBondContact O-N 3.11Å; S322-Y325 PolarHBondContact O-N 3.11Å; Y325-M328 PolarHBondContact O-N 3.5Å; Y325-L329 VanDerWaalsContact O-CB 3.27Å; Y325-L329 WeakPolarHBondContact O-CB 3.3Å; Y325-L329 WeakPolarHBondContact O-CG 3.32Å; Y325-L329 PolarHBondContact O-N 3.25Å; Y325-L344 HydrophobicContact CD1-CD1 4.26Å; Y325-L344 HydrophobicContact CD1-CD2 3.97Å; Y325-L344 HydrophobicContact CD1-CG 4.47Å; Y325-L344 HydrophobicContact CD2-CD2 3.94Å; Y325-L344 HydrophobicContact CE1-CD2 3.8Å; Y325-L344 HydrophobicContact CE2-CD2 3.76Å; Y325-L344 HydrophobicContact CG-CD1 4.15Å; Y325-L344 HydrophobicContact CG-CD2 4.04Å; Y325-L585 HydrophobicContact CD2-CD1 4.03Å; Y325-L585 HydrophobicContact CD2-CD2 4.32Å; Y325-L585 HydrophobicContact CE2-CD2 4.31Å
326	M	90.6	Very high	89.9	Confident	10 Å²	10	29.6 Å²	29.6	5%	0.049	17%	0.165	C	C	.	.	H	α-helix	trans	-60.2	-45.6	173.8	-169.6	-152	-42.2	0	0	112.2	S322 I324 M328 L329 L330 T592	S322-M326 WeakPolarHBondContact O-CB 3.39Å; S322-M326 PolarHBondContact O-N 2.85Å; I324-M326 VanDerWaalsContact C-N 3.28Å; I324-M326 PolarHBondContact O-N 3.45Å; M326-M328 VanDerWaalsContact C-N 3.32Å; M326-M328 PolarHBondContact O-N 2.97Å; M326-L329 PolarHBondContact O-N 3.46Å; M326-L330 HydrophobicContact CG-CD1 3.84Å; M326-L330 HydrophobicContact CG-CG 4.39Å; M326-L330 WeakPolarHBondContact O-CB 3.47Å; M326-L330 WeakPolarHBondContact O-CG 3.22Å; M326-L330 PolarHBondContact O-N 3.4Å; M326-T592 HydrophobicContact CE-CG2 3.47Å; M326-T592 VanDerWaalsContact CE-CG2 3.47Å
327	Q	88.8	Confident	90.2	Very high	57 Å²	57	24.5 Å²	24.5	27%	0.266	14%	0.138	S	C	.	.	H	α-helix	trans	-60.9	-40.4	177.1	-68.4	169.7	10.4	0	0	112.1	W273 K323 I324 C331	W273-Q327 HydrophobicContact CZ2-CB 4.12Å; K323-Q327 WeakPolarHBondContact O-CG 3.39Å; K323-Q327 PolarHBondContact O-N 3.17Å; I324-Q327 WeakPolarHBondContact O-CB 3.18Å; I324-Q327 PolarHBondContact O-N 3.12Å; I324-Q327 VanDerWaalsContact O-N 3.14Å; Q327-C331 PolarHBondContact O-N 2.87Å
328	M	93.4	Very high	90.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71.5	-47.4	177.8	-67.7	-177.3	176.5	0	0	111.8	V269 F272 W273 V300 L303 I324 Y325 M326 L330 C331 V336 S337 C340	V269-M328 HydrophobicContact CG1-CE 4.38Å; V269-M328 HydrophobicContact CG2-CE 4.22Å; F272-M328 HydrophobicContact CD1-CE 4.27Å; F272-M328 HydrophobicContact CE1-CE 4.31Å; W273-M328 HydrophobicContact CH2-CG 4.45Å; W273-M328 HydrophobicContact CZ2-CG 4.01Å; V300-M328 HydrophobicContact CG1-SD 4.47Å; L303-M328 HydrophobicContact CB-CE 4.42Å; L303-M328 HydrophobicContact CD1-CE 4.01Å; I324-M328 HydrophobicContact CG2-CE 3.89Å; I324-M328 HydrophobicContact CG2-SD 4.24Å; I324-M328 PolarHBondContact O-N 3.38Å; Y325-M328 PolarHBondContact O-N 3.5Å; M326-M328 VanDerWaalsContact C-N 3.32Å; M326-M328 PolarHBondContact O-N 2.97Å; M328-L330 PolarHBondContact O-N 3.24Å; M328-C331 WeakPolarHBondContact O-CB 3.3Å; M328-C331 PolarHBondContact O-N 3.16Å; M328-V336 HydrophobicContact CB-CG1 4.22Å; M328-V336 HydrophobicContact CG-CG1 4.38Å; M328-S337 VanDerWaalsContact O-CA 3.24Å; M328-S337 WeakPolarHBondContact O-CA 3.17Å; M328-C340 HydrophobicContact CB-CB 3.88Å; M328-C340 VanDerWaalsContact CB-SG 3.54Å
329	L	93.6	Very high	90.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.2	-36.1	-179.2	-73.7	168	0	0	0	113.3	Y325 M326 C331 S337 C340 K341 L344 P606 Y607 V610	Y325-L329 VanDerWaalsContact O-CB 3.27Å; Y325-L329 WeakPolarHBondContact O-CB 3.3Å; Y325-L329 WeakPolarHBondContact O-CG 3.32Å; Y325-L329 PolarHBondContact O-N 3.25Å; M326-L329 PolarHBondContact O-N 3.46Å; L329-C331 VanDerWaalsContact C-N 3.32Å; L329-S337 WeakPolarHBondContact O-CB 3.22Å; L329-C340 HydrophobicContact CD2-CB 4.39Å; L329-K341 HydrophobicContact CD2-CB 3.8Å; L329-L344 HydrophobicContact CD1-CD1 3.86Å; L329-L344 HydrophobicContact CD2-CD1 4.18Å; L329-L344 HydrophobicContact CG-CD1 4.17Å; L329-P606 HydrophobicContact CD2-CB 4.1Å; L329-Y607 HydrophobicContact CD1-CD2 4.39Å; L329-V610 HydrophobicContact CD1-CB 4.47Å; L329-V610 HydrophobicContact CD1-CG2 4.16Å; L329-V610 HydrophobicContact CD2-CG2 3.87Å
330	L	91.3	Very high	91	Very high	12 Å²	12	23.3 Å²	23.3	6%	0.063	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.2	178	-54.6	-177.7	0	0	0	112.8	M326 M328 L596 V599 R603 Y607	M326-L330 HydrophobicContact CG-CD1 3.84Å; M326-L330 HydrophobicContact CG-CG 4.39Å; M326-L330 WeakPolarHBondContact O-CB 3.47Å; M326-L330 WeakPolarHBondContact O-CG 3.22Å; M326-L330 PolarHBondContact O-N 3.4Å; M328-L330 PolarHBondContact O-N 3.24Å; L330-L596 HydrophobicContact CD1-CD1 4.02Å; L330-L596 HydrophobicContact CD1-CG 4.49Å; L330-L596 HydrophobicContact CD2-CD1 4.37Å; L330-L596 HydrophobicContact CD2-CG 4.21Å; L330-V599 HydrophobicContact CB-CG1 4.25Å; L330-V599 HydrophobicContact CD2-CG1 4.27Å; L330-R603 VanDerWaalsContact O-CZ 3.32Å; L330-R603 PolarHBondContact O-NE 3.11Å; L330-R603 PolarHBondContact O-NH2 2.94Å; L330-Y607 HydrophobicContact CD2-CD2 4.14Å; L330-Y607 HydrophobicContact CD2-CG 4.16Å
331	C	90.4	Very high	91.4	Very high	7 Å²	7	22.8 Å²	22.8	5%	0.047	13%	0.127	C	C	.	.			trans	-60.9	135.3	179.8	-167.8	0	0	0	0	111.3	W273 Q327 M328 L329 D333 V336 S337	W273-C331 HydrophobicContact CH2-CB 4.25Å; Q327-C331 PolarHBondContact O-N 2.87Å; M328-C331 WeakPolarHBondContact O-CB 3.3Å; M328-C331 PolarHBondContact O-N 3.16Å; L329-C331 VanDerWaalsContact C-N 3.32Å; C331-D333 PolarHBondContact O-N 3.36Å; C331-V336 HydrophobicContact CB-CB 3.96Å; C331-V336 HydrophobicContact CB-CG1 3.85Å; C331-S337 PolarHBondContact O-OG 2.92Å
332	P	86.6	Confident	91.6	Very high	87 Å²	87	27.2 Å²	27.2	57%	0.565	15%	0.147	S	C	*	.	S	Bend	trans	-62.9	-18.2	174.7	-23.4	34	0	0	0	114.9	P334	P332-P334 WeakPolarHBondContact O-CD 3.42Å
333	D	86.9	Confident	91.7	Very high	42 Å²	42	26.8 Å²	26.8	23%	0.225	14%	0.144	C	C	.	.			trans	-82.8	118.7	175.1	-174.2	-11.6	0	0	0	110.3	H276 C331 A335 V336 S337	H276-D333 IonicContact CD2-OD2 3.2Å; H276-D333 IonicContact CE1-OD2 3.67Å; H276-D333 IonicContact NE2-OD2 2.7Å; H276-D333 PolarHBondContact NE2-OD2 2.88Å; C331-D333 PolarHBondContact O-N 3.36Å; D333-A335 VanDerWaalsContact C-N 3.25Å; D333-A335 PolarHBondContact O-N 3.39Å; D333-A335 WeakPolarHBondContact OD1-CB 3.2Å; D333-A335 PolarHBondContact OD1-N 3.42Å; D333-V336 HydrophobicContact CB-CB 4.34Å; D333-V336 HydrophobicContact CB-CG2 4.01Å; D333-V336 PolarHBondContact O-N 3.19Å; D333-V336 VanDerWaalsContact O-N 3.13Å; D333-S337 PolarHBondContact O-N 3.01Å; D333-S337 PolarHBondContact O-OG 3.07Å
334	P	87.4	Confident	92	Very high	68 Å²	68	21.8 Å²	21.8	44%	0.442	12%	0.122	S	C	.	.	H	α-helix	trans	-59.1	-33.4	175.8	-24.6	35.9	0	0	0	113.6	P332 V336 S337 F338	P332-P334 WeakPolarHBondContact O-CD 3.42Å; P334-V336 PolarHBondContact O-N 2.94Å; P334-S337 WeakPolarHBondContact CA-OG 3.43Å; P334-S337 PolarHBondContact O-N 3.45Å; P334-F338 HydrophobicContact CB-CD2 4.12Å; P334-F338 WeakPolarHBondContact O-CB 3.33Å; P334-F338 PolarHBondContact O-N 3.13Å
335	A	87.8	Confident	92.1	Very high	25 Å²	25	22.3 Å²	22.3	21%	0.207	13%	0.125	C	C	.	.	H	α-helix	trans	-73.5	-8.1	179.5	0	0	0	0	0	113.3	I296 E297 D333 S339	I296-A335 HydrophobicContact CG2-CB 4.38Å; E297-A335 HydrophobicContact CG-CB 4.14Å; D333-A335 VanDerWaalsContact C-N 3.25Å; D333-A335 PolarHBondContact O-N 3.39Å; D333-A335 WeakPolarHBondContact OD1-CB 3.2Å; D333-A335 PolarHBondContact OD1-N 3.42Å; A335-S339 WeakPolarHBondContact O-CB 3.31Å; A335-S339 PolarHBondContact O-OG 3.05Å
336	V	92.3	Very high	92	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-99.6	-51.6	168.1	-178.5	0	0	0	0	110.2	F272 W273 I296 V300 M328 C331 D333 P334 C340	F272-V336 HydrophobicContact CE1-CG1 4.42Å; F272-V336 HydrophobicContact CZ-CG1 4.21Å; F272-V336 HydrophobicContact CZ-CG2 4.12Å; W273-V336 HydrophobicContact CH2-CG1 3.94Å; W273-V336 HydrophobicContact CZ3-CG1 4.33Å; I296-V336 HydrophobicContact CG2-CG2 3.72Å; V300-V336 HydrophobicContact CG2-CG1 4.18Å; M328-V336 HydrophobicContact CB-CG1 4.22Å; M328-V336 HydrophobicContact CG-CG1 4.38Å; C331-V336 HydrophobicContact CB-CB 3.96Å; C331-V336 HydrophobicContact CB-CG1 3.85Å; D333-V336 HydrophobicContact CB-CB 4.34Å; D333-V336 HydrophobicContact CB-CG2 4.01Å; D333-V336 PolarHBondContact O-N 3.19Å; D333-V336 VanDerWaalsContact O-N 3.13Å; P334-V336 PolarHBondContact O-N 2.94Å; V336-C340 WeakPolarHBondContact O-CB 3.33Å; V336-C340 PolarHBondContact O-N 3.48Å
337	S	93.4	Very high	92.1	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.028	15%	0.146	C	C	.	.	H	α-helix	trans	-69	-48.4	-172.6	50.7	0	0	0	0	113.8	M328 L329 C331 D333 P334 K341	M328-S337 VanDerWaalsContact O-CA 3.24Å; M328-S337 WeakPolarHBondContact O-CA 3.17Å; L329-S337 WeakPolarHBondContact O-CB 3.22Å; C331-S337 PolarHBondContact O-OG 2.92Å; D333-S337 PolarHBondContact O-N 3.01Å; D333-S337 PolarHBondContact O-OG 3.07Å; P334-S337 WeakPolarHBondContact CA-OG 3.43Å; P334-S337 PolarHBondContact O-N 3.45Å; S337-K341 PolarHBondContact O-N 3.43Å
338	F	93.4	Very high	92.1	Very high	17 Å²	17	24.9 Å²	24.9	8%	0.075	13%	0.134	C	C	.	.	H	α-helix	trans	-73	-37.1	178.7	-75.2	-91.8	0	0	0	112.1	P334 K341 Q342 I605 P606 P742 M744	P334-F338 HydrophobicContact CB-CD2 4.12Å; P334-F338 WeakPolarHBondContact O-CB 3.33Å; P334-F338 PolarHBondContact O-N 3.13Å; F338-K341 CarbonylContact O-C 3.6Å; F338-K341 WeakPolarHBondContact O-CB 3.03Å; F338-K341 PolarHBondContact O-N 2.92Å; F338-Q342 WeakPolarHBondContact O-CG 3.09Å; F338-Q342 PolarHBondContact O-N 2.92Å; F338-I605 HydrophobicContact CE1-CG2 4.23Å; F338-I605 HydrophobicContact CZ-CG2 4.26Å; F338-P606 HydrophobicContact CD1-CG 4.12Å; F338-P606 HydrophobicContact CD2-CG 3.91Å; F338-P606 HydrophobicContact CE1-CG 3.9Å; F338-P606 HydrophobicContact CE2-CG 3.67Å; F338-P606 HydrophobicContact CG-CG 4.14Å; F338-P606 HydrophobicContact CZ-CG 3.67Å; F338-P742 HydrophobicContact CB-CB 4.37Å; F338-P742 HydrophobicContact CD1-CB 3.7Å; F338-P742 HydrophobicContact CD1-CG 4.35Å; F338-P742 HydrophobicContact CD2-CB 3.73Å; F338-P742 HydrophobicContact CD2-CG 3.81Å; F338-P742 HydrophobicContact CE1-CB 3.81Å; F338-P742 HydrophobicContact CE1-CG 4.05Å; F338-P742 HydrophobicContact CE2-CB 3.85Å; F338-P742 HydrophobicContact CE2-CG 3.47Å; F338-P742 VanDerWaalsContact CE2-CG 3.47Å; F338-P742 HydrophobicContact CG-CB 3.65Å; F338-P742 HydrophobicContact CG-CG 4.23Å; F338-P742 HydrophobicContact CZ-CB 3.88Å; F338-P742 HydrophobicContact CZ-CG 3.6Å; F338-M744 HydrophobicContact CE1-CG 4.28Å; F338-M744 HydrophobicContact CZ-CE 4.34Å; F338-M744 HydrophobicContact CZ-CG 4.14Å
339	S	93.7	Very high	91.7	Very high	3 Å²	3	32 Å²	32	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-69.5	-34	177.4	-45.7	0	0	0	0	111.8	E297 A335 Q342 A343	E297-S339 VanDerWaalsContact CG-OG 3.23Å; E297-S339 WeakPolarHBondContact CG-OG 3.41Å; E297-S339 PolarHBondContact OE2-OG 3.34Å; A335-S339 WeakPolarHBondContact O-CB 3.31Å; A335-S339 PolarHBondContact O-OG 3.05Å; S339-Q342 PolarHBondContact O-N 3.31Å; S339-A343 WeakPolarHBondContact O-CB 3.35Å; S339-A343 PolarHBondContact O-N 3.09Å
340	C	96.6	Very high	90.5	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-46.1	167.9	-175.6	0	0	0	0	111.4	V300 M328 L329 V336 Q342 A343 L344	V300-C340 HydrophobicContact CG1-CB 3.7Å; M328-C340 HydrophobicContact CB-CB 3.88Å; M328-C340 VanDerWaalsContact CB-SG 3.54Å; L329-C340 HydrophobicContact CD2-CB 4.39Å; V336-C340 WeakPolarHBondContact O-CB 3.33Å; V336-C340 PolarHBondContact O-N 3.48Å; C340-Q342 PolarHBondContact O-N 3Å; C340-A343 PolarHBondContact O-N 3.29Å; C340-L344 WeakPolarHBondContact O-CB 3.49Å; C340-L344 WeakPolarHBondContact O-CG 3.08Å; C340-L344 PolarHBondContact O-N 3.31Å
341	K	95.6	Very high	89.3	Confident	12 Å²	12	44 Å²	44	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-43.9	175	-178.7	-117.8	71.5	165.2	0	112.9	L329 S337 F338 A343 L344 I345 P606 Q609 V610	L329-K341 HydrophobicContact CD2-CB 3.8Å; S337-K341 PolarHBondContact O-N 3.43Å; F338-K341 CarbonylContact O-C 3.6Å; F338-K341 WeakPolarHBondContact O-CB 3.03Å; F338-K341 PolarHBondContact O-N 2.92Å; K341-A343 VanDerWaalsContact C-N 3.35Å; K341-L344 PolarHBondContact O-N 2.76Å; K341-I345 HydrophobicContact CD-CD1 3.97Å; K341-I345 HydrophobicContact CG-CD1 4.07Å; K341-I345 WeakPolarHBondContact O-CB 3.4Å; K341-I345 VanDerWaalsContact O-CG1 3.31Å; K341-I345 WeakPolarHBondContact O-CG1 3.33Å; K341-I345 PolarHBondContact O-N 3.31Å; K341-P606 HydrophobicContact CB-CB 3.98Å; K341-P606 HydrophobicContact CG-CB 4.36Å; K341-P606 WeakPolarHBondContact CG-O 3.3Å; K341-Q609 HydrophobicContact CD-CB 3.72Å; K341-Q609 HydrophobicContact CD-CG 4.29Å; K341-Q609 HydrophobicContact CG-CB 3.96Å; K341-V610 HydrophobicContact CB-CG2 4.27Å; K341-V610 HydrophobicContact CG-CG2 3.84Å
342	Q	94.4	Very high	87.4	Confident	95 Å²	95	49.5 Å²	49.5	44%	0.444	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-42.1	177	-64.8	-65.7	27.7	0	0	110.9	F338 S339 C340 R346	F338-Q342 WeakPolarHBondContact O-CG 3.09Å; F338-Q342 PolarHBondContact O-N 2.92Å; S339-Q342 PolarHBondContact O-N 3.31Å; C340-Q342 PolarHBondContact O-N 3Å; Q342-R346 VanDerWaalsContact O-CB 3.27Å; Q342-R346 WeakPolarHBondContact O-CB 3.42Å; Q342-R346 PolarHBondContact O-N 3.33Å
343	A	95.1	Very high	85.2	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-48.1	176.6	0	0	0	0	0	112.1	N301 V304 S339 C340 K341 R346 V347	N301-A343 HydrophobicContact CB-CB 4.41Å; N301-A343 WeakPolarHBondContact OD1-CB 3.46Å; V304-A343 HydrophobicContact CB-CB 3.68Å; V304-A343 HydrophobicContact CG1-CB 3.69Å; V304-A343 HydrophobicContact CG2-CB 3.99Å; S339-A343 WeakPolarHBondContact O-CB 3.35Å; S339-A343 PolarHBondContact O-N 3.09Å; C340-A343 PolarHBondContact O-N 3.29Å; K341-A343 VanDerWaalsContact C-N 3.35Å; A343-R346 WeakPolarHBondContact O-CB 3.42Å; A343-R346 PolarHBondContact O-N 3.22Å; A343-R346 VanDerWaalsContact O-N 3.12Å; A343-V347 WeakPolarHBondContact O-CG2 3.35Å; A343-V347 PolarHBondContact O-N 3.23Å
344	L	95.4	Very high	82.8	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-46.7	178.4	-77.8	168.8	0	0	0	112.2	V304 Y325 L329 C340 K341 R346 V347 L348 V610	V304-L344 HydrophobicContact CG1-CD2 3.85Å; V304-L344 HydrophobicContact CG1-CG 3.95Å; Y325-L344 HydrophobicContact CD1-CD1 4.26Å; Y325-L344 HydrophobicContact CD1-CD2 3.97Å; Y325-L344 HydrophobicContact CD1-CG 4.47Å; Y325-L344 HydrophobicContact CD2-CD2 3.94Å; Y325-L344 HydrophobicContact CE1-CD2 3.8Å; Y325-L344 HydrophobicContact CE2-CD2 3.76Å; Y325-L344 HydrophobicContact CG-CD1 4.15Å; Y325-L344 HydrophobicContact CG-CD2 4.04Å; L329-L344 HydrophobicContact CD1-CD1 3.86Å; L329-L344 HydrophobicContact CD2-CD1 4.18Å; L329-L344 HydrophobicContact CG-CD1 4.17Å; C340-L344 WeakPolarHBondContact O-CB 3.49Å; C340-L344 WeakPolarHBondContact O-CG 3.08Å; C340-L344 PolarHBondContact O-N 3.31Å; K341-L344 PolarHBondContact O-N 2.76Å; L344-R346 PolarHBondContact O-N 2.97Å; L344-V347 PolarHBondContact O-N 2.97Å; L344-L348 HydrophobicContact CB-CD1 4.4Å; L344-L348 HydrophobicContact CD2-CD1 3.92Å; L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 PolarHBondContact O-N 2.93Å; L344-V610 HydrophobicContact CB-CG2 4.16Å; L344-V610 HydrophobicContact CD1-CG1 4.47Å; L344-V610 HydrophobicContact CD1-CG2 4.12Å
345	I	92.9	Very high	80.3	Confident	22 Å²	22	69.6 Å²	69.6	11%	0.113	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-32.6	175.3	-68.3	-176.5	0	0	0	111.3	K341 R349 M613	K341-I345 HydrophobicContact CD-CD1 3.97Å; K341-I345 HydrophobicContact CG-CD1 4.07Å; K341-I345 WeakPolarHBondContact O-CB 3.4Å; K341-I345 VanDerWaalsContact O-CG1 3.31Å; K341-I345 WeakPolarHBondContact O-CG1 3.33Å; K341-I345 PolarHBondContact O-N 3.31Å; I345-R349 WeakPolarHBondContact O-CB 3.48Å; I345-R349 PolarHBondContact O-N 2.75Å; I345-M613 HydrophobicContact CB-CG 4.34Å; I345-M613 HydrophobicContact CD1-CB 4.21Å; I345-M613 HydrophobicContact CG1-CB 3.91Å; I345-M613 HydrophobicContact CG1-CE 4.33Å; I345-M613 HydrophobicContact CG1-CG 3.94Å; I345-M613 HydrophobicContact CG2-CG 4.17Å
346	R	92.6	Very high	77.8	Confident	107 Å²	107	76.9 Å²	76.9	40%	0.404	33%	0.325	S	S	.	.	H	α-helix	trans	-73	-39.6	177	177.2	-178.3	54.5	67.4	-1.8	113.4	N301 D305 Q342 A343 L344	N301-R346 PolarHBondContact OD1-NH2 3.02Å; N301-R346 VanDerWaalsContact OD1-NH2 3.12Å; D305-R346 VanDerWaalsContact CG-NH2 3.29Å; D305-R346 IonicContact OD1-CZ 3.02Å; D305-R346 VanDerWaalsContact OD1-CZ 3.25Å; D305-R346 IonicContact OD1-NH1 3.56Å; D305-R346 PolarHBondContact OD1-NH1 3.45Å; D305-R346 IonicContact OD1-NH2 2.67Å; D305-R346 PolarHBondContact OD1-NH2 3.32Å; D305-R346 IonicContact OD2-CZ 3.97Å; D305-R346 IonicContact OD2-NH1 2.81Å; D305-R346 IonicContact OD2-NH2 3.27Å; D305-R346 PolarHBondContact OD2-NH2 3.38Å; Q342-R346 VanDerWaalsContact O-CB 3.27Å; Q342-R346 WeakPolarHBondContact O-CB 3.42Å; Q342-R346 PolarHBondContact O-N 3.33Å; A343-R346 WeakPolarHBondContact O-CB 3.42Å; A343-R346 PolarHBondContact O-N 3.22Å; A343-R346 VanDerWaalsContact O-N 3.12Å; L344-R346 PolarHBondContact O-N 2.97Å
347	V	91.6	Very high	74.7	Confident	19 Å²	19	82.6 Å²	82.6	12%	0.115	36%	0.36	C	S	.	.	H	α-helix	trans	-84.7	-30.7	-178.4	-61.5	0	0	0	0	113.6	V304 D305 H308 A343 L344	V304-V347 HydrophobicContact CG1-CG2 4.03Å; D305-V347 WeakPolarHBondContact OD1-CG1 3.36Å; H308-V347 HydrophobicContact CB-CB 4.3Å; H308-V347 HydrophobicContact CB-CG2 3.98Å; A343-V347 WeakPolarHBondContact O-CG2 3.35Å; A343-V347 PolarHBondContact O-N 3.23Å; L344-V347 PolarHBondContact O-N 2.97Å
348	L	89.6	Confident	71.8	Confident	2 Å²	2	88.4 Å²	88.4	1%	0.01	40%	0.396	C	S	.	.	H	α-helix	trans	-90.6	-25.2	-176.1	-67.1	163	0	0	0	114.2	L344 L578 V581 R582 L585 M613 L614	L344-L348 HydrophobicContact CB-CD1 4.4Å; L344-L348 HydrophobicContact CD2-CD1 3.92Å; L344-L348 WeakPolarHBondContact O-CB 3.47Å; L344-L348 PolarHBondContact O-N 2.93Å; L348-L578 HydrophobicContact CD2-CD1 4.43Å; L348-V581 HydrophobicContact CD2-CG1 4.2Å; L348-R582 HydrophobicContact CD2-CG 4.34Å; L348-R582 VanDerWaalsContact O-CZ 3.3Å; L348-R582 PolarHBondContact O-NE 3.26Å; L348-R582 PolarHBondContact O-NH2 3.03Å; L348-L585 HydrophobicContact CD1-CD2 3.63Å; L348-M613 HydrophobicContact CB-CE 3.67Å; L348-M613 HydrophobicContact CB-SD 3.83Å; L348-M613 HydrophobicContact CD1-CE 3.81Å; L348-M613 HydrophobicContact CG-CE 4.38Å; L348-L614 HydrophobicContact CD1-CD2 4.22Å
349	R	84.7	Confident	68.9	Low	150 Å²	150	94.7 Å²	94.7	57%	0.566	43%	0.429	S	S	*	.	S	Bend	trans	-56.8	141	-179.2	178	-173.3	-64.8	-168.8	-2.3	112.2	I345	I345-R349 WeakPolarHBondContact O-CB 3.48Å; I345-R349 PolarHBondContact O-N 2.75Å
350	P	69.3	Low	65.8	Low	41 Å²	41	100.2 Å²	100.2	27%	0.266	47%	0.465	S	S	.	.			trans	-62.8	144.4	175.4	-19.7	32.5	0	0	0	112.1	D617	P350-D617 VanDerWaalsContact CD-CG 3.46Å; P350-D617 WeakPolarHBondContact CD-OD1 3.48Å; P350-D617 WeakPolarHBondContact CD-OD2 3.42Å; P350-D617 HydrophobicContact CG-CB 4.09Å; P350-D617 WeakPolarHBondContact CG-OD1 3.47Å; P350-D617 VanDerWaalsContact CG-OD2 3.23Å; P350-D617 WeakPolarHBondContact CG-OD2 3.48Å
351	R	66.1	Low	62.6	Low	223 Å²	223	105.9 Å²	105.9	84%	0.842	51%	0.505	S	S	*	.			trans	-110.1	79.9	173.8	-56.8	-175.6	84.9	147	2.5	107.9	K353	R351-K353 PolarHBondContact O-N 3.27Å
352	N	49.3	Very low	59.4	Low	122 Å²	122	110.5 Å²	110.5	65%	0.652	54%	0.538	S	S	*	.			trans	-66.2	86.4	174.9	-71	14.2	0	0	0	109.1	R354	N352-R354 PolarHBondContact O-N 3.08Å
353	K	41.1	Very low	56.8	Low	139 Å²	139	111.9 Å²	111.9	60%	0.604	56%	0.555	S	S	*	*			trans	-60	104.2	170.2	-60.9	179	-167.2	168.8	0	107.4	R351 R355 D571	R351-K353 PolarHBondContact O-N 3.27Å; K353-R355 PolarHBondContact O-N 3.25Å; K353-D571 IonicContact NZ-OD1 2.76Å; K353-D571 PolarHBondContact NZ-OD1 3.21Å; K353-D571 IonicContact NZ-OD2 2.63Å; K353-D571 PolarHBondContact NZ-OD2 3.08Å
354	R	35.6	Very low	53.7	Low	244 Å²	244	123.7 Å²	123.7	92%	0.921	60%	0.6	S	S	*	*			trans	-56.5	115.2	160.7	-75.8	-176.7	174.1	176	-1.5	105.8	N352 H356	N352-R354 PolarHBondContact O-N 3.08Å; R354-H356 PolarHBondContact O-N 2.76Å
355	R	35	Very low	50.4	Low	235 Å²	235	128.4 Å²	128.4	89%	0.887	63%	0.633	S	S	*	*			trans	-59.3	115.7	177.5	-73.7	-175	178.2	-178.5	-1	107.7	K353 V357	K353-R355 PolarHBondContact O-N 3.25Å; R355-V357 PolarHBondContact O-N 3.15Å
356	H	35.1	Very low	47.4	Very low	179 Å²	179	135.4 Å²	135.4	83%	0.829	67%	0.671	S	S	*	*			trans	-67.5	117.1	169.5	-144.2	-78.8	0	0	0	106.7	R354 T358	R354-H356 PolarHBondContact O-N 2.76Å; H356-T358 PolarHBondContact O-N 3.44Å
357	V	27.8	Very low	44.6	Very low	119 Å²	119	136.2 Å²	136.2	72%	0.721	69%	0.688	S	S	*	*			trans	-78.8	95.1	-178.8	178.4	0	0	0	0	108	R355 L359	R355-V357 PolarHBondContact O-N 3.15Å; V357-L359 PolarHBondContact O-N 3.23Å; V357-L359 VanDerWaalsContact O-N 3.1Å
358	T	32.6	Very low	41.6	Very low	127 Å²	127	140.5 Å²	140.5	78%	0.779	72%	0.716	S	S	*	*			trans	-71.4	100.5	171.7	-20.9	0	0	0	0	108.5	H356	H356-T358 PolarHBondContact O-N 3.44Å
359	L	32.3	Very low	38.7	Very low	148 Å²	148	149.5 Å²	149.5	78%	0.775	76%	0.76	S	S	*	*			trans	-63.5	127.7	170.4	-75.6	165.8	0	0	0	109.1	V357 S361	V357-L359 PolarHBondContact O-N 3.23Å; V357-L359 VanDerWaalsContact O-N 3.1Å; L359-S361 PolarHBondContact O-N 3.04Å
360	P	29.5	Very low	36.1	Very low	119 Å²	119	145.9 Å²	145.9	77%	0.773	77%	0.77	S	S	*	*			trans	-68.8	117.6	173.6	28	-32.6	0	0	0	109.3	S362	P360-S362 PolarHBondContact O-N 3.5Å
361	S	28.6	Very low	34.3	Very low	120 Å²	120	151.3 Å²	151.3	84%	0.839	80%	0.797	S	S	*	*			trans	-72.3	98.2	-179.9	54.9	0	0	0	0	111.1	L359	L359-S361 PolarHBondContact O-N 3.04Å
362	S	29	Very low	32.8	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	79%	0.792	S	S	*	*			trans	-68.3	146	169.9	-83.6	0	0	0	0	111.8	P360	P360-S362 PolarHBondContact O-N 3.5Å
363	P	38.7	Very low	32.1	Very low	123 Å²	123	148.1 Å²	148.1	80%	0.799	79%	0.788	S	S	*	*			trans	-73.9	148	-168.6	30	-36.3	0	0	0	112.8
364	R	30.3	Very low	32	Very low	249 Å²	249	148 Å²	148	94%	0.94	79%	0.794	S	S	*	*			trans	-118.3	112.2	159.3	-80.1	-172.3	170.4	167.6	-0.8	109.9
365	S	27.6	Very low	32.1	Very low	100 Å²	100	142.6 Å²	142.6	70%	0.699	78%	0.783	S	S	*	*			trans	-71	147.5	170.2	41.9	0	0	0	0	111.2
366	N	29	Very low	32.5	Very low	168 Å²	168	137.8 Å²	137.8	90%	0.898	78%	0.776	S	S	*	*			trans	-118.4	98.7	153.3	-87.1	-19	0	0	0	106.9
367	T	33.5	Very low	33	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	77%	0.769	S	S	*	*			trans	-80.8	154.9	172.8	-15.6	0	0	0	0	110.3
368	P	29.9	Very low	33.8	Very low	109 Å²	109	136.5 Å²	136.5	71%	0.708	77%	0.771	S	S	*	*			trans	-138.8	135.8	130.7	34.9	-22.5	0	0	0	114.3
369	M	27.8	Very low	34.4	Very low	191 Å²	191	137.8 Å²	137.8	94%	0.941	77%	0.773	S	S	*	*			trans	65	139.1	157.3	-66.1	166.9	51.8	0	0	119.6
370	G	29.7	Very low	35	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	77%	0.769	S	S	*	*			trans	154.8	92.5	173.3	0	0	0	0	0	111
371	D	31.5	Very low	35.4	Very low	155 Å²	155	136 Å²	136	83%	0.829	77%	0.769	S	S	*	*			trans	-69.8	144.9	176.1	-48.5	-68.1	0	0	0	111.1
372	K	34.4	Very low	35.9	Very low	170 Å²	170	137.1 Å²	137.1	74%	0.739	76%	0.761	S	S	*	*				167.8	130.8	112.6	-90.7	-178.7	160.9	-90.9	0	114.6
373	D	34.7	Very low	36.4	Very low	108 Å²	108	138.6 Å²	138.6	58%	0.578	75%	0.754	S	S	*	*				57.9	134.2	121.2	-47.2	-9.7	0	0	0	121.9
374	D	39	Very low	36.2	Very low	137 Å²	137	139.8 Å²	139.8	73%	0.733	75%	0.751	S	S	*	*			trans	90.5	127	142	-57.7	-12.3	0	0	0	123.5
375	D	38.5	Very low	36.1	Very low	129 Å²	129	136.7 Å²	136.7	69%	0.69	75%	0.747	S	S	*	*			trans	75.9	99.2	139.2	-56.8	0.6	0	0	0	123.6
376	D	44.2	Very low	36.1	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	75%	0.747	S	S	*	*				83.6	144	109	-66.7	-2.6	0	0	0	125.9
377	D	45.4	Very low	36.1	Very low	131 Å²	131	134.4 Å²	134.4	70%	0.701	74%	0.744	S	S	*	*			trans	71.8	96.3	143.2	-67.4	6	0	0	0	123.8
378	D	43.1	Very low	35.7	Very low	140 Å²	140	132.3 Å²	132.3	75%	0.749	75%	0.747	S	S	*	*				82.4	152.1	109.8	-84.1	-6.7	0	0	0	124.8
379	D	46.7	Very low	35.7	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	75%	0.752	S	S	*	*			trans	63.1	137.1	159.4	-78.1	-14.7	0	0	0	120.7
380	A	43.3	Very low	36.1	Very low	85 Å²	85	130.9 Å²	130.9	70%	0.702	74%	0.742	S	S	*	*			cis	-162.9	172.1	-9.3	0	0	0	0	0	112.5
381	D	38.7	Very low	35.9	Very low	145 Å²	145	135 Å²	135	78%	0.775	75%	0.746	S	S	*	*			trans	-39.5	163	165.9	-86.5	-67.9	0	0	0	116.7
382	E	39.9	Very low	35.6	Very low	143 Å²	143	131.1 Å²	131.1	67%	0.668	74%	0.743	S	S	*	*			cis	-150	144.2	42.1	-83.7	-165.8	141.4	0	0	115.8
383	K	38.5	Very low	35.1	Very low	140 Å²	140	126.6 Å²	126.6	61%	0.609	75%	0.745	S	S	*	*			trans	55.3	148	132	-61.4	171.2	-175.4	161.8	0	120.2
384	M	33.8	Very low	34.8	Very low	149 Å²	149	130.7 Å²	130.7	73%	0.734	76%	0.76	S	S	*	*			cis	-157.1	134.6	0.5	-120.8	162.5	-177.6	0	0	105.7
385	Q	29.9	Very low	34.2	Very low	184 Å²	184	132 Å²	132	86%	0.86	77%	0.765	S	S	*	*				46	137.7	74.3	-63.3	-168.7	6	0	0	113.9
386	S	26.8	Very low	33.5	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	77%	0.767	S	S	*	*			cis	-151.4	138.9	20.7	65.5	0	0	0	0	110
387	S	29.1	Very low	32.5	Very low	120 Å²	120	136.6 Å²	136.6	84%	0.839	77%	0.77	S	S	*	*				83	129	77.4	91.8	0	0	0	0	115.8
388	G	24.8	Very low	31.4	Very low	80 Å²	80	136 Å²	136	83%	0.825	76%	0.763	S	S	*	*			trans	178.6	79.6	176.3	0	0	0	0	0	115
389	I	29	Very low	30.6	Very low	156 Å²	156	134.9 Å²	134.9	80%	0.8	77%	0.767	S	S	*	*			trans	-116.2	139	-178.7	-75.4	173.2	0	0	0	106.4
390	P	36.9	Very low	29.5	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	77%	0.768	S	S	*	*				-156.4	157	79.3	41.4	-20.4	0	0	0	121
391	N	25.9	Very low	28.6	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	78%	0.778	S	S	*	*			trans	50.3	137.5	147.8	-73	-9.8	0	0	0	122.4
392	G	25	Very low	27.9	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	78%	0.779	S	S	*	*			cis	160.2	-178.3	-6	0	0	0	0	0	114.4
393	G	23.8	Very low	27.1	Very low	75 Å²	75	141 Å²	141	77%	0.773	78%	0.783	S	S	*	*			trans	108	82.1	165.5	0	0	0	0	0	116.3
394	H	28.3	Very low	26.4	Very low	193 Å²	193	143.5 Å²	143.5	89%	0.894	80%	0.796	S	S	*	*			trans	-148.1	156	142	-137.6	-86.3	0	0	0	112.2
395	I	26	Very low	26	Very low	164 Å²	164	142.3 Å²	142.3	84%	0.841	80%	0.798	S	S	*	*			trans	-92.3	150.8	-169.6	-67	165.5	0	0	0	111.4
396	R	24.2	Very low	25.7	Very low	191 Å²	191	140.3 Å²	140.3	72%	0.721	79%	0.793	S	S	*	*			trans	-96.2	162.7	-174.6	162.3	-177.7	171.5	178.4	3.5	112.3	E398	R396-E398 IonicContact CZ-OE1 3.72Å; R396-E398 IonicContact CZ-OE2 3.19Å; R396-E398 IonicContact NE-OE1 3.81Å; R396-E398 IonicContact NE-OE2 2.7Å; R396-E398 PolarHBondContact NE-OE2 3.38Å; R396-E398 IonicContact NH2-OE1 2.83Å; R396-E398 PolarHBondContact NH2-OE1 3.18Å; R396-E398 IonicContact NH2-OE2 2.86Å; R396-E398 PolarHBondContact NH2-OE2 3.42Å
397	Q	24.4	Very low	25.7	Very low	170 Å²	170	143.8 Å²	143.8	79%	0.794	80%	0.798	S	S	*	*			trans	135.4	96.5	145.5	-157.9	164.7	13	0	0	109.6
398	E	21.3	Very low	25.5	Very low	118 Å²	118	141.6 Å²	141.6	55%	0.551	79%	0.794	S	S	*	*				69.3	94.4	84.4	-72.4	163.8	125.4	0	0	114.7	R396	R396-E398 IonicContact CZ-OE1 3.72Å; R396-E398 IonicContact CZ-OE2 3.19Å; R396-E398 IonicContact NE-OE1 3.81Å; R396-E398 IonicContact NE-OE2 2.7Å; R396-E398 PolarHBondContact NE-OE2 3.38Å; R396-E398 IonicContact NH2-OE1 2.83Å; R396-E398 PolarHBondContact NH2-OE1 3.18Å; R396-E398 IonicContact NH2-OE2 2.86Å; R396-E398 PolarHBondContact NH2-OE2 3.42Å
399	S	25.7	Very low	25.5	Very low	118 Å²	118	144.7 Å²	144.7	83%	0.825	79%	0.791	S	S	*	*			trans	46.5	116.7	131.8	-48.2	0	0	0	0	121.1
400	Q	24.2	Very low	25.3	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	79%	0.791	S	S	*	*				-153.3	123.7	129.1	-122.6	167.9	-9.3	0	0	111.8
401	E	23.6	Very low	24.8	Very low	196 Å²	196	146.8 Å²	146.8	92%	0.916	79%	0.785	S	S	*	*			trans	-90.6	134.6	165.6	-65.5	174	121.3	0	0	108.3
402	Q	24.8	Very low	24.9	Very low	167 Å²	167	146.9 Å²	146.9	78%	0.78	78%	0.783	S	S	*	*			trans	-141.5	101.7	171.2	-117	178.1	-6.6	0	0	111.2	E404	Q402-E404 PolarHBondContact O-N 2.87Å
403	S	23	Very low	25	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	77%	0.767	S	S	*	*			trans	7.4	101.2	154.2	55.9	0	0	0	0	117.9
404	E	23.8	Very low	25.1	Very low	193 Å²	193	147.6 Å²	147.6	90%	0.902	76%	0.761	S	S	*	*			trans	-77.1	140.9	149.8	-68.6	-172.6	135.5	0	0	109.6	Q402	Q402-E404 PolarHBondContact O-N 2.87Å
405	V	25.5	Very low	25.1	Very low	125 Å²	125	145.7 Å²	145.7	76%	0.758	75%	0.752	S	S	*	*			trans	-96.1	98.4	176.5	-179	0	0	0	0	108.1	H407	V405-H407 PolarHBondContact O-N 3.24Å
406	D	22.6	Very low	25.3	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	73%	0.733	S	S	*	*			trans	-70.2	113.8	-176.6	-173.2	18.5	0	0	0	111.6	G408	D406-G408 VanDerWaalsContact C-N 3.28Å; D406-G408 PolarHBondContact O-N 3.5Å
407	H	26.9	Very low	25.8	Very low	173 Å²	173	134.5 Å²	134.5	80%	0.801	71%	0.712	S	S	*	*			trans	-75.5	83.1	170.5	-85.9	-85.5	0	0	0	109.3	V405 D409	V405-H407 PolarHBondContact O-N 3.24Å; H407-D409 VanDerWaalsContact C-N 3.33Å; H407-D409 PolarHBondContact O-N 3.17Å
408	G	25.7	Very low	26.2	Very low	73 Å²	73	131.8 Å²	131.8	75%	0.753	71%	0.707	S	S	*	*			trans	-67.3	76.9	-173.2	0	0	0	0	0	115.8	D406	D406-G408 VanDerWaalsContact C-N 3.28Å; D406-G408 PolarHBondContact O-N 3.5Å
409	D	25.1	Very low	26.7	Very low	146 Å²	146	130.4 Å²	130.4	78%	0.781	70%	0.703	S	S	*	*			trans	-136.5	117.8	151.3	-163	4.9	0	0	0	109.9	H407	H407-D409 VanDerWaalsContact C-N 3.33Å; H407-D409 PolarHBondContact O-N 3.17Å
410	F	24.8	Very low	26.7	Very low	179 Å²	179	132 Å²	132	79%	0.785	70%	0.697	S	S	*	*			trans	-142.8	79.1	-177.3	-136	-73.7	0	0	0	110.8	M412	F410-M412 VanDerWaalsContact C-N 3.31Å; F410-M412 HydrophobicContact CD1-CG 3.84Å; F410-M412 HydrophobicContact CE1-CG 4.28Å; F410-M412 PolarHBondContact O-N 3.02Å
411	E	26.5	Very low	26.8	Very low	133 Å²	133	129.5 Å²	129.5	62%	0.621	70%	0.695	S	S	*	*			trans	-63.4	88.5	169.1	-172	-176.9	-172.5	0	0	109.6	V413 R750	E411-V413 HydrophobicContact CG-CB 4.08Å; E411-V413 HydrophobicContact CG-CG2 3.72Å; E411-V413 PolarHBondContact O-N 2.95Å; E411-V413 VanDerWaalsContact OE1-CG2 3.25Å; E411-V413 WeakPolarHBondContact OE1-CG2 3.02Å; E411-R750 IonicContact OE1-CZ 3.11Å; E411-R750 IonicContact OE1-NH1 3.36Å; E411-R750 PolarHBondContact OE1-NH1 3.42Å; E411-R750 IonicContact OE1-NH2 3.97Å
412	M	28.5	Very low	26.9	Very low	163 Å²	163	124.9 Å²	124.9	80%	0.803	69%	0.69	S	S	*	*			trans	-72.2	54	169.7	-80.5	-154.6	-72.3	0	0	112.5	F410 S414	F410-M412 VanDerWaalsContact C-N 3.31Å; F410-M412 HydrophobicContact CD1-CG 3.84Å; F410-M412 HydrophobicContact CE1-CG 4.28Å; F410-M412 PolarHBondContact O-N 3.02Å; M412-S414 PolarHBondContact O-N 3Å
413	V	25.6	Very low	26.9	Very low	73 Å²	73	125.5 Å²	125.5	44%	0.442	69%	0.693	S	S	.	*			trans	-81.8	97.7	156.2	170.9	0	0	0	0	107	E411 E415	E411-V413 HydrophobicContact CG-CB 4.08Å; E411-V413 HydrophobicContact CG-CG2 3.72Å; E411-V413 PolarHBondContact O-N 2.95Å; E411-V413 VanDerWaalsContact OE1-CG2 3.25Å; E411-V413 WeakPolarHBondContact OE1-CG2 3.02Å; V413-E415 PolarHBondContact O-N 2.97Å; V413-E415 VanDerWaalsContact O-N 3.1Å
414	S	27.6	Very low	27	Very low	92 Å²	92	128 Å²	128	64%	0.643	70%	0.698	S	S	*	*			trans	-67.5	106.8	170.7	-68.4	0	0	0	0	110	M412 S416	M412-S414 PolarHBondContact O-N 3Å; S414-S416 PolarHBondContact O-N 2.91Å
415	E	27.4	Very low	27.1	Very low	154 Å²	154	125.3 Å²	125.3	72%	0.72	69%	0.694	S	S	*	*			trans	-67.1	74.3	161.2	-74.3	-156.7	123.1	0	0	110.1	V413	V413-E415 PolarHBondContact O-N 2.97Å; V413-E415 VanDerWaalsContact O-N 3.1Å
416	S	30	Very low	27	Very low	62 Å²	62	126.7 Å²	126.7	43%	0.434	70%	0.698	S	S	.	*			trans	-132.5	45.5	-179.8	-155.3	0	0	0	0	111.2	S414	S414-S416 PolarHBondContact O-N 2.91Å
417	M	34.8	Very low	27.3	Very low	57 Å²	57	127.6 Å²	127.6	28%	0.281	70%	0.702	S	S	.	*	S	Bend	trans	-98.5	-7.8	155.1	-60.6	-168.6	99.7	0	0	112.3	P746 L749	M417-P746 WeakPolarHBondContact CE-O 3.37Å; M417-L749 HydrophobicContact CB-CD1 4.2Å; M417-L749 HydrophobicContact CB-CD2 4Å; M417-L749 HydrophobicContact CB-CG 4.15Å; M417-L749 HydrophobicContact CG-CD2 4.08Å; M417-L749 HydrophobicContact CG-CG 4.4Å; M417-L749 HydrophobicContact SD-CD2 3.87Å; M417-L749 HydrophobicContact SD-CG 3.78Å
418	V	31.8	Very low	27.2	Very low	113 Å²	113	122.8 Å²	122.8	69%	0.685	70%	0.699	S	S	*	*	S	Bend	trans	-88.1	134.2	163.3	-177.1	0	0	0	0	108.1	E420	V418-E420 PolarHBondContact O-N 2.81Å
419	L	31.8	Very low	27.2	Very low	89 Å²	89	127.1 Å²	127.1	47%	0.466	71%	0.705	S	S	.	*			trans	-84.5	112.3	180	-82.5	155.3	0	0	0	110.5	T421 K820	L419-T421 PolarHBondContact O-N 2.71Å; L419-K820 HydrophobicContact CD1-CD 4.17Å
420	E	27	Very low	27.3	Very low	152 Å²	152	125.3 Å²	125.3	71%	0.71	70%	0.701	S	S	*	*			trans	-48.3	133.1	173.2	-66.7	165.8	160.9	0	0	111.8	V418	V418-E420 PolarHBondContact O-N 2.81Å
421	T	25.7	Very low	27.6	Very low	130 Å²	130	120.6 Å²	120.6	80%	0.798	69%	0.691	S	S	*	*			trans	-95.4	132.3	168.5	41.2	0	0	0	0	109.4	L419	L419-T421 PolarHBondContact O-N 2.71Å
422	A	25.6	Very low	27.8	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	70%	0.7	S	S	*	*			trans	-120.4	95.8	178.9	0	0	0	0	0	110.9
423	E	24.3	Very low	28	Very low	180 Å²	180	117.7 Å²	117.7	84%	0.841	69%	0.689	S	S	*	*			trans	-161.2	139.8	155.3	-107.4	157.2	-158	0	0	106.1
424	N	25.8	Very low	28.7	Very low	159 Å²	159	121.4 Å²	121.4	85%	0.85	70%	0.701	S	S	*	*			trans	-121.6	88.5	-145.8	-174.8	96.4	0	0	0	113.9
425	V	25.5	Very low	29.2	Very low	137 Å²	137	121.3 Å²	121.3	83%	0.83	71%	0.706	S	S	*	*			trans	-144.1	109.6	175.7	-172.1	0	0	0	0	113.5
426	N	25	Very low	29.5	Very low	155 Å²	155	120.7 Å²	120.7	83%	0.829	71%	0.707	S	S	*	*			trans	63	157.5	154	-146.8	15.9	0	0	0	121.2
427	N	27.1	Very low	29.7	Very low	161 Å²	161	123.5 Å²	123.5	86%	0.861	72%	0.717	S	S	*	*			trans	-83.2	142.9	-169.5	-76.1	-7.6	0	0	0	115.1
428	G	24.6	Very low	29.9	Very low	71 Å²	71	125.4 Å²	125.4	73%	0.732	74%	0.741	S	S	*	*			trans	-177.4	122.7	162	0	0	0	0	0	112.4
429	N	26.1	Very low	30	Very low	165 Å²	165	123.5 Å²	123.5	88%	0.882	74%	0.744	S	S	*	*			trans	-77.1	131.9	177.1	-89.2	0.6	0	0	0	111.4
430	P	28.2	Very low	29.8	Very low	107 Å²	107	123 Å²	123	70%	0.695	75%	0.754	S	S	*	*			trans	-72.1	152	156.2	32.5	-32.5	0	0	0	110
431	S	31	Very low	30	Very low	81 Å²	81	125.7 Å²	125.7	57%	0.566	77%	0.766	S	S	*	*			trans	-108.5	161.2	-176.8	74.3	0	0	0	0	112.4	L433	S431-L433 PolarHBondContact O-N 2.85Å
432	P	31.1	Very low	30.4	Very low	124 Å²	124	122.6 Å²	122.6	81%	0.805	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	4.8	-172.9	-23.1	35.2	0	0	0	117
433	L	32.2	Very low	30.4	Very low	110 Å²	110	127.7 Å²	127.7	58%	0.576	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-31.7	-169.8	-149	75.3	0	0	0	113.8	S431 A435 L436 L437	S431-L433 PolarHBondContact O-N 2.85Å; L433-A435 PolarHBondContact O-N 3.15Å; L433-L436 WeakPolarHBondContact O-CB 3.36Å; L433-L436 PolarHBondContact O-N 3.21Å; L433-L437 HydrophobicContact CD2-CD1 4.47Å; L433-L437 HydrophobicContact CG-CD1 4.48Å; L433-L437 PolarHBondContact O-N 3.16Å
434	E	39.3	Very low	30.6	Very low	151 Å²	151	124.2 Å²	124.2	71%	0.706	76%	0.757	S	S	*	*	H	α-helix	trans	-61.1	-32.9	179.7	-66.4	-171.8	123.1	0	0	112.4	L436 L437 A438	E434-L436 PolarHBondContact O-N 3.4Å; E434-L437 PolarHBondContact O-N 3.39Å; E434-A438 PolarHBondContact O-N 3.12Å
435	A	38	Very low	31	Very low	90 Å²	90	123 Å²	123	74%	0.744	76%	0.758	S	S	*	*	H	α-helix	trans	-68.8	-17.1	177.3	0	0	0	0	0	113.7	L433	L433-A435 PolarHBondContact O-N 3.15Å
436	L	34.2	Very low	31.3	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	76%	0.761	S	S	*	*	H	α-helix	trans	-92.9	-32.1	176.8	-143.8	79.7	0	0	0	112.2	L433 E434	L433-L436 WeakPolarHBondContact O-CB 3.36Å; L433-L436 PolarHBondContact O-N 3.21Å; E434-L436 PolarHBondContact O-N 3.4Å
437	L	34.6	Very low	31.9	Very low	121 Å²	121	125.5 Å²	125.5	63%	0.634	76%	0.762	S	S	*	*	H	α-helix	trans	-75.8	-22.4	-178.4	-77.6	158.8	0	0	0	113.4	L433 E434 G439	L433-L437 HydrophobicContact CD2-CD1 4.47Å; L433-L437 HydrophobicContact CG-CD1 4.48Å; L433-L437 PolarHBondContact O-N 3.16Å; E434-L437 PolarHBondContact O-N 3.39Å; L437-G439 PolarHBondContact O-N 3.23Å
438	A	38.7	Very low	32.4	Very low	96 Å²	96	125.4 Å²	125.4	79%	0.793	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	6.4	175	0	0	0	0	0	115.1	E434	E434-A438 PolarHBondContact O-N 3.12Å
439	G	33.8	Very low	32.9	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	10.4	-177.7	0	0	0	0	0	115.7	L437	L437-G439 PolarHBondContact O-N 3.23Å
440	A	27.3	Very low	33.6	Very low	80 Å²	80	123 Å²	123	66%	0.661	74%	0.735	S	S	*	*			trans	-138.7	99.2	-177.3	0	0	0	0	0	112.7
441	E	32.9	Very low	34.5	Very low	208 Å²	208	123.1 Å²	123.1	97%	0.972	74%	0.735	S	S	*	*			trans	-74.2	120.9	169.2	-63.4	176.8	156.2	0	0	109.4
442	G	33.8	Very low	35.4	Very low	65 Å²	65	121 Å²	121	67%	0.67	72%	0.718	S	S	*	*			trans	169.9	20.3	-176.4	0	0	0	0	0	119.5
443	F	25	Very low	36.2	Very low	206 Å²	206	117.2 Å²	117.2	90%	0.904	70%	0.697	S	S	*	*	S	Bend	trans	-137.2	150.4	171.7	-84.8	-86.4	0	0	0	111.2
444	P	29.4	Very low	37.1	Very low	106 Å²	106	117.2 Å²	117.2	69%	0.688	70%	0.698	S	S	*	*			trans	-70.1	159.5	-177.3	30.5	-35.8	0	0	0	112.2	M446	P444-M446 PolarHBondContact O-N 3.25Å; P444-M446 VanDerWaalsContact O-N 3.11Å
445	P	33.3	Very low	37.9	Very low	135 Å²	135	116.8 Å²	116.8	88%	0.877	70%	0.7	S	S	*	*			trans	-63	114.8	-177.2	25.6	-34.6	0	0	0	111.6
446	M	32.7	Very low	38.6	Very low	181 Å²	181	120.2 Å²	120.2	89%	0.892	70%	0.701	S	S	*	*			trans	-77.8	131.8	171.7	-171.2	166.8	64.1	0	0	109.3	P444 D448	P444-M446 PolarHBondContact O-N 3.25Å; P444-M446 VanDerWaalsContact O-N 3.11Å; M446-D448 PolarHBondContact O-N 3.14Å
447	L	36.8	Very low	39.8	Very low	162 Å²	162	116.7 Å²	116.7	85%	0.848	69%	0.685	S	S	*	*			trans	-24.6	115.9	-173.4	-78.2	151.6	0	0	0	116	I449	L447-I449 PolarHBondContact O-N 3.35Å
448	D	38.3	Very low	41	Very low	159 Å²	159	116.7 Å²	116.7	85%	0.85	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-73.4	116.7	174.3	-165.7	12.4	0	0	0	110.1	M446	M446-D448 PolarHBondContact O-N 3.14Å
449	I	35.6	Very low	42.2	Very low	112 Å²	112	116.1 Å²	116.1	57%	0.574	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-99.5	119.6	-179.8	-59.9	179.2	0	0	0	108.6	L447	L447-I449 PolarHBondContact O-N 3.35Å
450	P	40.5	Very low	43.6	Very low	75 Å²	75	118.9 Å²	118.9	49%	0.487	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-57	130.8	178.7	-27.6	35.7	0	0	0	112.6	D452 A453	P450-D452 PolarHBondContact O-N 2.96Å; P450-A453 PolarHBondContact O-N 3.27Å
451	P	47.3	Very low	44.9	Very low	108 Å²	108	119.4 Å²	119.4	70%	0.701	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	29.7	-179.7	34.7	-38.1	0	0	0	113.1
452	D	49.8	Very low	46.4	Very low	38 Å²	38	112 Å²	112	20%	0.203	63%	0.628	C	S	.	*	T	Hydrogen-bonded Turn	trans	-138.6	29.4	171.9	37.9	37.6	0	0	0	112.1	P450 D454 R836 Q893 R894	P450-D452 PolarHBondContact O-N 2.96Å; D452-D454 PolarHBondContact O-N 2.76Å; D452-R836 IonicContact OD2-CZ 3.46Å; D452-R836 IonicContact OD2-NH1 3.11Å; D452-R836 IonicContact OD2-NH2 2.88Å; D452-R836 PolarHBondContact OD2-NH2 3.22Å; D452-Q893 PolarHBondContact OD1-NE2 3.05Å; D452-R894 IonicContact OD2-NH2 2.66Å; D452-R894 PolarHBondContact OD2-NH2 3.47Å
453	A	47.9	Very low	48.1	Very low	44 Å²	44	113.2 Å²	113.2	36%	0.364	62%	0.619	S	S	.	*			trans	-60.2	116.6	152.2	0	0	0	0	0	109.4	P450 M458	P450-A453 PolarHBondContact O-N 3.27Å; A453-M458 HydrophobicContact CB-CG 4.29Å
454	D	50	Low	49.6	Very low	110 Å²	110	105.5 Å²	105.5	59%	0.588	59%	0.593	S	S	*	*			trans	-67.9	162.1	173.7	-72	-53	0	0	0	110.8	D452 E456 T457 M458	D452-D454 PolarHBondContact O-N 2.76Å; D454-E456 PolarHBondContact O-N 3.23Å; D454-T457 PolarHBondContact N-OG1 3.46Å; D454-T457 VanDerWaalsContact N-OG1 3.14Å; D454-T457 PolarHBondContact O-N 3.31Å; D454-T457 PolarHBondContact O-OG1 3.21Å; D454-M458 PolarHBondContact O-N 3.05Å; D454-M458 VanDerWaalsContact O-N 3.08Å
455	D	55.4	Low	50.9	Low	142 Å²	142	105.2 Å²	105.2	76%	0.759	59%	0.585	S	S	*	*	H	α-helix	trans	-53.9	-30.8	-178.9	-62.8	-43.9	0	0	0	112.5	V459	D455-V459 WeakPolarHBondContact O-CB 3.42Å; D455-V459 VanDerWaalsContact O-CG2 3.26Å; D455-V459 WeakPolarHBondContact O-CG2 3.26Å; D455-V459 PolarHBondContact O-N 3.44Å
456	E	53	Low	52.2	Low	162 Å²	162	102.2 Å²	102.2	76%	0.757	57%	0.568	S	S	*	*	H	α-helix	trans	-66.1	-41.2	174.9	-63.3	-176.1	156.8	0	0	112.7	D454 V459 E460	D454-E456 PolarHBondContact O-N 3.23Å; E456-V459 PolarHBondContact O-N 2.94Å; E456-E460 WeakPolarHBondContact O-CG 3.4Å; E456-E460 PolarHBondContact O-N 3Å
457	T	60.4	Low	52.9	Low	67 Å²	67	99 Å²	99	41%	0.411	55%	0.554	S	S	.	*	H	α-helix	trans	-77.1	-30.1	177.8	32.1	0	0	0	0	112.5	D454 V459 L461	D454-T457 PolarHBondContact N-OG1 3.46Å; D454-T457 VanDerWaalsContact N-OG1 3.14Å; D454-T457 PolarHBondContact O-N 3.31Å; D454-T457 PolarHBondContact O-OG1 3.21Å; T457-V459 VanDerWaalsContact C-N 3.34Å; T457-L461 WeakPolarHBondContact O-CB 3.46Å; T457-L461 PolarHBondContact O-N 3.35Å
458	M	58.5	Low	53.4	Low	121 Å²	121	98.4 Å²	98.4	60%	0.596	55%	0.546	S	S	*	.	H	α-helix	trans	-62.7	-41	168.2	-73.8	-88.5	-75.8	0	0	111.5	A453 D454 A462	A453-M458 HydrophobicContact CB-CG 4.29Å; D454-M458 PolarHBondContact O-N 3.05Å; D454-M458 VanDerWaalsContact O-N 3.08Å; M458-A462 WeakPolarHBondContact O-CB 3.28Å; M458-A462 PolarHBondContact O-N 3.36Å
459	V	65.6	Low	53.7	Low	84 Å²	84	98.9 Å²	98.9	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-69.3	-43.9	175.4	166.1	0	0	0	0	111.8	D455 E456 T457 L461 A462 I463	D455-V459 WeakPolarHBondContact O-CB 3.42Å; D455-V459 VanDerWaalsContact O-CG2 3.26Å; D455-V459 WeakPolarHBondContact O-CG2 3.26Å; D455-V459 PolarHBondContact O-N 3.44Å; E456-V459 PolarHBondContact O-N 2.94Å; T457-V459 VanDerWaalsContact C-N 3.34Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 3.17Å; V459-A462 PolarHBondContact O-N 2.87Å; V459-I463 HydrophobicContact CG1-CD1 3.7Å; V459-I463 HydrophobicContact CG1-CG1 4.41Å; V459-I463 WeakPolarHBondContact O-CB 3.45Å; V459-I463 VanDerWaalsContact O-CG1 3.27Å; V459-I463 WeakPolarHBondContact O-CG1 3.47Å; V459-I463 PolarHBondContact O-N 3.29Å
460	E	61.2	Low	53.7	Low	131 Å²	131	100.5 Å²	100.5	61%	0.612	55%	0.553	S	S	*	*	H	α-helix	trans	-60.3	-41.1	175.3	-76	-175.3	158.5	0	0	112.2	E456 I463 A464	E456-E460 WeakPolarHBondContact O-CG 3.4Å; E456-E460 PolarHBondContact O-N 3Å; E460-I463 PolarHBondContact O-N 2.79Å; E460-A464 WeakPolarHBondContact O-CB 3.3Å; E460-A464 PolarHBondContact O-N 2.77Å
461	L	56.3	Low	53.5	Low	91 Å²	91	105 Å²	105	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-68.7	-38.4	177	-164.1	71.1	0	0	0	112.1	T457 V459 I463 A464 L465	T457-L461 WeakPolarHBondContact O-CB 3.46Å; T457-L461 PolarHBondContact O-N 3.35Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 3.17Å; L461-I463 VanDerWaalsContact C-N 3.35Å; L461-A464 PolarHBondContact O-N 3.04Å; L461-L465 HydrophobicContact CG-CD1 4.39Å; L461-L465 WeakPolarHBondContact O-CB 3.43Å; L461-L465 WeakPolarHBondContact O-CG 3.4Å; L461-L465 PolarHBondContact O-N 3.18Å
462	A	64.3	Low	52.6	Low	52 Å²	52	109 Å²	109	43%	0.43	58%	0.577	S	S	.	*	H	α-helix	trans	-65.2	-37.4	173.7	0	0	0	0	0	112.3	M458 V459 S466	M458-A462 WeakPolarHBondContact O-CB 3.28Å; M458-A462 PolarHBondContact O-N 3.36Å; V459-A462 PolarHBondContact O-N 2.87Å; A462-S466 WeakPolarHBondContact O-CB 3.35Å; A462-S466 PolarHBondContact O-N 2.95Å; A462-S466 PolarHBondContact O-OG 3.01Å
463	I	68.3	Low	51.6	Low	92 Å²	92	111.8 Å²	111.8	47%	0.472	61%	0.605	S	S	.	*	H	α-helix	trans	-66.4	-44.2	173.1	-70.5	165.7	0	0	0	110.5	V459 E460 L461 S466 L467	V459-I463 HydrophobicContact CG1-CD1 3.7Å; V459-I463 HydrophobicContact CG1-CG1 4.41Å; V459-I463 WeakPolarHBondContact O-CB 3.45Å; V459-I463 VanDerWaalsContact O-CG1 3.27Å; V459-I463 WeakPolarHBondContact O-CG1 3.47Å; V459-I463 PolarHBondContact O-N 3.29Å; E460-I463 PolarHBondContact O-N 2.79Å; L461-I463 VanDerWaalsContact C-N 3.35Å; I463-S466 PolarHBondContact O-N 3.18Å; I463-L467 HydrophobicContact CG2-CD1 3.8Å; I463-L467 HydrophobicContact CG2-CG 4.39Å; I463-L467 WeakPolarHBondContact O-CB 3.48Å; I463-L467 VanDerWaalsContact O-CG 3.29Å; I463-L467 WeakPolarHBondContact O-CG 3.28Å; I463-L467 PolarHBondContact O-N 3.36Å
464	A	58.3	Low	50.9	Low	44 Å²	44	115.4 Å²	115.4	36%	0.364	63%	0.625	S	S	.	*	H	α-helix	trans	-61.3	-45	177.5	0	0	0	0	0	112.3	E460 L461 L467 Q468	E460-A464 WeakPolarHBondContact O-CB 3.3Å; E460-A464 PolarHBondContact O-N 2.77Å; L461-A464 PolarHBondContact O-N 3.04Å; A464-L467 PolarHBondContact O-N 3.16Å; A464-Q468 WeakPolarHBondContact O-CG 3.32Å; A464-Q468 PolarHBondContact O-N 2.9Å
465	L	56.5	Low	49.8	Very low	99 Å²	99	114.6 Å²	114.6	52%	0.518	63%	0.634	S	S	.	*	H	α-helix	trans	-64.7	-40.3	175.7	-73.2	166.2	0	0	0	112.1	L461 Q468 Q469	L461-L465 HydrophobicContact CG-CD1 4.39Å; L461-L465 WeakPolarHBondContact O-CB 3.43Å; L461-L465 WeakPolarHBondContact O-CG 3.4Å; L461-L465 PolarHBondContact O-N 3.18Å; L465-Q468 PolarHBondContact O-N 3.33Å; L465-Q469 PolarHBondContact O-N 3.3Å; L465-Q469 VanDerWaalsContact O-N 3.14Å
466	S	59.9	Low	48.4	Very low	73 Å²	73	112.8 Å²	112.8	51%	0.51	63%	0.632	S	S	.	*	H	α-helix	trans	-62.6	-42.6	175.1	-57.2	0	0	0	0	111.6	A462 I463 Q468 Q469 D470	A462-S466 WeakPolarHBondContact O-CB 3.35Å; A462-S466 PolarHBondContact O-N 2.95Å; A462-S466 PolarHBondContact O-OG 3.01Å; I463-S466 PolarHBondContact O-N 3.18Å; S466-Q468 VanDerWaalsContact C-N 3.28Å; S466-Q468 PolarHBondContact O-N 2.77Å; S466-Q469 WeakPolarHBondContact O-CB 3.43Å; S466-Q469 PolarHBondContact O-N 3.49Å; S466-Q469 VanDerWaalsContact O-N 3.12Å; S466-D470 PolarHBondContact O-N 3.13Å
467	L	46.7	Very low	47.3	Very low	114 Å²	114	112.6 Å²	112.6	60%	0.597	64%	0.637	S	S	*	*	H	α-helix	trans	-67.5	-25.1	176.5	-72.7	169.1	0	0	0	113.4	I463 A464	I463-L467 HydrophobicContact CG2-CD1 3.8Å; I463-L467 HydrophobicContact CG2-CG 4.39Å; I463-L467 WeakPolarHBondContact O-CB 3.48Å; I463-L467 VanDerWaalsContact O-CG 3.29Å; I463-L467 WeakPolarHBondContact O-CG 3.28Å; I463-L467 PolarHBondContact O-N 3.36Å; A464-L467 PolarHBondContact O-N 3.16Å
468	Q	47.8	Very low	45.8	Very low	148 Å²	148	117.3 Å²	117.3	69%	0.692	66%	0.659	S	S	*	*	H	α-helix	trans	-78.2	-24.4	171.3	-73.7	-177.3	-56.1	0	0	113	A464 L465 S466	A464-Q468 WeakPolarHBondContact O-CG 3.32Å; A464-Q468 PolarHBondContact O-N 2.9Å; L465-Q468 PolarHBondContact O-N 3.33Å; S466-Q468 VanDerWaalsContact C-N 3.28Å; S466-Q468 PolarHBondContact O-N 2.77Å
469	Q	44.5	Very low	44.7	Very low	169 Å²	169	120.3 Å²	120.3	79%	0.79	67%	0.672	S	S	*	*	H	α-helix	trans	-76.1	-30.6	179.7	-160.1	100.6	47.3	0	0	112.6	L465 S466 Q471	L465-Q469 PolarHBondContact O-N 3.3Å; L465-Q469 VanDerWaalsContact O-N 3.14Å; S466-Q469 WeakPolarHBondContact O-CB 3.43Å; S466-Q469 PolarHBondContact O-N 3.49Å; S466-Q469 VanDerWaalsContact O-N 3.12Å; Q469-Q471 VanDerWaalsContact C-N 3.32Å; Q469-Q471 PolarHBondContact O-N 2.95Å
470	D	36.3	Very low	43	Very low	146 Å²	146	119.1 Å²	119.1	78%	0.781	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	9.5	-175.4	-93	-16.2	0	0	0	115.2	S466	S466-D470 PolarHBondContact O-N 3.13Å
471	Q	36	Very low	41.6	Very low	170 Å²	170	118.1 Å²	118.1	79%	0.794	68%	0.684	S	S	*	*	S	Bend	trans	-128.7	45.6	-179.6	-68.1	-160.7	8.1	0	0	115.8	Q469	Q469-Q471 VanDerWaalsContact C-N 3.32Å; Q469-Q471 PolarHBondContact O-N 2.95Å
472	Q	28.2	Very low	40.5	Very low	192 Å²	192	120 Å²	120	90%	0.897	70%	0.699	S	S	*	*			trans	-155.3	83.3	163.2	-123.9	162.1	23.3	0	0	117.7
473	A	28.6	Very low	38.8	Very low	96 Å²	96	121.5 Å²	121.5	79%	0.793	71%	0.712	S	S	*	*			trans	173.3	156.1	146.9	0	0	0	0	0	111.2
474	P	32.9	Very low	37	Very low	121 Å²	121	121.6 Å²	121.6	79%	0.786	73%	0.726	S	S	*	*			cis	-132.5	174.2	-16.7	39.3	-23.3	0	0	0	115.7
475	A	26.9	Very low	35.6	Very low	93 Å²	93	125.9 Å²	125.9	77%	0.769	75%	0.748	S	S	*	*			trans	85.9	148.5	146.9	0	0	0	0	0	123.4
476	S	26.8	Very low	34.3	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	77%	0.767	S	S	*	*			trans	62.8	93.4	158.7	61.6	0	0	0	0	122.1
477	D	29.2	Very low	33	Very low	158 Å²	158	128.4 Å²	128.4	85%	0.845	77%	0.768	S	S	*	*				44.4	146.6	110.6	-52.3	-26.1	0	0	0	124.2
478	D	30.1	Very low	32	Very low	166 Å²	166	128.6 Å²	128.6	89%	0.888	78%	0.779	S	S	*	*			trans	60.9	145.3	172.7	-87	-10.1	0	0	0	118.4
479	E	33.8	Very low	31.2	Very low	184 Å²	184	127.3 Å²	127.3	86%	0.86	78%	0.782	S	S	*	*			cis	-148.9	148.1	-12.6	178.5	-172.1	-159.9	0	0	106
480	G	30	Very low	30.5	Very low	58 Å²	58	125.1 Å²	125.1	60%	0.598	78%	0.775	S	S	*	*			cis	158.6	168	-1.2	0	0	0	0	0	110.5
481	S	33.2	Very low	30.2	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	78%	0.775	S	S	*	*			trans	65.7	138.9	179.5	-62.8	0	0	0	0	116.6
482	T	31.8	Very low	29.8	Very low	132 Å²	132	126.4 Å²	126.4	81%	0.81	78%	0.776	S	S	*	*			cis	-166.2	160.6	1.5	12.5	0	0	0	0	107.3
483	A	29.8	Very low	30.1	Very low	83 Å²	83	122.6 Å²	122.6	69%	0.686	77%	0.771	S	S	*	*			cis	-162.1	-177.4	-0.7	0	0	0	0	0	109.5
484	A	30.4	Very low	30.8	Very low	94 Å²	94	123.7 Å²	123.7	78%	0.777	77%	0.77	S	S	*	*			trans	73.8	121.1	152.6	0	0	0	0	0	118.1
485	T	29.2	Very low	30.6	Very low	134 Å²	134	122 Å²	122	82%	0.822	77%	0.766	S	S	*	*			cis	-149.9	130	-1.4	50.7	0	0	0	0	112
486	D	28.5	Very low	30.8	Very low	172 Å²	172	124 Å²	124	92%	0.92	76%	0.764	S	S	*	*			trans	-165.6	164.6	148.4	-149	-12.1	0	0	0	112.7
487	G	31.7	Very low	30.9	Very low	52 Å²	52	127.6 Å²	127.6	54%	0.536	77%	0.769	S	S	.	*			trans	72.6	102.5	144.5	0	0	0	0	0	121.9
488	S	26.4	Very low	30.7	Very low	118 Å²	118	123.9 Å²	123.9	83%	0.825	77%	0.768	S	S	*	*			trans	-174	123.6	143.2	-82.4	0	0	0	0	109.9
489	T	31.5	Very low	30.5	Very low	121 Å²	121	119.7 Å²	119.7	74%	0.742	76%	0.764	S	S	*	*			cis	90.4	148.9	18.9	-42.1	0	0	0	0	114.7
490	L	30	Very low	30.3	Very low	124 Å²	124	116.5 Å²	116.5	65%	0.649	76%	0.762	S	S	*	*			trans	82	149.4	175.3	-48.9	178.2	0	0	0	115.4
491	R	28.3	Very low	30.2	Very low	209 Å²	209	120.1 Å²	120.1	79%	0.789	77%	0.772	S	S	*	*			cis	-148.8	169.2	1.9	-125.4	154.9	-170.7	153.1	0.7	108.6
492	T	29.1	Very low	30.1	Very low	133 Å²	133	118 Å²	118	82%	0.816	77%	0.768	S	S	*	*				-172.4	152.3	72.4	42.1	0	0	0	0	112.6
493	S	33.3	Very low	30.4	Very low	112 Å²	112	116.4 Å²	116.4	78%	0.783	76%	0.762	S	S	*	*			trans	-113.2	169.5	147.2	-33	0	0	0	0	106.5
494	P	43.3	Very low	30.5	Very low	119 Å²	119	120.8 Å²	120.8	77%	0.773	77%	0.768	S	S	*	*				-154.5	-176	52	43.5	-22.3	0	0	0	117.9
495	A	28.8	Very low	30.6	Very low	86 Å²	86	121.7 Å²	121.7	71%	0.711	77%	0.769	S	S	*	*			trans	68.1	156.9	149.4	0	0	0	0	0	119.1
496	D	30.7	Very low	30.5	Very low	134 Å²	134	119 Å²	119	72%	0.717	77%	0.767	S	S	*	*			cis	-158.7	159.9	-4.5	-133.4	-26.6	0	0	0	115.3
497	H	29.5	Very low	30.4	Very low	181 Å²	181	114.7 Å²	114.7	84%	0.838	76%	0.764	S	S	*	*			trans	48.6	136.8	152.8	-87.7	67.9	0	0	0	125.9
498	G	26	Very low	30.3	Very low	80 Å²	80	118.3 Å²	118.3	83%	0.825	78%	0.781	S	S	*	*			trans	161.5	85.7	148.7	0	0	0	0	0	122
499	G	25.6	Very low	30.1	Very low	77 Å²	77	116.6 Å²	116.6	79%	0.794	77%	0.774	S	S	*	*			trans	88	130.4	163.3	0	0	0	0	0	116.6
500	S	29.1	Very low	29.8	Very low	117 Å²	117	117.1 Å²	117.1	82%	0.818	78%	0.777	S	S	*	*			cis	79.1	126.6	48.1	-161.9	0	0	0	0	112.9
501	V	28.4	Very low	29.6	Very low	135 Å²	135	118 Å²	118	82%	0.818	78%	0.782	S	S	*	*			cis	-137.6	158.2	15.3	-130.5	0	0	0	0	110.1
502	G	30.6	Very low	29.7	Very low	66 Å²	66	113.8 Å²	113.8	68%	0.68	79%	0.785	S	S	*	*				78.4	128	86.7	0	0	0	0	0	113.6
503	S	38.5	Very low	29.5	Very low	97 Å²	97	114 Å²	114	68%	0.678	79%	0.786	S	S	*	*			cis	-161.8	157	6.5	-64	0	0	0	0	112.9
504	E	31	Very low	29.1	Very low	176 Å²	176	113.4 Å²	113.4	82%	0.822	79%	0.787	S	S	*	*			trans	51.8	158.5	137.5	86.8	-160.9	112.5	0	0	122.8
505	S	33.3	Very low	28.2	Very low	112 Å²	112	111.6 Å²	111.6	78%	0.783	79%	0.79	S	S	*	*			cis	-156.9	147.2	-2.5	-152.8	0	0	0	0	113.5
506	G	27.1	Very low	28	Very low	77 Å²	77	115.5 Å²	115.5	79%	0.794	79%	0.793	S	S	*	*			trans	68.7	135.6	140.7	0	0	0	0	0	119.6
507	G	25.4	Very low	27.8	Very low	82 Å²	82	116.4 Å²	116.4	85%	0.845	79%	0.793	S	S	*	*			cis	113.2	140	26.8	0	0	0	0	0	109.2
508	S	30.2	Very low	27.6	Very low	128 Å²	128	112.8 Å²	112.8	90%	0.895	79%	0.788	S	S	*	*			cis	-158.6	-171.3	9.1	-163.1	0	0	0	0	112.2
509	A	21.9	Very low	27.6	Very low	83 Å²	83	115.5 Å²	115.5	69%	0.686	79%	0.789	S	S	*	*			trans	-56.7	172.5	179.4	0	0	0	0	0	115.4
510	V	26.2	Very low	27.7	Very low	131 Å²	131	117.7 Å²	117.7	79%	0.794	79%	0.792	S	S	*	*			cis	-155.1	149.9	50	-77.2	0	0	0	0	110.3
511	D	24.5	Very low	27.5	Very low	143 Å²	143	115.1 Å²	115.1	77%	0.765	78%	0.784	S	S	*	*				75.5	130.9	51.8	-162.2	11.9	0	0	0	114.5
512	S	31	Very low	27.5	Very low	121 Å²	121	120.6 Å²	120.6	85%	0.846	79%	0.789	S	S	*	*			trans	152.1	108.6	163.2	-72	0	0	0	0	114.9
513	V	24.8	Very low	27.5	Very low	138 Å²	138	122.8 Å²	122.8	84%	0.836	79%	0.794	S	S	*	*			trans	-61.4	161.6	176.8	77	0	0	0	0	118.8
514	A	24.8	Very low	27.1	Very low	99 Å²	99	123.7 Å²	123.7	82%	0.818	80%	0.801	S	S	*	*			trans	62.4	154.4	150	0	0	0	0	0	123.4
515	G	24.6	Very low	26.8	Very low	80 Å²	80	119.3 Å²	119.3	83%	0.825	80%	0.795	S	S	*	*			trans	162.1	112.1	162.5	0	0	0	0	0	115.6
516	E	24.6	Very low	26.4	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	80%	0.803	S	S	*	*			trans	-89.2	160.7	-174.5	-71	-174.2	-179.4	0	0	116.9
517	H	25.8	Very low	26.3	Very low	153 Å²	153	125.3 Å²	125.3	71%	0.708	80%	0.799	S	S	*	*			trans	56.7	117.1	139.8	-66.8	136	0	0	0	123.7
518	S	25.3	Very low	26.2	Very low	105 Å²	105	129 Å²	129	73%	0.734	80%	0.8	S	S	*	*				83.5	124.8	119.8	-64.5	0	0	0	0	124.8
519	V	26	Very low	26	Very low	138 Å²	138	127.4 Å²	127.4	84%	0.836	80%	0.795	S	S	*	*			trans	89.3	124.3	138.4	171.7	0	0	0	0	122
520	S	27.8	Very low	26	Very low	122 Å²	122	130 Å²	130	85%	0.853	80%	0.802	S	S	*	*			trans	69.5	138.8	157.2	-166.8	0	0	0	0	119.5
521	G	26.4	Very low	25.9	Very low	63 Å²	63	128.7 Å²	128.7	65%	0.649	81%	0.805	S	S	*	*			cis	156.4	141.5	-9.8	0	0	0	0	0	114.8
522	R	28.2	Very low	25.8	Very low	250 Å²	250	131.4 Å²	131.4	94%	0.943	81%	0.813	S	S	*	*			trans	69.3	141.1	175.5	-73.4	178.9	174.9	-172.5	-2.9	116
523	S	29.8	Very low	25.4	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	80%	0.802	S	S	*	*			cis	-154.6	166.4	10.3	-95.9	0	0	0	0	113.3
524	S	30.1	Very low	25.3	Very low	116 Å²	116	131 Å²	131	81%	0.811	80%	0.804	S	S	*	*			trans	101.4	86.6	149.3	-158	0	0	0	0	121.7
525	A	24.7	Very low	25.6	Very low	84 Å²	84	132.2 Å²	132.2	69%	0.694	80%	0.803	S	S	*	*				63.3	112.1	128.4	0	0	0	0	0	123.3
526	Y	26.3	Very low	25.6	Very low	246 Å²	246	133.6 Å²	133.6	97%	0.965	81%	0.807	S	S	*	*			trans	62	124.1	138	-92.3	-89	0	0	0	122.1
527	G	24.9	Very low	25.6	Very low	69 Å²	69	129 Å²	129	71%	0.711	81%	0.805	S	S	*	*			trans	137.1	105.6	140.7	0	0	0	0	0	116.5
528	D	22.3	Very low	25.8	Very low	160 Å²	160	128.1 Å²	128.1	86%	0.856	81%	0.813	S	S	*	*			trans	55.3	141.8	145.4	-152.4	10.9	0	0	0	121
529	A	25.8	Very low	25.7	Very low	95 Å²	95	126.4 Å²	126.4	79%	0.785	81%	0.812	S	S	*	*			trans	-157.3	112.6	177.8	0	0	0	0	0	112.9
530	T	21.9	Very low	25.8	Very low	137 Å²	137	126.1 Å²	126.1	84%	0.84	82%	0.816	S	S	*	*			trans	-87.5	161.2	168.9	48.7	0	0	0	0	111.7
531	A	24	Very low	25.7	Very low	103 Å²	103	127.4 Å²	127.4	85%	0.851	82%	0.818	S	S	*	*			trans	-149.1	128.1	174.2	0	0	0	0	0	113.8
532	E	22.5	Very low	25.7	Very low	201 Å²	201	130.2 Å²	130.2	94%	0.939	83%	0.828	S	S	*	*			trans	-85.8	166	153.4	-55.5	177.3	123.7	0	0	108.5
533	G	22.5	Very low	25.7	Very low	59 Å²	59	124.6 Å²	124.6	61%	0.608	83%	0.827	S	S	*	*			cis	155.6	125.1	-8.2	0	0	0	0	0	112.8
534	H	23.4	Very low	25.5	Very low	192 Å²	192	124.6 Å²	124.6	89%	0.889	83%	0.827	S	S	*	*			trans	64.6	172.6	161.5	-63.2	105.2	0	0	0	119.1
535	P	31.7	Very low	25.5	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	83%	0.831	S	S	*	*			cis	-129.6	154.1	-16.1	22.2	-0.2	0	0	0	117
536	A	23.4	Very low	25.7	Very low	110 Å²	110	125.5 Å²	125.5	91%	0.909	83%	0.833	S	S	*	*			trans	-162.5	164	149.8	0	0	0	0	0	108.1
537	G	24.1	Very low	25.8	Very low	71 Å²	71	118.9 Å²	118.9	73%	0.732	83%	0.829	S	S	*	*			cis	174.8	125.9	-7.9	0	0	0	0	0	108.5
538	P	30.3	Very low	25.8	Very low	135 Å²	135	123.4 Å²	123.4	88%	0.877	84%	0.835	S	S	*	*			trans	-98.6	154.6	-155.5	36.5	-36.8	0	0	0	116.4
539	G	24.6	Very low	25.8	Very low	69 Å²	69	121.3 Å²	121.3	71%	0.711	83%	0.833	S	S	*	*			trans	-159.8	146.6	169.7	0	0	0	0	0	114.9
540	S	27.4	Very low	25.9	Very low	132 Å²	132	123.8 Å²	123.8	92%	0.923	84%	0.839	S	S	*	*			trans	47.6	109.6	156.9	-56.6	0	0	0	0	120.4
541	V	25.7	Very low	26.2	Very low	149 Å²	149	123.9 Å²	123.9	90%	0.903	84%	0.839	S	S	*	*			trans	-103	141	167.9	-70.3	0	0	0	0	112.6
542	S	26.5	Very low	26.4	Very low	122 Å²	122	125.7 Å²	125.7	85%	0.853	84%	0.84	S	S	*	*			trans	-119.5	136.2	167.8	-73.9	0	0	0	0	109.5	S544	S542-S544 PolarHBondContact O-N 3.47Å
543	S	26.7	Very low	26.6	Very low	131 Å²	131	119.4 Å²	119.4	92%	0.916	83%	0.829	S	S	*	*			trans	-73.6	117.7	-168.9	55.6	0	0	0	0	113.7
544	S	27.3	Very low	26.9	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	84%	0.842	S	S	*	*			trans	-106.7	121.7	171.5	51.7	0	0	0	0	111.4	S542 G546	S542-S544 PolarHBondContact O-N 3.47Å; S544-G546 PolarHBondContact O-N 3.14Å
545	T	29.5	Very low	27.1	Very low	148 Å²	148	125.6 Å²	125.6	91%	0.908	84%	0.842	S	S	*	*			trans	-78.6	110.8	169.2	44.8	0	0	0	0	109.4
546	G	29.9	Very low	26.9	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	85%	0.848	S	S	*	*			trans	-66.5	150.2	-164.8	0	0	0	0	0	116.2	S544	S544-G546 PolarHBondContact O-N 3.14Å
547	A	27.2	Very low	27	Very low	108 Å²	108	127.6 Å²	127.6	89%	0.893	84%	0.843	S	S	*	*			trans	-81.9	144.5	163.5	0	0	0	0	0	110.3
548	I	25.1	Very low	27.1	Very low	164 Å²	164	132.2 Å²	132.2	84%	0.841	85%	0.851	S	S	*	*			trans	-125.4	108.5	176.1	-50.7	175.9	0	0	0	108.5
549	S	22.7	Very low	26.8	Very low	115 Å²	115	129.2 Å²	129.2	80%	0.804	84%	0.844	S	S	*	*			trans	-162.3	85.7	171.7	-99.8	0	0	0	0	112.5
550	T	27.4	Very low	27.3	Very low	148 Å²	148	131.2 Å²	131.2	91%	0.908	85%	0.848	S	S	*	*			trans	-162.7	146.5	140.3	20.7	0	0	0	0	108.5
551	T	28	Very low	27.4	Very low	139 Å²	139	134.4 Å²	134.4	85%	0.853	85%	0.848	S	S	*	*			trans	-106.7	118.2	-175.3	49	0	0	0	0	111.4	G553	T551-G553 PolarHBondContact O-N 3.47Å
552	T	28.4	Very low	27.7	Very low	140 Å²	140	130.9 Å²	130.9	86%	0.859	84%	0.842	S	S	*	*			trans	-74.1	98	161.4	48.9	0	0	0	0	109.2
553	G	26.6	Very low	28	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-71.9	130.7	168.6	0	0	0	0	0	110.5	T551	T551-G553 PolarHBondContact O-N 3.47Å
554	H	28.8	Very low	28.3	Very low	192 Å²	192	132.4 Å²	132.4	89%	0.889	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-77.3	154.3	159.5	-102	46.6	0	0	0	109.9
555	Q	27.8	Very low	28.5	Very low	190 Å²	190	136 Å²	136	89%	0.888	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-79.7	126.7	177.1	-64.4	172.2	-8.8	0	0	110.4
556	E	27.2	Very low	28.6	Very low	197 Å²	197	131.9 Å²	131.9	92%	0.921	83%	0.834	S	S	*	*			trans	-146.9	141.2	156.5	-71.7	-162.4	145.3	0	0	109.7
557	G	26	Very low	29	Very low	78 Å²	78	137.4 Å²	137.4	80%	0.804	84%	0.841	S	S	*	*			trans	78.4	107.3	161	0	0	0	0	0	117.6
558	D	26	Very low	29.8	Very low	167 Å²	167	137.4 Å²	137.4	89%	0.893	83%	0.83	S	S	*	*			trans	-69.1	150.4	155.6	-178.6	23.2	0	0	0	110.3
559	G	25.1	Very low	30.7	Very low	72 Å²	72	136.4 Å²	136.4	74%	0.742	82%	0.822	S	S	*	*			trans	172.3	60.8	-168.8	0	0	0	0	0	114	E561	G559-E561 PolarHBondContact O-N 3.07Å
560	S	34.7	Very low	32.1	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	80%	0.802	S	S	*	*			trans	-64.2	117.3	178	162.5	0	0	0	0	114
561	E	29.8	Very low	33.6	Very low	198 Å²	198	129.4 Å²	129.4	93%	0.925	78%	0.779	S	S	*	*			trans	-156.7	146.9	138	-112.1	165.2	-144.8	0	0	108.7	G559	G559-E561 PolarHBondContact O-N 3.07Å
562	G	32.1	Very low	35.7	Very low	76 Å²	76	126.6 Å²	126.6	78%	0.784	76%	0.761	S	S	*	*			trans	-123.3	138.8	-157.3	0	0	0	0	0	116.5
563	E	31.9	Very low	37.9	Very low	205 Å²	205	126.3 Å²	126.3	96%	0.958	75%	0.75	S	S	*	*			trans	-128.9	109	163	-68.3	-171.9	155.2	0	0	108.4
564	G	33.4	Very low	40.3	Very low	80 Å²	80	127.2 Å²	127.2	83%	0.825	74%	0.742	S	S	*	*			trans	-124.4	14.6	-163.1	0	0	0	0	0	116.9
565	E	30.5	Very low	42.8	Very low	189 Å²	189	121.3 Å²	121.3	88%	0.883	72%	0.722	S	S	*	*	S	Bend	trans	-128	-2.6	-171.6	-74.8	-177.3	166.3	0	0	115.5
566	G	32.4	Very low	45.5	Very low	61 Å²	61	116.6 Å²	116.6	63%	0.629	70%	0.703	S	S	*	*			trans	-90.8	-13.9	-169.1	0	0	0	0	0	118.2	T568	G566-T568 PolarHBondContact O-N 3.31Å
567	E	38.8	Very low	48.3	Very low	185 Å²	185	111.8 Å²	111.8	86%	0.864	68%	0.676	S	S	*	*	H	α-helix	trans	-75	-22.7	-164.1	-63.3	-159.6	138.4	0	0	115.3
568	T	42.8	Very low	51.3	Low	109 Å²	109	109.7 Å²	109.7	67%	0.669	65%	0.647	S	S	*	*	H	α-helix	trans	-82.6	-31.9	-172.7	44.4	0	0	0	0	114.3	G566	G566-T568 PolarHBondContact O-N 3.31Å
569	E	43.9	Very low	54.3	Low	143 Å²	143	104 Å²	104	67%	0.668	61%	0.614	S	S	*	*	H	α-helix	trans	-75.7	-37.6	179	-62.7	-163.5	138.3	0	0	112.2	D571 V572 H573	E569-D571 VanDerWaalsContact C-N 3.32Å; E569-D571 PolarHBondContact O-N 3.32Å; E569-V572 PolarHBondContact O-N 3.09Å; E569-H573 PolarHBondContact O-CD2 2.96Å; E569-H573 VanDerWaalsContact O-CD2 3.31Å; E569-H573 PolarHBondContact O-N 2.68Å; E569-H573 VanDerWaalsContact O-N 3.08Å
570	G	53.6	Low	57.5	Low	38 Å²	38	105.1 Å²	105.1	39%	0.392	60%	0.602	S	S	.	*	H	α-helix	trans	-60.6	-37.7	179.4	0	0	0	0	0	113.7	V572 H573 T574	G570-V572 VanDerWaalsContact C-N 3.35Å; G570-V572 PolarHBondContact O-N 3.01Å; G570-H573 PolarHBondContact O-N 3.22Å; G570-T574 WeakPolarHBondContact O-CG2 3.5Å; G570-T574 PolarHBondContact O-N 3.38Å; G570-T574 PolarHBondContact O-OG1 2.93Å; G570-T574 VanDerWaalsContact O-OG1 3.08Å
571	D	58.7	Low	60.2	Low	77 Å²	77	100 Å²	100	41%	0.412	57%	0.565	S	S	.	*	H	α-helix	trans	-66.9	-36.3	179.1	-148.2	37.8	0	0	0	111.9	K353 E569 T574 S575	K353-D571 IonicContact NZ-OD1 2.76Å; K353-D571 PolarHBondContact NZ-OD1 3.21Å; K353-D571 IonicContact NZ-OD2 2.63Å; K353-D571 PolarHBondContact NZ-OD2 3.08Å; E569-D571 VanDerWaalsContact C-N 3.32Å; E569-D571 PolarHBondContact O-N 3.32Å; D571-T574 PolarHBondContact O-OG1 3.49Å; D571-T574 VanDerWaalsContact O-OG1 3.09Å; D571-S575 WeakPolarHBondContact O-CB 3.48Å; D571-S575 PolarHBondContact O-N 3.2Å
572	V	70.7	Confident	63.1	Low	81 Å²	81	91.3 Å²	91.3	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-68.6	-47	174.8	179.1	0	0	0	0	111	E569 G570 T574 S575 N576	E569-V572 PolarHBondContact O-N 3.09Å; G570-V572 VanDerWaalsContact C-N 3.35Å; G570-V572 PolarHBondContact O-N 3.01Å; V572-T574 PolarHBondContact O-N 3.44Å; V572-S575 PolarHBondContact O-N 3.17Å; V572-N576 WeakPolarHBondContact O-CB 3.34Å; V572-N576 VanDerWaalsContact O-CG 3.24Å; V572-N576 PolarHBondContact O-N 3.47Å; V572-N576 PolarHBondContact O-OD1 3.11Å
573	H	74.3	Confident	66	Low	134 Å²	134	88.8 Å²	88.8	62%	0.62	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-41	178.8	-80	-67.7	0	0	0	112.8	E569 G570 R577	E569-H573 PolarHBondContact O-CD2 2.96Å; E569-H573 VanDerWaalsContact O-CD2 3.31Å; E569-H573 PolarHBondContact O-N 2.68Å; E569-H573 VanDerWaalsContact O-N 3.08Å; G570-H573 PolarHBondContact O-N 3.22Å; H573-R577 WeakPolarHBondContact O-CB 3.35Å; H573-R577 PolarHBondContact O-N 3.48Å
574	T	78.3	Confident	68.9	Low	88 Å²	88	81.7 Å²	81.7	54%	0.54	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-39.5	175.7	56.9	0	0	0	0	112.7	G570 D571 V572 R577 L578	G570-T574 WeakPolarHBondContact O-CG2 3.5Å; G570-T574 PolarHBondContact O-N 3.38Å; G570-T574 PolarHBondContact O-OG1 2.93Å; G570-T574 VanDerWaalsContact O-OG1 3.08Å; D571-T574 PolarHBondContact O-OG1 3.49Å; D571-T574 VanDerWaalsContact O-OG1 3.09Å; V572-T574 PolarHBondContact O-N 3.44Å; T574-R577 PolarHBondContact O-N 3.43Å; T574-L578 WeakPolarHBondContact O-CB 3.41Å; T574-L578 PolarHBondContact O-N 2.94Å
575	S	80.9	Confident	71.8	Confident	67 Å²	67	78 Å²	78	47%	0.469	42%	0.422	S	S	.	.	H	α-helix	trans	-61.3	-47	174.3	-173.4	0	0	0	0	112	D571 V572 R577 L578 H579	D571-S575 WeakPolarHBondContact O-CB 3.48Å; D571-S575 PolarHBondContact O-N 3.2Å; V572-S575 PolarHBondContact O-N 3.17Å; S575-R577 VanDerWaalsContact C-N 3.32Å; S575-R577 PolarHBondContact O-N 3.35Å; S575-L578 PolarHBondContact O-N 3.15Å; S575-H579 PolarHBondContact O-N 3.33Å
576	N	84.3	Confident	74.8	Confident	91 Å²	91	69.1 Å²	69.1	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-63.5	-38.2	178.2	-68.1	-6.2	0	0	0	111.7	V572 H579 M580	V572-N576 WeakPolarHBondContact O-CB 3.34Å; V572-N576 VanDerWaalsContact O-CG 3.24Å; V572-N576 PolarHBondContact O-N 3.47Å; V572-N576 PolarHBondContact O-OD1 3.11Å; N576-H579 WeakPolarHBondContact O-CB 3.47Å; N576-H579 PolarHBondContact O-N 3.47Å; N576-M580 PolarHBondContact O-N 3.1Å; N576-M580 VanDerWaalsContact O-N 3.07Å
577	R	87.1	Confident	77.6	Confident	97 Å²	97	70 Å²	70	37%	0.366	37%	0.368	S	S	.	.	H	α-helix	trans	-68.2	-39.5	176.5	-158.5	169	-154.8	-149.4	4.9	112.1	T312 C313 H573 T574 S575 H579 M580 V581	T312-R577 WeakPolarHBondContact O-CD 3.41Å; T312-R577 PolarHBondContact O-NH1 3.25Å; C313-R577 VanDerWaalsContact CA-NH1 3.35Å; C313-R577 PolarHBondContact O-NH1 3.12Å; C313-R577 PolarHBondContact O-NH2 3.08Å; H573-R577 WeakPolarHBondContact O-CB 3.35Å; H573-R577 PolarHBondContact O-N 3.48Å; T574-R577 PolarHBondContact O-N 3.43Å; S575-R577 VanDerWaalsContact C-N 3.32Å; S575-R577 PolarHBondContact O-N 3.35Å; R577-H579 VanDerWaalsContact C-N 3.3Å; R577-H579 PolarHBondContact O-N 3.27Å; R577-M580 PolarHBondContact O-N 3.33Å; R577-V581 WeakPolarHBondContact O-CG2 3.34Å; R577-V581 PolarHBondContact O-N 3.5Å
578	L	88.7	Confident	80.2	Confident	34 Å²	34	65.6 Å²	65.6	18%	0.178	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-37.2	172.6	179.6	58.9	0	0	0	111.7	L348 T574 S575 V581 R582	L348-L578 HydrophobicContact CD2-CD1 4.43Å; T574-L578 WeakPolarHBondContact O-CB 3.41Å; T574-L578 PolarHBondContact O-N 2.94Å; S575-L578 PolarHBondContact O-N 3.15Å; L578-V581 PolarHBondContact O-N 2.85Å; L578-R582 WeakPolarHBondContact O-CG 3.4Å; L578-R582 PolarHBondContact O-N 3.13Å
579	H	89.8	Confident	82.5	Confident	46 Å²	46	60.5 Å²	60.5	21%	0.213	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-47.1	173.5	-165.2	63.1	0	0	0	112.4	S575 N576 R577 V581 R582 L583 D617 D625	S575-H579 PolarHBondContact O-N 3.33Å; N576-H579 WeakPolarHBondContact O-CB 3.47Å; N576-H579 PolarHBondContact O-N 3.47Å; R577-H579 VanDerWaalsContact C-N 3.3Å; R577-H579 PolarHBondContact O-N 3.27Å; H579-V581 VanDerWaalsContact C-N 3.28Å; H579-V581 PolarHBondContact O-N 3.46Å; H579-R582 WeakPolarHBondContact O-CB 3.25Å; H579-R582 PolarHBondContact O-N 2.97Å; H579-R582 VanDerWaalsContact O-N 3.08Å; H579-L583 PolarHBondContact O-N 2.86Å; H579-D617 PolarHBondContact CE1-O 3.34Å; H579-D625 IonicContact CD2-OD1 3.01Å; H579-D625 IonicContact CE1-OD1 3.27Å; H579-D625 IonicContact CE1-OD2 2.8Å; H579-D625 PolarHBondContact CE1-OD2 2.95Å; H579-D625 VanDerWaalsContact NE2-CG 3.31Å; H579-D625 IonicContact NE2-OD1 3.58Å; H579-D625 PolarHBondContact NE2-OD1 2.87Å; H579-D625 IonicContact NE2-OD2 2.87Å; H579-D625 PolarHBondContact NE2-OD2 3.15Å
580	M	90.6	Very high	84.7	Confident	97 Å²	97	53.8 Å²	53.8	48%	0.478	28%	0.281	S	S	.	.	H	α-helix	trans	-57.7	-40.2	174	-68.1	-179.6	68	0	0	112.4	L315 N576 R577 R582 L583 M584	L315-M580 HydrophobicContact CD1-CE 3.89Å; N576-M580 PolarHBondContact O-N 3.1Å; N576-M580 VanDerWaalsContact O-N 3.07Å; R577-M580 PolarHBondContact O-N 3.33Å; M580-R582 VanDerWaalsContact C-N 3.35Å; M580-R582 PolarHBondContact O-N 3.24Å; M580-L583 PolarHBondContact O-N 3.34Å; M580-M584 WeakPolarHBondContact O-CB 3.47Å; M580-M584 WeakPolarHBondContact O-CG 3.44Å; M580-M584 PolarHBondContact O-N 2.91Å
581	V	91.8	Very high	86.4	Confident	4 Å²	4	57 Å²	57	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-40.3	175.5	171.8	0	0	0	0	111.7	C311 L315 I318 L348 R577 L578 H579 L585	C311-V581 HydrophobicContact CB-CG1 4.01Å; C311-V581 HydrophobicContact CB-CG2 4.39Å; C311-V581 VanDerWaalsContact O-CG2 3.24Å; C311-V581 WeakPolarHBondContact O-CG2 3.46Å; L315-V581 HydrophobicContact CD2-CG2 3.86Å; I318-V581 HydrophobicContact CD1-CB 4.44Å; I318-V581 HydrophobicContact CD1-CG1 4.5Å; I318-V581 HydrophobicContact CD1-CG2 4.12Å; L348-V581 HydrophobicContact CD2-CG1 4.2Å; R577-V581 WeakPolarHBondContact O-CG2 3.34Å; R577-V581 PolarHBondContact O-N 3.5Å; L578-V581 PolarHBondContact O-N 2.85Å; H579-V581 VanDerWaalsContact C-N 3.28Å; H579-V581 PolarHBondContact O-N 3.46Å; V581-L585 WeakPolarHBondContact O-CB 3.45Å; V581-L585 PolarHBondContact O-N 3.04Å
582	R	92	Very high	87.6	Confident	16 Å²	16	54.2 Å²	54.2	6%	0.06	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-49	174.4	-66.5	172.3	-169.5	132.7	0.1	111.9	L348 L578 H579 M580 L585 L586 L614 D617	L348-R582 HydrophobicContact CD2-CG 4.34Å; L348-R582 VanDerWaalsContact O-CZ 3.3Å; L348-R582 PolarHBondContact O-NE 3.26Å; L348-R582 PolarHBondContact O-NH2 3.03Å; L578-R582 WeakPolarHBondContact O-CG 3.4Å; L578-R582 PolarHBondContact O-N 3.13Å; H579-R582 WeakPolarHBondContact O-CB 3.25Å; H579-R582 PolarHBondContact O-N 2.97Å; H579-R582 VanDerWaalsContact O-N 3.08Å; M580-R582 VanDerWaalsContact C-N 3.35Å; M580-R582 PolarHBondContact O-N 3.24Å; R582-L585 PolarHBondContact O-N 3.35Å; R582-L586 WeakPolarHBondContact O-CB 3.42Å; R582-L586 PolarHBondContact O-N 3.23Å; R582-L614 HydrophobicContact CB-CD2 3.84Å; R582-L614 HydrophobicContact CG-CD2 4.03Å; R582-D617 WeakPolarHBondContact CD-OD2 3.43Å; R582-D617 IonicContact CZ-OD2 2.8Å; R582-D617 IonicContact NE-OD2 3.22Å; R582-D617 PolarHBondContact NE-OD2 3.44Å; R582-D617 IonicContact NH1-OD2 2.68Å; R582-D617 IonicContact NH2-OD2 3.95Å
583	L	92.3	Very high	88.3	Confident	23 Å²	23	50.5 Å²	50.5	12%	0.12	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-49.8	-175.3	-162.5	72.7	0	0	0	110.9	H579 M580 L585 L586 E587 L618 K624 A628	H579-L583 PolarHBondContact O-N 2.86Å; M580-L583 PolarHBondContact O-N 3.34Å; L583-L585 VanDerWaalsContact C-N 3.34Å; L583-L585 PolarHBondContact O-N 3.02Å; L583-L586 WeakPolarHBondContact O-CB 3.32Å; L583-L586 PolarHBondContact O-N 2.68Å; L583-E587 PolarHBondContact O-N 3.15Å; L583-L618 HydrophobicContact CD1-CD2 3.99Å; L583-K624 HydrophobicContact CD2-CB 4.15Å; L583-A628 HydrophobicContact CD1-CB 3.53Å; L583-A628 HydrophobicContact CG-CB 4.49Å
584	M	92.8	Very high	88.9	Confident	55 Å²	55	47.1 Å²	47.1	27%	0.271	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-37.2	176	-68	177.1	68.4	0	0	112.3	L315 I318 M580 R588	L315-M584 HydrophobicContact CB-CE 4.31Å; L315-M584 HydrophobicContact CB-SD 4.32Å; L315-M584 HydrophobicContact CD1-SD 4.35Å; I318-M584 HydrophobicContact CD1-CB 3.99Å; I318-M584 HydrophobicContact CD1-CE 4Å; I318-M584 HydrophobicContact CD1-SD 3.84Å; I318-M584 HydrophobicContact CG2-CB 4.12Å; M580-M584 WeakPolarHBondContact O-CB 3.47Å; M580-M584 WeakPolarHBondContact O-CG 3.44Å; M580-M584 PolarHBondContact O-N 2.91Å; M584-R588 WeakPolarHBondContact O-CB 3.06Å; M584-R588 WeakPolarHBondContact O-CG 3.41Å; M584-R588 PolarHBondContact O-N 2.86Å
585	L	93.4	Very high	88.9	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-69	-37.5	175.8	-178.4	59.8	0	0	0	112	Y325 L348 V581 R582 L583 R588 L589 L614	Y325-L585 HydrophobicContact CD2-CD1 4.03Å; Y325-L585 HydrophobicContact CD2-CD2 4.32Å; Y325-L585 HydrophobicContact CE2-CD2 4.31Å; L348-L585 HydrophobicContact CD1-CD2 3.63Å; V581-L585 WeakPolarHBondContact O-CB 3.45Å; V581-L585 PolarHBondContact O-N 3.04Å; R582-L585 PolarHBondContact O-N 3.35Å; L583-L585 VanDerWaalsContact C-N 3.34Å; L583-L585 PolarHBondContact O-N 3.02Å; L585-R588 PolarHBondContact O-N 3.1Å; L585-L589 HydrophobicContact CD1-CD1 4.19Å; L585-L589 HydrophobicContact CD1-CG 4.08Å; L585-L589 HydrophobicContact CG-CD1 4.02Å; L585-L589 HydrophobicContact CG-CG 4.37Å; L585-L589 WeakPolarHBondContact O-CB 3.28Å; L585-L589 VanDerWaalsContact O-CG 3.25Å; L585-L589 WeakPolarHBondContact O-CG 3.37Å; L585-L589 PolarHBondContact O-N 2.58Å; L585-L614 HydrophobicContact CG-CD1 4.3Å
586	L	94.3	Very high	89.1	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-48.9	174.6	179.3	59.2	0	0	0	110.7	R582 L583 R588 L589 L590 I611 L614 L618	R582-L586 WeakPolarHBondContact O-CB 3.42Å; R582-L586 PolarHBondContact O-N 3.23Å; L583-L586 WeakPolarHBondContact O-CB 3.32Å; L583-L586 PolarHBondContact O-N 2.68Å; L586-R588 PolarHBondContact O-N 3.03Å; L586-L589 PolarHBondContact O-N 3.2Å; L586-L590 HydrophobicContact CD1-CD1 3.93Å; L586-L590 HydrophobicContact CD1-CG 4.28Å; L586-L590 HydrophobicContact CG-CD1 3.93Å; L586-L590 WeakPolarHBondContact O-CB 3.48Å; L586-L590 WeakPolarHBondContact O-CD1 3.43Å; L586-L590 VanDerWaalsContact O-CG 3.25Å; L586-L590 WeakPolarHBondContact O-CG 3.47Å; L586-L590 PolarHBondContact O-N 3.2Å; L586-I611 HydrophobicContact CD1-CG2 4.28Å; L586-L614 HydrophobicContact CB-CB 4.36Å; L586-L614 HydrophobicContact CB-CD1 4.12Å; L586-L614 HydrophobicContact CD1-CB 4.15Å; L586-L614 HydrophobicContact CD1-CD1 4.32Å; L586-L618 HydrophobicContact CD2-CD1 4.41Å
587	E	92.1	Very high	89.1	Confident	78 Å²	78	42.1 Å²	42.1	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-57.9	-46.4	175	-71.1	-179.5	173.1	0	0	112.6	L583 L590 Q591	L583-E587 PolarHBondContact O-N 3.15Å; E587-L590 PolarHBondContact O-N 3Å; E587-Q591 WeakPolarHBondContact O-CG 3.49Å; E587-Q591 PolarHBondContact O-N 3.27Å; E587-Q591 VanDerWaalsContact O-N 3.11Å
588	R	91.9	Very high	88.8	Confident	93 Å²	93	43.2 Å²	43.2	35%	0.351	21%	0.208	S	C	.	.	H	α-helix	trans	-68.6	-35.8	-179.6	-73	-55.4	-165.8	-160.6	-0.2	113.4	N319 M584 L585 L586 Q591	N319-R588 VanDerWaalsContact OD1-CZ 3.23Å; N319-R588 PolarHBondContact OD1-NE 2.96Å; N319-R588 PolarHBondContact OD1-NH2 3.4Å; M584-R588 WeakPolarHBondContact O-CB 3.06Å; M584-R588 WeakPolarHBondContact O-CG 3.41Å; M584-R588 PolarHBondContact O-N 2.86Å; L585-R588 PolarHBondContact O-N 3.1Å; L586-R588 PolarHBondContact O-N 3.03Å; R588-Q591 VanDerWaalsContact CD-OE1 3.32Å
589	L	91.8	Very high	88.5	Confident	3 Å²	3	42 Å²	42	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-65.2	-48.3	171.3	-71.1	170.7	0	0	0	109.8	L585 L586 Q591 T592 L593 Y607 V610 L614	L585-L589 HydrophobicContact CD1-CD1 4.19Å; L585-L589 HydrophobicContact CD1-CG 4.08Å; L585-L589 HydrophobicContact CG-CD1 4.02Å; L585-L589 HydrophobicContact CG-CG 4.37Å; L585-L589 WeakPolarHBondContact O-CB 3.28Å; L585-L589 VanDerWaalsContact O-CG 3.25Å; L585-L589 WeakPolarHBondContact O-CG 3.37Å; L585-L589 PolarHBondContact O-N 2.58Å; L586-L589 PolarHBondContact O-N 3.2Å; L589-Q591 VanDerWaalsContact C-N 3.33Å; L589-Q591 PolarHBondContact O-N 3.45Å; L589-T592 WeakPolarHBondContact O-CA 3.45Å; L589-T592 PolarHBondContact O-N 3.14Å; L589-T592 PolarHBondContact O-OG1 2.97Å; L589-L593 PolarHBondContact O-N 3.48Å; L589-Y607 HydrophobicContact CB-CE2 4.49Å; L589-Y607 HydrophobicContact CD2-CD2 4.45Å; L589-Y607 HydrophobicContact CD2-CE2 3.8Å; L589-Y607 PolarHBondContact O-OH 3.16Å; L589-V610 HydrophobicContact CD1-CG1 4.16Å; L589-L614 HydrophobicContact CD1-CD1 3.76Å
590	L	90.6	Very high	88.3	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-41.9	-177.8	-74.4	166	0	0	0	113.5	L586 E587 T592 L593 L632 Q635	L586-L590 HydrophobicContact CD1-CD1 3.93Å; L586-L590 HydrophobicContact CD1-CG 4.28Å; L586-L590 HydrophobicContact CG-CD1 3.93Å; L586-L590 WeakPolarHBondContact O-CB 3.48Å; L586-L590 WeakPolarHBondContact O-CD1 3.43Å; L586-L590 VanDerWaalsContact O-CG 3.25Å; L586-L590 WeakPolarHBondContact O-CG 3.47Å; L586-L590 PolarHBondContact O-N 3.2Å; E587-L590 PolarHBondContact O-N 3Å; L590-T592 PolarHBondContact O-N 3.32Å; L590-L593 WeakPolarHBondContact O-CB 3.13Å; L590-L593 PolarHBondContact O-N 3.18Å; L590-L632 HydrophobicContact CD1-CB 3.85Å; L590-L632 HydrophobicContact CD1-CD1 4.08Å; L590-L632 HydrophobicContact CD2-CD1 3.5Å; L590-L632 HydrophobicContact CG-CD1 4.32Å; L590-Q635 VanDerWaalsContact C-OE1 3.25Å; L590-Q635 PolarHBondContact O-OE1 3.19Å
591	Q	88.6	Confident	88.2	Confident	104 Å²	104	35.8 Å²	35.8	49%	0.486	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-17	172.7	-71.3	164.2	19.9	0	0	114.4	E587 R588 L589	E587-Q591 WeakPolarHBondContact O-CG 3.49Å; E587-Q591 PolarHBondContact O-N 3.27Å; E587-Q591 VanDerWaalsContact O-N 3.11Å; R588-Q591 VanDerWaalsContact CD-OE1 3.32Å; L589-Q591 VanDerWaalsContact C-N 3.33Å; L589-Q591 PolarHBondContact O-N 3.45Å
592	T	83.8	Confident	88.1	Confident	19 Å²	19	38.3 Å²	38.3	12%	0.117	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-0.2	-177	70.7	0	0	0	0	113.4	M326 L589 L590 P594 Q595 Y607	M326-T592 HydrophobicContact CE-CG2 3.47Å; M326-T592 VanDerWaalsContact CE-CG2 3.47Å; L589-T592 WeakPolarHBondContact O-CA 3.45Å; L589-T592 PolarHBondContact O-N 3.14Å; L589-T592 PolarHBondContact O-OG1 2.97Å; L590-T592 PolarHBondContact O-N 3.32Å; T592-P594 VanDerWaalsContact C-CD 3.42Å; T592-Q595 VanDerWaalsContact O-CB 3.28Å; T592-Q595 WeakPolarHBondContact O-CB 3.22Å; T592-Q595 WeakPolarHBondContact O-CG 3.31Å; T592-Q595 PolarHBondContact O-N 3.34Å; T592-Y607 PolarHBondContact OG1-OH 3.14Å
593	L	86.1	Confident	88	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-49	-43	176	-176.2	71.4	0	0	0	114	L589 L590 Q595 L596 Y607 M608 Q635 L636 E639	L589-L593 PolarHBondContact O-N 3.48Å; L590-L593 WeakPolarHBondContact O-CB 3.13Å; L590-L593 PolarHBondContact O-N 3.18Å; L593-Q595 PolarHBondContact O-N 3.44Å; L593-Q595 VanDerWaalsContact O-N 3.09Å; L593-L596 WeakPolarHBondContact O-CB 3.14Å; L593-L596 PolarHBondContact O-N 3.06Å; L593-L596 VanDerWaalsContact O-N 3.13Å; L593-Y607 HydrophobicContact CD1-CE1 4.32Å; L593-M608 HydrophobicContact CD1-CE 3.69Å; L593-Q635 HydrophobicContact CD2-CB 4.15Å; L593-L636 HydrophobicContact CD1-CD2 4.28Å; L593-L636 HydrophobicContact CD2-CD2 4.08Å; L593-E639 HydrophobicContact CD2-CB 3.89Å; L593-E639 HydrophobicContact CD2-CG 4.24Å; L593-E639 HydrophobicContact CG-CB 4.38Å; L593-E639 HydrophobicContact CG-CG 4.2Å
594	P	85.1	Confident	88.1	Confident	63 Å²	63	39.3 Å²	39.3	41%	0.409	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-65.4	-15	-179.6	-22.4	35.4	0	0	0	114.5	T592 L596 R597	T592-P594 VanDerWaalsContact C-CD 3.42Å; P594-L596 VanDerWaalsContact C-N 3.27Å; P594-L596 PolarHBondContact O-N 3.33Å; P594-R597 WeakPolarHBondContact O-CD 3.24Å; P594-R597 WeakPolarHBondContact O-CG 3.36Å
595	Q	80	Confident	88.2	Confident	46 Å²	46	36.7 Å²	36.7	22%	0.215	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-73.9	-20.1	177.8	-54.5	-175.8	18.7	0	0	112	I233 T592 L593 R597 V599	I233-Q595 HydrophobicContact CG2-CG 4.11Å; T592-Q595 VanDerWaalsContact O-CB 3.28Å; T592-Q595 WeakPolarHBondContact O-CB 3.22Å; T592-Q595 WeakPolarHBondContact O-CG 3.31Å; T592-Q595 PolarHBondContact O-N 3.34Å; L593-Q595 PolarHBondContact O-N 3.44Å; L593-Q595 VanDerWaalsContact O-N 3.09Å; Q595-R597 VanDerWaalsContact C-N 3.25Å; Q595-R597 PolarHBondContact O-N 3.42Å; Q595-V599 WeakPolarHBondContact O-CG2 3.27Å
596	L	84.3	Confident	88.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-69.4	-19.2	-178.5	-85.1	67.3	0	0	0	113.8	L330 L593 P594 N598 V599 A604 Y607 M608 V659	L330-L596 HydrophobicContact CD1-CD1 4.02Å; L330-L596 HydrophobicContact CD1-CG 4.49Å; L330-L596 HydrophobicContact CD2-CD1 4.37Å; L330-L596 HydrophobicContact CD2-CG 4.21Å; L593-L596 WeakPolarHBondContact O-CB 3.14Å; L593-L596 PolarHBondContact O-N 3.06Å; L593-L596 VanDerWaalsContact O-N 3.13Å; P594-L596 VanDerWaalsContact C-N 3.27Å; P594-L596 PolarHBondContact O-N 3.33Å; L596-N598 PolarHBondContact O-N 2.91Å; L596-V599 VanDerWaalsContact O-CB 3.32Å; L596-V599 WeakPolarHBondContact O-CB 3.31Å; L596-V599 PolarHBondContact O-N 3.33Å; L596-A604 HydrophobicContact CD2-CB 3.96Å; L596-Y607 HydrophobicContact CD1-CD1 4.38Å; L596-Y607 HydrophobicContact CD1-CE1 4.04Å; L596-Y607 HydrophobicContact CD1-CE2 4.24Å; L596-Y607 HydrophobicContact CD2-CD1 3.46Å; L596-Y607 VanDerWaalsContact CD2-CD1 3.46Å; L596-Y607 HydrophobicContact CD2-CE1 3.65Å; L596-Y607 HydrophobicContact CD2-CG 4.06Å; L596-M608 HydrophobicContact CD2-CE 3.85Å; L596-V659 HydrophobicContact CB-CG1 4.17Å
597	R	83.6	Confident	88.3	Confident	95 Å²	95	36.4 Å²	36.4	36%	0.358	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-47.5	-36.2	-176	-70.8	176.3	-175.6	173.2	5.5	114.6	P594 Q595 E639 L656	P594-R597 WeakPolarHBondContact O-CD 3.24Å; P594-R597 WeakPolarHBondContact O-CG 3.36Å; Q595-R597 VanDerWaalsContact C-N 3.25Å; Q595-R597 PolarHBondContact O-N 3.42Å; R597-E639 WeakPolarHBondContact CD-OE1 3.48Å; R597-E639 WeakPolarHBondContact CG-OE1 3.19Å; R597-E639 IonicContact CZ-OE1 2.82Å; R597-E639 IonicContact CZ-OE2 3.76Å; R597-E639 IonicContact NE-OE1 3.49Å; R597-E639 PolarHBondContact NE-OE1 2.82Å; R597-E639 IonicContact NE-OE2 3.74Å; R597-E639 PolarHBondContact NE-OE2 3.45Å; R597-E639 IonicContact NH2-OE1 3.77Å; R597-E639 IonicContact NH2-OE2 3.69Å; R597-E639 PolarHBondContact NH2-OE2 2.78Å; R597-L656 HydrophobicContact CB-CD1 4.2Å; R597-L656 HydrophobicContact CG-CD1 4.22Å; R597-L656 WeakPolarHBondContact O-CA 3.41Å; R597-L656 WeakPolarHBondContact O-CB 3.37Å; R597-L656 PolarHBondContact O-N 2.97Å
598	N	82	Confident	88.4	Confident	120 Å²	120	32.7 Å²	32.7	64%	0.642	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-103.2	9.1	-175.8	-60.9	-21.8	0	0	0	113.4	L596	L596-N598 PolarHBondContact O-N 2.91Å
599	V	81.9	Confident	88.6	Confident	10 Å²	10	28.7 Å²	28.7	6%	0.061	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-29.6	-166.6	-176.7	0	0	0	0	113	I230 L330 Q595 L596 R603	I230-V599 HydrophobicContact CD1-CG2 4.33Å; L330-V599 HydrophobicContact CB-CG1 4.25Å; L330-V599 HydrophobicContact CD2-CG1 4.27Å; Q595-V599 WeakPolarHBondContact O-CG2 3.27Å; L596-V599 VanDerWaalsContact O-CB 3.32Å; L596-V599 WeakPolarHBondContact O-CB 3.31Å; L596-V599 PolarHBondContact O-N 3.33Å; V599-R603 HydrophobicContact CG1-CB 3.75Å; V599-R603 PolarHBondContact O-NH1 3.45Å
600	G	85.9	Confident	88.7	Confident	12 Å²	12	28.6 Å²	28.6	12%	0.124	15%	0.145	C	C	.	.			trans	93	151.4	-179.5	0	0	0	0	0	113.6	V602 R603 A604	G600-V602 PolarHBondContact O-N 3.03Å; G600-R603 PolarHBondContact O-N 3.01Å; G600-A604 PolarHBondContact O-N 3.46Å
601	G	87.8	Confident	88.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-47	-168.3	0	0	0	0	0	114	R603 A604 I605 E658	G601-R603 PolarHBondContact O-N 3.42Å; G601-A604 PolarHBondContact O-N 3.18Å; G601-I605 WeakPolarHBondContact O-CG1 3.37Å; G601-I605 PolarHBondContact O-N 2.86Å; G601-E658 PolarHBondContact N-OE2 3.09Å
602	V	89.9	Confident	89.1	Confident	56 Å²	56	24.1 Å²	24.1	34%	0.339	13%	0.125	S	C	.	.	H	α-helix	trans	-57.8	-37.2	-178.9	-179.9	0	0	0	0	111.9	G600 P606 M744 F761	G600-V602 PolarHBondContact O-N 3.03Å; V602-P606 WeakPolarHBondContact O-CD 3.39Å; V602-M744 HydrophobicContact CG1-CE 3.9Å; V602-F761 HydrophobicContact CG2-CD2 3.83Å; V602-F761 HydrophobicContact CG2-CE2 3.72Å
603	R	90.5	Very high	89.5	Confident	60 Å²	60	23.8 Å²	23.8	23%	0.226	12%	0.122	C	C	.	.	H	α-helix	trans	-81.3	-19.9	179.6	-71.8	169.9	62.7	-149.5	9.2	113.5	L330 V599 G600 G601	L330-R603 VanDerWaalsContact O-CZ 3.32Å; L330-R603 PolarHBondContact O-NE 3.11Å; L330-R603 PolarHBondContact O-NH2 2.94Å; V599-R603 HydrophobicContact CG1-CB 3.75Å; V599-R603 PolarHBondContact O-NH1 3.45Å; G600-R603 PolarHBondContact O-N 3.01Å; G601-R603 PolarHBondContact O-N 3.42Å
604	A	93.3	Very high	89.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-79.2	-21	171.3	0	0	0	0	0	113.1	L596 G600 G601 Y607 M608 V659	L596-A604 HydrophobicContact CD2-CB 3.96Å; G600-A604 PolarHBondContact O-N 3.46Å; G601-A604 PolarHBondContact O-N 3.18Å; A604-Y607 PolarHBondContact O-N 2.96Å; A604-M608 WeakPolarHBondContact O-CB 3.34Å; A604-M608 VanDerWaalsContact O-CG 3.24Å; A604-M608 WeakPolarHBondContact O-CG 2.92Å; A604-M608 PolarHBondContact O-N 3.14Å; A604-V659 HydrophobicContact CB-CG2 3.94Å
605	I	95	Very high	90	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.8	-51	-177.7	-75.2	167.6	0	0	0	113.1	F338 G601 Y607 M608 Q609 V662 M744 F747 F748 F761	F338-I605 HydrophobicContact CE1-CG2 4.23Å; F338-I605 HydrophobicContact CZ-CG2 4.26Å; G601-I605 WeakPolarHBondContact O-CG1 3.37Å; G601-I605 PolarHBondContact O-N 2.86Å; I605-Y607 VanDerWaalsContact C-N 3.31Å; I605-Y607 PolarHBondContact O-N 3.02Å; I605-M608 PolarHBondContact O-N 3.17Å; I605-Q609 HydrophobicContact CG2-CG 4.33Å; I605-Q609 WeakPolarHBondContact O-CB 3.11Å; I605-Q609 VanDerWaalsContact O-CG 3.31Å; I605-Q609 WeakPolarHBondContact O-CG 3.39Å; I605-Q609 PolarHBondContact O-N 3.41Å; I605-V662 HydrophobicContact CG1-CG1 4.26Å; I605-V662 HydrophobicContact CG1-CG2 4.04Å; I605-M744 HydrophobicContact CD1-CB 4.26Å; I605-M744 HydrophobicContact CD1-CG 4.21Å; I605-M744 HydrophobicContact CD1-SD 3.56Å; I605-M744 VanDerWaalsContact CD1-SD 3.56Å; I605-M744 HydrophobicContact CG2-CB 3.95Å; I605-M744 HydrophobicContact CG2-CG 4.05Å; I605-F747 HydrophobicContact CG1-CD2 4.23Å; I605-F747 HydrophobicContact CG2-CD2 4.15Å; I605-F748 HydrophobicContact CD1-CD2 3.94Å; I605-F748 HydrophobicContact CD1-CE2 3.75Å; I605-F761 HydrophobicContact CD1-CE2 4.33Å; I605-F761 HydrophobicContact CD1-CZ 4.4Å
606	P	94.6	Very high	90.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.5	-43	176.9	-26.8	36	0	0	0	112.8	L329 F338 K341 V602 Q609 V610	L329-P606 HydrophobicContact CD2-CB 4.1Å; F338-P606 HydrophobicContact CD1-CG 4.12Å; F338-P606 HydrophobicContact CD2-CG 3.91Å; F338-P606 HydrophobicContact CE1-CG 3.9Å; F338-P606 HydrophobicContact CE2-CG 3.67Å; F338-P606 HydrophobicContact CG-CG 4.14Å; F338-P606 HydrophobicContact CZ-CG 3.67Å; K341-P606 HydrophobicContact CB-CB 3.98Å; K341-P606 HydrophobicContact CG-CB 4.36Å; K341-P606 WeakPolarHBondContact CG-O 3.3Å; V602-P606 WeakPolarHBondContact O-CD 3.39Å; P606-Q609 PolarHBondContact O-N 3.36Å; P606-V610 PolarHBondContact O-N 3.26Å; P606-V610 VanDerWaalsContact O-N 3.14Å
607	Y	94.9	Very high	90	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.6	-47.4	177.2	178.1	-85.3	0	0	0	112.1	L329 L330 L589 T592 L593 L596 A604 I605 Q609 V610 I611	L329-Y607 HydrophobicContact CD1-CD2 4.39Å; L330-Y607 HydrophobicContact CD2-CD2 4.14Å; L330-Y607 HydrophobicContact CD2-CG 4.16Å; L589-Y607 HydrophobicContact CB-CE2 4.49Å; L589-Y607 HydrophobicContact CD2-CD2 4.45Å; L589-Y607 HydrophobicContact CD2-CE2 3.8Å; L589-Y607 PolarHBondContact O-OH 3.16Å; T592-Y607 PolarHBondContact OG1-OH 3.14Å; L593-Y607 HydrophobicContact CD1-CE1 4.32Å; L596-Y607 HydrophobicContact CD1-CD1 4.38Å; L596-Y607 HydrophobicContact CD1-CE1 4.04Å; L596-Y607 HydrophobicContact CD1-CE2 4.24Å; L596-Y607 HydrophobicContact CD2-CD1 3.46Å; L596-Y607 VanDerWaalsContact CD2-CD1 3.46Å; L596-Y607 HydrophobicContact CD2-CE1 3.65Å; L596-Y607 HydrophobicContact CD2-CG 4.06Å; A604-Y607 PolarHBondContact O-N 2.96Å; I605-Y607 VanDerWaalsContact C-N 3.31Å; I605-Y607 PolarHBondContact O-N 3.02Å; Y607-Q609 VanDerWaalsContact C-N 3.34Å; Y607-Q609 PolarHBondContact O-N 2.76Å; Y607-V610 PolarHBondContact O-N 3.04Å; Y607-V610 VanDerWaalsContact O-N 3.15Å; Y607-I611 HydrophobicContact CD1-CD1 3.97Å; Y607-I611 HydrophobicContact CE1-CD1 3.4Å; Y607-I611 VanDerWaalsContact CE1-CD1 3.4Å; Y607-I611 HydrophobicContact CE1-CG1 4.38Å; Y607-I611 PolarHBondContact O-N 2.97Å; Y607-I611 VanDerWaalsContact O-N 3.13Å
608	M	95.3	Very high	90.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.7	-30.3	178.6	-67	-72.8	179.5	0	0	112.5	L593 L596 A604 I605 V610 I611 L612 V662 V663 L666 F747	L593-M608 HydrophobicContact CD1-CE 3.69Å; L596-M608 HydrophobicContact CD2-CE 3.85Å; A604-M608 WeakPolarHBondContact O-CB 3.34Å; A604-M608 VanDerWaalsContact O-CG 3.24Å; A604-M608 WeakPolarHBondContact O-CG 2.92Å; A604-M608 PolarHBondContact O-N 3.14Å; I605-M608 PolarHBondContact O-N 3.17Å; M608-V610 VanDerWaalsContact C-N 3.33Å; M608-I611 PolarHBondContact O-N 3.36Å; M608-I611 HydrophobicContact SD-CD1 4.47Å; M608-L612 VanDerWaalsContact O-CB 3.31Å; M608-L612 WeakPolarHBondContact O-CB 3.24Å; M608-L612 PolarHBondContact O-N 3.02Å; M608-V662 HydrophobicContact CB-CG1 3.95Å; M608-V662 HydrophobicContact CG-CG1 3.78Å; M608-V663 HydrophobicContact CE-CG2 3.54Å; M608-V663 HydrophobicContact SD-CG2 4.45Å; M608-L666 HydrophobicContact SD-CD2 3.77Å; M608-F747 HydrophobicContact CB-CE2 3.51Å; M608-F747 HydrophobicContact CB-CZ 3.64Å
609	Q	95.2	Very high	90.2	Very high	9 Å²	9	16.9 Å²	16.9	4%	0.042	9%	0.092	C	C	.	.	H	α-helix	trans	-66.5	-32.5	171.4	-74.4	170.5	-47	0	0	112.1	K341 I605 P606 Y607 M613 D743 S745 F747	K341-Q609 HydrophobicContact CD-CB 3.72Å; K341-Q609 HydrophobicContact CD-CG 4.29Å; K341-Q609 HydrophobicContact CG-CB 3.96Å; I605-Q609 HydrophobicContact CG2-CG 4.33Å; I605-Q609 WeakPolarHBondContact O-CB 3.11Å; I605-Q609 VanDerWaalsContact O-CG 3.31Å; I605-Q609 WeakPolarHBondContact O-CG 3.39Å; I605-Q609 PolarHBondContact O-N 3.41Å; P606-Q609 PolarHBondContact O-N 3.36Å; Y607-Q609 VanDerWaalsContact C-N 3.34Å; Y607-Q609 PolarHBondContact O-N 2.76Å; Q609-M613 PolarHBondContact O-N 3.46Å; Q609-D743 PolarHBondContact NE2-O 3.47Å; Q609-S745 PolarHBondContact NE2-O 3.3Å; Q609-F747 HydrophobicContact CG-CD2 4.23Å; Q609-F747 HydrophobicContact CG-CE2 3.74Å
610	V	95	Very high	90.1	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-71.6	-42.9	173.6	173.3	0	0	0	0	111.3	L329 K341 L344 L589 P606 Y607 M608 L612 M613 L614	L329-V610 HydrophobicContact CD1-CB 4.47Å; L329-V610 HydrophobicContact CD1-CG2 4.16Å; L329-V610 HydrophobicContact CD2-CG2 3.87Å; K341-V610 HydrophobicContact CB-CG2 4.27Å; K341-V610 HydrophobicContact CG-CG2 3.84Å; L344-V610 HydrophobicContact CB-CG2 4.16Å; L344-V610 HydrophobicContact CD1-CG1 4.47Å; L344-V610 HydrophobicContact CD1-CG2 4.12Å; L589-V610 HydrophobicContact CD1-CG1 4.16Å; P606-V610 PolarHBondContact O-N 3.26Å; P606-V610 VanDerWaalsContact O-N 3.14Å; Y607-V610 PolarHBondContact O-N 3.04Å; Y607-V610 VanDerWaalsContact O-N 3.15Å; M608-V610 VanDerWaalsContact C-N 3.33Å; V610-L612 VanDerWaalsContact C-N 3.32Å; V610-L612 PolarHBondContact O-N 2.84Å; V610-M613 HydrophobicContact CG1-CE 4.17Å; V610-M613 PolarHBondContact O-N 2.95Å; V610-M613 VanDerWaalsContact O-N 3.12Å; V610-L614 HydrophobicContact CG1-CD1 4.15Å; V610-L614 HydrophobicContact CG1-CG 4.46Å; V610-L614 PolarHBondContact O-N 2.87Å
611	I	94.6	Very high	89.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-42.8	172.5	-67.7	178.2	0	0	0	111	L586 Y607 M608 M613 L614 T615 L632 L666	L586-I611 HydrophobicContact CD1-CG2 4.28Å; Y607-I611 HydrophobicContact CD1-CD1 3.97Å; Y607-I611 HydrophobicContact CE1-CD1 3.4Å; Y607-I611 VanDerWaalsContact CE1-CD1 3.4Å; Y607-I611 HydrophobicContact CE1-CG1 4.38Å; Y607-I611 PolarHBondContact O-N 2.97Å; Y607-I611 VanDerWaalsContact O-N 3.13Å; M608-I611 PolarHBondContact O-N 3.36Å; M608-I611 HydrophobicContact SD-CD1 4.47Å; I611-M613 PolarHBondContact O-N 2.72Å; I611-L614 PolarHBondContact O-N 2.96Å; I611-T615 WeakPolarHBondContact O-CG2 3.27Å; I611-T615 PolarHBondContact O-N 3.46Å; I611-T615 PolarHBondContact O-OG1 3.39Å; I611-L632 HydrophobicContact CG2-CD1 3.79Å; I611-L666 HydrophobicContact CG2-CD2 4.15Å
612	L	93.4	Very high	89.8	Confident	13 Å²	13	27 Å²	27	7%	0.068	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-26.6	176.7	179.8	61.5	0	0	0	113.6	M608 V610 T615 L666 V669 F670 R673 P746 F747	M608-L612 VanDerWaalsContact O-CB 3.31Å; M608-L612 WeakPolarHBondContact O-CB 3.24Å; M608-L612 PolarHBondContact O-N 3.02Å; V610-L612 VanDerWaalsContact C-N 3.32Å; V610-L612 PolarHBondContact O-N 2.84Å; L612-T615 PolarHBondContact O-OG1 3.42Å; L612-L666 HydrophobicContact CB-CD1 3.82Å; L612-L666 HydrophobicContact CD1-CD1 3.82Å; L612-L666 HydrophobicContact CG-CD1 4.28Å; L612-V669 HydrophobicContact CD1-CG1 3.66Å; L612-V669 HydrophobicContact CD2-CG1 4.03Å; L612-F670 HydrophobicContact CD1-CD1 4.02Å; L612-F670 HydrophobicContact CD1-CE1 3.71Å; L612-R673 PolarHBondContact O-NH2 3.33Å; L612-P746 VanDerWaalsContact CD2-CD 3.47Å; L612-P746 HydrophobicContact CD2-CG 3.42Å; L612-P746 VanDerWaalsContact CD2-CG 3.42Å; L612-F747 HydrophobicContact CD2-CE1 4.22Å; L612-F747 HydrophobicContact CD2-CZ 4.24Å
613	M	91.6	Very high	89.8	Confident	11 Å²	11	31 Å²	31	5%	0.054	16%	0.156	C	C	.	.	H	α-helix	trans	-82.3	-44.3	173	175.6	-80.1	-52.2	0	0	111.7	I345 L348 Q609 V610 I611 T615 T616	I345-M613 HydrophobicContact CB-CG 4.34Å; I345-M613 HydrophobicContact CD1-CB 4.21Å; I345-M613 HydrophobicContact CG1-CB 3.91Å; I345-M613 HydrophobicContact CG1-CE 4.33Å; I345-M613 HydrophobicContact CG1-CG 3.94Å; I345-M613 HydrophobicContact CG2-CG 4.17Å; L348-M613 HydrophobicContact CB-CE 3.67Å; L348-M613 HydrophobicContact CB-SD 3.83Å; L348-M613 HydrophobicContact CD1-CE 3.81Å; L348-M613 HydrophobicContact CG-CE 4.38Å; Q609-M613 PolarHBondContact O-N 3.46Å; V610-M613 HydrophobicContact CG1-CE 4.17Å; V610-M613 PolarHBondContact O-N 2.95Å; V610-M613 VanDerWaalsContact O-N 3.12Å; I611-M613 PolarHBondContact O-N 2.72Å; M613-T615 PolarHBondContact O-N 2.97Å; M613-T616 PolarHBondContact O-N 2.85Å; M613-T616 PolarHBondContact O-OG1 3.41Å
614	L	91.9	Very high	89.7	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-19.6	177	-71.2	170.9	0	0	0	113.5	L348 R582 L585 L586 L589 V610 I611	L348-L614 HydrophobicContact CD1-CD2 4.22Å; R582-L614 HydrophobicContact CB-CD2 3.84Å; R582-L614 HydrophobicContact CG-CD2 4.03Å; L585-L614 HydrophobicContact CG-CD1 4.3Å; L586-L614 HydrophobicContact CB-CB 4.36Å; L586-L614 HydrophobicContact CB-CD1 4.12Å; L586-L614 HydrophobicContact CD1-CB 4.15Å; L586-L614 HydrophobicContact CD1-CD1 4.32Å; L589-L614 HydrophobicContact CD1-CD1 3.76Å; V610-L614 HydrophobicContact CG1-CD1 4.15Å; V610-L614 HydrophobicContact CG1-CG 4.46Å; V610-L614 PolarHBondContact O-N 2.87Å; I611-L614 PolarHBondContact O-N 2.96Å
615	T	90.4	Very high	89.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.7	173.2	56.5	0	0	0	0	115.6	I611 L612 M613 D617 L618 L632 F670 R673 I689	I611-T615 WeakPolarHBondContact O-CG2 3.27Å; I611-T615 PolarHBondContact O-N 3.46Å; I611-T615 PolarHBondContact O-OG1 3.39Å; L612-T615 PolarHBondContact O-OG1 3.42Å; M613-T615 PolarHBondContact O-N 2.97Å; T615-D617 PolarHBondContact O-N 2.96Å; T615-L618 HydrophobicContact CG2-CD1 4.15Å; T615-L632 HydrophobicContact CG2-CD2 3.25Å; T615-F670 HydrophobicContact CG2-CE1 4.08Å; T615-F670 HydrophobicContact CG2-CZ 3.93Å; T615-F670 WeakPolarHBondContact OG1-CE1 3.42Å; T615-R673 PolarHBondContact OG1-NH1 2.89Å; T615-I689 WeakPolarHBondContact O-CD1 3.43Å
616	T	85.4	Confident	89.4	Confident	63 Å²	63	38.5 Å²	38.5	39%	0.387	19%	0.19	S	C	.	.	S	Bend	trans	-73.9	-15.7	177.2	51.4	0	0	0	0	113.3	M613 R673	M613-T616 PolarHBondContact O-N 2.85Å; M613-T616 PolarHBondContact O-OG1 3.41Å; T616-R673 VanDerWaalsContact CG2-NH2 3.29Å
617	D	78.9	Confident	89.3	Confident	29 Å²	29	40.3 Å²	40.3	16%	0.155	21%	0.209	C	C	.	.	S	Bend	trans	-116.3	0.6	-162.2	-47.9	-14.8	0	0	0	112.6	P350 H579 R582 T615 D619	P350-D617 VanDerWaalsContact CD-CG 3.46Å; P350-D617 WeakPolarHBondContact CD-OD1 3.48Å; P350-D617 WeakPolarHBondContact CD-OD2 3.42Å; P350-D617 HydrophobicContact CG-CB 4.09Å; P350-D617 WeakPolarHBondContact CG-OD1 3.47Å; P350-D617 VanDerWaalsContact CG-OD2 3.23Å; P350-D617 WeakPolarHBondContact CG-OD2 3.48Å; H579-D617 PolarHBondContact CE1-O 3.34Å; R582-D617 WeakPolarHBondContact CD-OD2 3.43Å; R582-D617 IonicContact CZ-OD2 2.8Å; R582-D617 IonicContact NE-OD2 3.22Å; R582-D617 PolarHBondContact NE-OD2 3.44Å; R582-D617 IonicContact NH1-OD2 2.68Å; R582-D617 IonicContact NH2-OD2 3.95Å; T615-D617 PolarHBondContact O-N 2.96Å; D617-D619 PolarHBondContact O-N 2.96Å
618	L	86.8	Confident	89.2	Confident	9 Å²	9	40.5 Å²	40.5	5%	0.047	21%	0.211	C	C	.	.			trans	-71.5	121.2	179.7	-65	172.9	0	0	0	109.7	L583 L586 T615 D625 L629	L583-L618 HydrophobicContact CD1-CD2 3.99Å; L586-L618 HydrophobicContact CD2-CD1 4.41Å; T615-L618 HydrophobicContact CG2-CD1 4.15Å; L618-D625 WeakPolarHBondContact CA-OD2 3.31Å; L618-D625 HydrophobicContact CB-CB 4.25Å; L618-D625 HydrophobicContact CD2-CB 4.04Å; L618-L629 HydrophobicContact CD1-CB 4.22Å
619	D	82.7	Confident	89.2	Confident	78 Å²	78	41.2 Å²	41.2	42%	0.417	22%	0.215	S	C	.	.			trans	-73.4	138.9	176.8	-157.8	-34.1	0	0	0	110.5	D617 E621 D622 D625	D617-D619 PolarHBondContact O-N 2.96Å; D619-E621 VanDerWaalsContact C-N 3.29Å; D619-E621 PolarHBondContact OD1-N 3.14Å; D619-D622 HydrophobicContact CB-CB 4.35Å; D619-D625 PolarHBondContact N-OD2 3.21Å; D619-D625 WeakPolarHBondContact O-CB 3.46Å
620	G	78.5	Confident	89.1	Confident	10 Å²	10	45.1 Å²	45.1	10%	0.103	24%	0.236	C	C	.	.	S	Bend	trans	-71.4	-23.5	171.9	0	0	0	0	0	113.4	K626	G620-K626 WeakPolarHBondContact O-CE 3.37Å; G620-K626 PolarHBondContact O-NZ 2.7Å
621	E	80.3	Confident	89.1	Confident	156 Å²	156	48 Å²	48	73%	0.729	25%	0.251	S	S	*	.	S	Bend	trans	-91.7	-30.3	-175.3	-62.1	-59.7	123.4	0	0	113.1	D619 K626	D619-E621 VanDerWaalsContact C-N 3.29Å; D619-E621 PolarHBondContact OD1-N 3.14Å; E621-K626 PolarHBondContact O-NZ 2.64Å
622	D	87.6	Confident	89.1	Confident	68 Å²	68	48 Å²	48	36%	0.364	25%	0.251	S	S	.	.			trans	-76.6	133.1	177.7	-166.6	-66.1	0	0	0	112.1	D619 K624 D625 K626	D619-D622 HydrophobicContact CB-CB 4.35Å; D622-K624 WeakPolarHBondContact OD1-CA 3.45Å; D622-K624 VanDerWaalsContact OD1-CB 3.24Å; D622-K624 WeakPolarHBondContact OD1-CB 3.38Å; D622-K624 WeakPolarHBondContact OD1-CG 3.48Å; D622-K624 PolarHBondContact OD1-N 3.32Å; D622-D625 HydrophobicContact CB-CB 4.29Å; D622-K626 WeakPolarHBondContact O-CG 3.3Å; D622-K626 PolarHBondContact O-N 2.92Å; D622-K626 VanDerWaalsContact O-N 3.16Å; D622-K626 PolarHBondContact O-NZ 3.12Å
623	E	89.4	Confident	89.2	Confident	141 Å²	141	47.4 Å²	47.4	66%	0.659	25%	0.248	S	C	*	.	H	α-helix	trans	-72.3	-25.1	-178	-67.1	-64.5	110.2	0	0	113.6	K626 G627	E623-K626 WeakPolarHBondContact OE1-CD 3.39Å; E623-K626 WeakPolarHBondContact OE1-CE 3.46Å; E623-K626 IonicContact OE1-NZ 2.69Å; E623-K626 PolarHBondContact OE1-NZ 3.44Å; E623-G627 PolarHBondContact O-N 3.35Å
624	K	89.3	Confident	89.3	Confident	147 Å²	147	50.4 Å²	50.4	64%	0.639	27%	0.27	S	S	*	.	H	α-helix	trans	-74.1	-40.7	175.7	-57.7	169.4	-175.3	162.6	0	110.8	L583 D622 G627 A628	L583-K624 HydrophobicContact CD2-CB 4.15Å; D622-K624 WeakPolarHBondContact OD1-CA 3.45Å; D622-K624 VanDerWaalsContact OD1-CB 3.24Å; D622-K624 WeakPolarHBondContact OD1-CB 3.38Å; D622-K624 WeakPolarHBondContact OD1-CG 3.48Å; D622-K624 PolarHBondContact OD1-N 3.32Å; K624-G627 CarbonylContact O-C 3.6Å; K624-G627 PolarHBondContact O-N 3.08Å; K624-A628 WeakPolarHBondContact O-CB 3.38Å; K624-A628 PolarHBondContact O-N 2.96Å
625	D	91.2	Very high	89.4	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-40.4	177.9	-77.4	23.2	0	0	0	110.7	H579 L618 D619 D622 A628 L629	H579-D625 IonicContact CD2-OD1 3.01Å; H579-D625 IonicContact CE1-OD1 3.27Å; H579-D625 IonicContact CE1-OD2 2.8Å; H579-D625 PolarHBondContact CE1-OD2 2.95Å; H579-D625 VanDerWaalsContact NE2-CG 3.31Å; H579-D625 IonicContact NE2-OD1 3.58Å; H579-D625 PolarHBondContact NE2-OD1 2.87Å; H579-D625 IonicContact NE2-OD2 2.87Å; H579-D625 PolarHBondContact NE2-OD2 3.15Å; L618-D625 WeakPolarHBondContact CA-OD2 3.31Å; L618-D625 HydrophobicContact CB-CB 4.25Å; L618-D625 HydrophobicContact CD2-CB 4.04Å; D619-D625 PolarHBondContact N-OD2 3.21Å; D619-D625 WeakPolarHBondContact O-CB 3.46Å; D622-D625 HydrophobicContact CB-CB 4.29Å; D625-A628 PolarHBondContact O-N 3.17Å; D625-L629 WeakPolarHBondContact O-CB 3.35Å; D625-L629 PolarHBondContact O-N 3.03Å
626	K	90.4	Very high	89.6	Confident	66 Å²	66	52.5 Å²	52.5	29%	0.287	28%	0.28	S	S	.	.	H	α-helix	trans	-55.4	-52.3	165.3	-70.2	-175.8	-161.6	72.4	0	111.8	G620 E621 D622 E623 A628 L629 D630	G620-K626 WeakPolarHBondContact O-CE 3.37Å; G620-K626 PolarHBondContact O-NZ 2.7Å; E621-K626 PolarHBondContact O-NZ 2.64Å; D622-K626 WeakPolarHBondContact O-CG 3.3Å; D622-K626 PolarHBondContact O-N 2.92Å; D622-K626 VanDerWaalsContact O-N 3.16Å; D622-K626 PolarHBondContact O-NZ 3.12Å; E623-K626 WeakPolarHBondContact OE1-CD 3.39Å; E623-K626 WeakPolarHBondContact OE1-CE 3.46Å; E623-K626 IonicContact OE1-NZ 2.69Å; E623-K626 PolarHBondContact OE1-NZ 3.44Å; K626-A628 VanDerWaalsContact C-N 3.3Å; K626-A628 PolarHBondContact O-N 3.29Å; K626-L629 WeakPolarHBondContact O-CB 3.28Å; K626-L629 PolarHBondContact O-N 2.99Å; K626-L629 VanDerWaalsContact O-N 3.1Å; K626-D630 PolarHBondContact O-N 3.34Å
627	G	92.3	Very high	90	Very high	39 Å²	39	50.2 Å²	50.2	40%	0.402	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-36.7	-179.3	0	0	0	0	0	113.5	E623 K624 N631	E623-G627 PolarHBondContact O-N 3.35Å; K624-G627 CarbonylContact O-C 3.6Å; K624-G627 PolarHBondContact O-N 3.08Å; G627-N631 WeakPolarHBondContact O-CB 3.35Å; G627-N631 PolarHBondContact O-N 2.86Å
628	A	93.3	Very high	90.6	Very high	3 Å²	3	51.9 Å²	51.9	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-37.1	174.3	0	0	0	0	0	112.3	L583 K624 D625 K626 L632	L583-A628 HydrophobicContact CD1-CB 3.53Å; L583-A628 HydrophobicContact CG-CB 4.49Å; K624-A628 WeakPolarHBondContact O-CB 3.38Å; K624-A628 PolarHBondContact O-N 2.96Å; D625-A628 PolarHBondContact O-N 3.17Å; K626-A628 VanDerWaalsContact C-N 3.3Å; K626-A628 PolarHBondContact O-N 3.29Å; A628-L632 WeakPolarHBondContact O-CB 3.05Å; A628-L632 PolarHBondContact O-N 3.45Å
629	L	94.2	Very high	90.8	Very high	16 Å²	16	51.9 Å²	51.9	8%	0.084	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-45.5	172.6	177.8	61.2	0	0	0	111.9	L618 D625 K626 L632 L633 I689 A692	L618-L629 HydrophobicContact CD1-CB 4.22Å; D625-L629 WeakPolarHBondContact O-CB 3.35Å; D625-L629 PolarHBondContact O-N 3.03Å; K626-L629 WeakPolarHBondContact O-CB 3.28Å; K626-L629 PolarHBondContact O-N 2.99Å; K626-L629 VanDerWaalsContact O-N 3.1Å; L629-L632 HydrophobicContact CD1-CD2 4.28Å; L629-L632 WeakPolarHBondContact O-CB 3.35Å; L629-L632 PolarHBondContact O-N 3.46Å; L629-L633 HydrophobicContact CD1-CD1 4.09Å; L629-L633 HydrophobicContact CD1-CG 4.18Å; L629-L633 HydrophobicContact CG-CD1 4.12Å; L629-L633 WeakPolarHBondContact O-CB 3.44Å; L629-L633 VanDerWaalsContact O-CG 3.32Å; L629-L633 WeakPolarHBondContact O-CG 3.07Å; L629-L633 PolarHBondContact O-N 2.88Å; L629-I689 HydrophobicContact CD1-CG1 4.4Å; L629-I689 HydrophobicContact CD1-CG2 4.5Å; L629-I689 HydrophobicContact CD2-CG1 4.06Å; L629-A692 HydrophobicContact CD2-CB 3.97Å
630	D	93.3	Very high	91	Very high	91 Å²	91	48.2 Å²	48.2	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-66.1	-38.7	178.1	-76.1	-22	0	0	0	111.6	K626 S634	K626-D630 PolarHBondContact O-N 3.34Å; D630-S634 VanDerWaalsContact O-CB 3.23Å; D630-S634 WeakPolarHBondContact O-CB 3.36Å; D630-S634 PolarHBondContact O-N 3.11Å; D630-S634 PolarHBondContact O-OG 3.35Å
631	N	94.9	Very high	91.3	Very high	60 Å²	60	48 Å²	48	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-45.8	172.8	-174.2	18.5	0	0	0	111.8	G627 S634 Q635	G627-N631 WeakPolarHBondContact O-CB 3.35Å; G627-N631 PolarHBondContact O-N 2.86Å; N631-S634 PolarHBondContact O-N 2.94Å; N631-Q635 WeakPolarHBondContact O-CG 3.19Å; N631-Q635 PolarHBondContact O-N 2.59Å; N631-Q635 PolarHBondContact OD1-NE2 2.92Å
632	L	95.6	Very high	91.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-52.8	173.6	165.2	66.2	0	0	0	111.7	L590 I611 T615 A628 L629 Q635 L636 F670	L590-L632 HydrophobicContact CD1-CB 3.85Å; L590-L632 HydrophobicContact CD1-CD1 4.08Å; L590-L632 HydrophobicContact CD2-CD1 3.5Å; L590-L632 HydrophobicContact CG-CD1 4.32Å; I611-L632 HydrophobicContact CG2-CD1 3.79Å; T615-L632 HydrophobicContact CG2-CD2 3.25Å; A628-L632 WeakPolarHBondContact O-CB 3.05Å; A628-L632 PolarHBondContact O-N 3.45Å; L629-L632 HydrophobicContact CD1-CD2 4.28Å; L629-L632 WeakPolarHBondContact O-CB 3.35Å; L629-L632 PolarHBondContact O-N 3.46Å; L632-Q635 PolarHBondContact O-N 2.92Å; L632-L636 HydrophobicContact CD1-CD1 3.65Å; L632-L636 HydrophobicContact CD1-CG 3.96Å; L632-L636 HydrophobicContact CG-CD1 4.11Å; L632-L636 WeakPolarHBondContact O-CG 3.39Å; L632-L636 PolarHBondContact O-N 2.9Å; L632-F670 HydrophobicContact CD2-CE2 4.24Å; L632-F670 HydrophobicContact CD2-CZ 4.12Å
633	L	95.2	Very high	90.2	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-43.7	-179.2	-70.5	173.9	0	0	0	111.1	L629 Q635 L636 I637 L667 F670 A692 T693 A696	L629-L633 HydrophobicContact CD1-CD1 4.09Å; L629-L633 HydrophobicContact CD1-CG 4.18Å; L629-L633 HydrophobicContact CG-CD1 4.12Å; L629-L633 WeakPolarHBondContact O-CB 3.44Å; L629-L633 VanDerWaalsContact O-CG 3.32Å; L629-L633 WeakPolarHBondContact O-CG 3.07Å; L629-L633 PolarHBondContact O-N 2.88Å; L633-Q635 PolarHBondContact O-N 2.79Å; L633-L636 PolarHBondContact O-N 3.44Å; L633-I637 WeakPolarHBondContact O-CB 3.25Å; L633-I637 VanDerWaalsContact O-CG1 3.25Å; L633-I637 WeakPolarHBondContact O-CG1 3.25Å; L633-I637 PolarHBondContact O-N 3.43Å; L633-L667 HydrophobicContact CD2-CD2 3.92Å; L633-F670 HydrophobicContact CD2-CD2 4.29Å; L633-A692 HydrophobicContact CD1-CB 3.97Å; L633-T693 HydrophobicContact CD2-CG2 3.99Å; L633-A696 HydrophobicContact CB-CB 4.22Å; L633-A696 HydrophobicContact CD1-CB 4.17Å
634	S	94.6	Very high	89.2	Confident	74 Å²	74	42.9 Å²	42.9	52%	0.517	24%	0.237	S	C	.	.	H	α-helix	trans	-58.5	-44.8	176.3	-61.4	0	0	0	0	112.2	D630 N631 A638	D630-S634 VanDerWaalsContact O-CB 3.23Å; D630-S634 WeakPolarHBondContact O-CB 3.36Å; D630-S634 PolarHBondContact O-N 3.11Å; D630-S634 PolarHBondContact O-OG 3.35Å; N631-S634 PolarHBondContact O-N 2.94Å; S634-A638 VanDerWaalsContact O-CB 3.25Å; S634-A638 WeakPolarHBondContact O-CB 3.43Å; S634-A638 PolarHBondContact O-N 3.12Å
635	Q	94.2	Very high	87.8	Confident	48 Å²	48	45.5 Å²	45.5	22%	0.224	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-40.4	179.6	-70.4	-171.1	52.1	0	0	112.9	L590 L593 N631 L632 L633 I637 A638 E639	L590-Q635 VanDerWaalsContact C-OE1 3.25Å; L590-Q635 PolarHBondContact O-OE1 3.19Å; L593-Q635 HydrophobicContact CD2-CB 4.15Å; N631-Q635 WeakPolarHBondContact O-CG 3.19Å; N631-Q635 PolarHBondContact O-N 2.59Å; N631-Q635 PolarHBondContact OD1-NE2 2.92Å; L632-Q635 PolarHBondContact O-N 2.92Å; L633-Q635 PolarHBondContact O-N 2.79Å; Q635-I637 VanDerWaalsContact C-N 3.33Å; Q635-I637 PolarHBondContact O-N 3.43Å; Q635-A638 PolarHBondContact O-N 2.87Å; Q635-E639 WeakPolarHBondContact O-CB 3.33Å; Q635-E639 PolarHBondContact O-N 3.03Å
636	L	94.3	Very high	86.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-39.4	174.8	-70.5	175.8	0	0	0	112.1	L593 L632 L633 L640 V663 L666 L667 F670	L593-L636 HydrophobicContact CD1-CD2 4.28Å; L593-L636 HydrophobicContact CD2-CD2 4.08Å; L632-L636 HydrophobicContact CD1-CD1 3.65Å; L632-L636 HydrophobicContact CD1-CG 3.96Å; L632-L636 HydrophobicContact CG-CD1 4.11Å; L632-L636 WeakPolarHBondContact O-CG 3.39Å; L632-L636 PolarHBondContact O-N 2.9Å; L633-L636 PolarHBondContact O-N 3.44Å; L636-L640 PolarHBondContact O-N 3.34Å; L636-V663 HydrophobicContact CB-CG1 4.2Å; L636-V663 HydrophobicContact CD2-CG1 4.14Å; L636-V663 HydrophobicContact CD2-CG2 4.44Å; L636-L666 HydrophobicContact CD1-CD2 3.87Å; L636-L666 HydrophobicContact CD1-CG 4.43Å; L636-L666 HydrophobicContact CD2-CD2 4.13Å; L636-L667 HydrophobicContact CB-CD2 4.39Å; L636-L667 HydrophobicContact CD1-CD2 4.2Å; L636-F670 HydrophobicContact CD1-CE2 3.96Å
637	I	93.2	Very high	85.9	Confident	15 Å²	15	47.5 Å²	47.5	8%	0.077	26%	0.262	C	S	.	.	H	α-helix	trans	-71.4	-43.3	177.9	-71.8	170.5	0	0	0	111.2	L633 Q635 E639 L640 G641 M642 A696 L697	L633-I637 WeakPolarHBondContact O-CB 3.25Å; L633-I637 VanDerWaalsContact O-CG1 3.25Å; L633-I637 WeakPolarHBondContact O-CG1 3.25Å; L633-I637 PolarHBondContact O-N 3.43Å; Q635-I637 VanDerWaalsContact C-N 3.33Å; Q635-I637 PolarHBondContact O-N 3.43Å; I637-E639 VanDerWaalsContact C-N 3.26Å; I637-E639 PolarHBondContact O-N 2.76Å; I637-L640 PolarHBondContact O-N 2.78Å; I637-G641 PolarHBondContact O-N 3.02Å; I637-M642 HydrophobicContact CG2-CG 4.45Å; I637-M642 HydrophobicContact CG2-SD 3.98Å; I637-A696 HydrophobicContact CD1-CB 3.88Å; I637-L697 HydrophobicContact CD1-CD2 4.14Å; I637-L697 HydrophobicContact CD1-CG 4.44Å; I637-L697 HydrophobicContact CG1-CD2 4.11Å
638	A	91.5	Very high	84.8	Confident	63 Å²	63	49.3 Å²	49.3	52%	0.521	27%	0.269	S	S	.	.	H	α-helix	trans	-61.5	-35.3	175.3	0	0	0	0	0	112.2	S634 Q635 G641	S634-A638 VanDerWaalsContact O-CB 3.25Å; S634-A638 WeakPolarHBondContact O-CB 3.43Å; S634-A638 PolarHBondContact O-N 3.12Å; Q635-A638 PolarHBondContact O-N 2.87Å; A638-G641 PolarHBondContact O-N 2.88Å; A638-G641 VanDerWaalsContact O-N 3.15Å
639	E	90.1	Very high	84.1	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-67.3	-35.9	176.5	-172.6	57.8	-155.9	0	0	112.5	L593 R597 Q635 I637 G641 H660	L593-E639 HydrophobicContact CD2-CB 3.89Å; L593-E639 HydrophobicContact CD2-CG 4.24Å; L593-E639 HydrophobicContact CG-CB 4.38Å; L593-E639 HydrophobicContact CG-CG 4.2Å; R597-E639 WeakPolarHBondContact CD-OE1 3.48Å; R597-E639 WeakPolarHBondContact CG-OE1 3.19Å; R597-E639 IonicContact CZ-OE1 2.82Å; R597-E639 IonicContact CZ-OE2 3.76Å; R597-E639 IonicContact NE-OE1 3.49Å; R597-E639 PolarHBondContact NE-OE1 2.82Å; R597-E639 IonicContact NE-OE2 3.74Å; R597-E639 PolarHBondContact NE-OE2 3.45Å; R597-E639 IonicContact NH2-OE1 3.77Å; R597-E639 IonicContact NH2-OE2 3.69Å; R597-E639 PolarHBondContact NH2-OE2 2.78Å; Q635-E639 WeakPolarHBondContact O-CB 3.33Å; Q635-E639 PolarHBondContact O-N 3.03Å; I637-E639 VanDerWaalsContact C-N 3.26Å; I637-E639 PolarHBondContact O-N 2.76Å; E639-G641 PolarHBondContact O-N 2.92Å; E639-H660 PolarHBondContact O-NE2 3.32Å
640	L	88.5	Confident	83.6	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-22.1	172	-69.1	177.8	0	0	0	113.3	L636 I637 M642 K650 H660 V663 M664 L667	L636-L640 PolarHBondContact O-N 3.34Å; I637-L640 PolarHBondContact O-N 2.78Å; L640-M642 HydrophobicContact CB-CG 3.65Å; L640-M642 HydrophobicContact CB-SD 4.25Å; L640-M642 HydrophobicContact CD1-CE 4.44Å; L640-M642 HydrophobicContact CD1-CG 4.43Å; L640-M642 HydrophobicContact CD1-SD 3.94Å; L640-K650 PolarHBondContact O-NZ 2.75Å; L640-H660 HydrophobicContact CD2-CB 3.94Å; L640-H660 WeakPolarHBondContact CD2-O 3.43Å; L640-V663 HydrophobicContact CD1-CG1 4.15Å; L640-V663 HydrophobicContact CD2-CB 3.98Å; L640-V663 HydrophobicContact CD2-CG1 3.76Å; L640-V663 HydrophobicContact CG-CG1 3.76Å; L640-M664 HydrophobicContact CD1-CG 3.96Å; L640-M664 HydrophobicContact CD2-CG 3.82Å; L640-L667 HydrophobicContact CD1-CD1 3.78Å
641	G	83.4	Confident	83	Confident	6 Å²	6	53 Å²	53	6%	0.062	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	43.7	179.9	0	0	0	0	0	112.9	I637 A638 E639 D643 K644	I637-G641 PolarHBondContact O-N 3.02Å; A638-G641 PolarHBondContact O-N 2.88Å; A638-G641 VanDerWaalsContact O-N 3.15Å; E639-G641 PolarHBondContact O-N 2.92Å; G641-D643 VanDerWaalsContact CA-OD1 3.26Å; G641-D643 WeakPolarHBondContact CA-OD1 3.23Å; G641-D643 PolarHBondContact O-N 2.82Å; G641-K644 WeakPolarHBondContact O-CB 3.31Å; G641-K644 PolarHBondContact O-N 2.97Å
642	M	79.8	Confident	82.6	Confident	23 Å²	23	56 Å²	56	11%	0.113	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17	-172.9	-47.9	-170.3	80.6	0	0	113.1	I637 L640 K644 L697 A702 Y705	I637-M642 HydrophobicContact CG2-CG 4.45Å; I637-M642 HydrophobicContact CG2-SD 3.98Å; L640-M642 HydrophobicContact CB-CG 3.65Å; L640-M642 HydrophobicContact CB-SD 4.25Å; L640-M642 HydrophobicContact CD1-CE 4.44Å; L640-M642 HydrophobicContact CD1-CG 4.43Å; L640-M642 HydrophobicContact CD1-SD 3.94Å; M642-K644 VanDerWaalsContact C-N 3.28Å; M642-K644 PolarHBondContact O-N 3.45Å; M642-L697 HydrophobicContact SD-CD2 4.49Å; M642-A702 HydrophobicContact CE-CB 3.69Å; M642-Y705 HydrophobicContact CB-CD2 4.11Å; M642-Y705 HydrophobicContact CB-CG 4.29Å; M642-Y705 HydrophobicContact CE-CD1 3.4Å; M642-Y705 VanDerWaalsContact CE-CD1 3.4Å; M642-Y705 HydrophobicContact CE-CD2 4.46Å; M642-Y705 HydrophobicContact CE-CE1 4.06Å; M642-Y705 HydrophobicContact CE-CG 3.64Å; M642-Y705 HydrophobicContact CG-CD2 4.41Å; M642-Y705 HydrophobicContact CG-CG 4.44Å
643	D	65.3	Low	82.4	Confident	117 Å²	117	61.2 Å²	61.2	63%	0.626	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.4	170.1	62.7	-57.1	0	0	0	113.6	G641 K645	G641-D643 VanDerWaalsContact CA-OD1 3.26Å; G641-D643 WeakPolarHBondContact CA-OD1 3.23Å; G641-D643 PolarHBondContact O-N 2.82Å; D643-K645 PolarHBondContact O-N 3.49Å
644	K	68.5	Low	82.2	Confident	117 Å²	117	63.3 Å²	63.3	51%	0.509	33%	0.327	S	S	.	.			trans	-87.4	110.5	-170.9	-65.8	160	-165	162.7	0	110.5	G641 M642 D646	G641-K644 WeakPolarHBondContact O-CB 3.31Å; G641-K644 PolarHBondContact O-N 2.97Å; M642-K644 VanDerWaalsContact C-N 3.28Å; M642-K644 PolarHBondContact O-N 3.45Å; K644-D646 PolarHBondContact O-N 3.2Å
645	K	59.7	Low	82	Confident	201 Å²	201	61.7 Å²	61.7	87%	0.874	32%	0.318	S	S	*	.			trans	-67.5	-15.2	-179.6	-63.2	-178.1	176.7	179.9	0	114.7	D643 V647	D643-K645 PolarHBondContact O-N 3.49Å; K645-V647 PolarHBondContact O-N 3.06Å
646	D	66.8	Low	81.8	Confident	102 Å²	102	62.5 Å²	62.5	55%	0.545	32%	0.324	S	S	.	.			trans	-82.4	99.1	171.8	-177.1	15.9	0	0	0	110.3	K644 S648	K644-D646 PolarHBondContact O-N 3.2Å; D646-S648 VanDerWaalsContact OD1-CB 3.3Å; D646-S648 WeakPolarHBondContact OD1-CB 3.28Å; D646-S648 PolarHBondContact OD1-N 3.19Å; D646-S648 PolarHBondContact OD1-OG 3.36Å
647	V	76.1	Confident	81.7	Confident	10 Å²	10	62.8 Å²	62.8	6%	0.061	33%	0.325	C	S	.	.			trans	-101.7	-7.6	-179.2	-175.2	0	0	0	0	111.5	K645 K649 K650 H708 V709	K645-V647 PolarHBondContact O-N 3.06Å; V647-K649 PolarHBondContact O-N 3.44Å; V647-K649 VanDerWaalsContact O-N 3.1Å; V647-K650 HydrophobicContact CG1-CB 4.19Å; V647-K650 HydrophobicContact CG1-CG 4.09Å; V647-K650 VanDerWaalsContact O-CB 3.29Å; V647-K650 WeakPolarHBondContact O-CB 3.13Å; V647-K650 PolarHBondContact O-N 3.15Å; V647-H708 HydrophobicContact CB-CB 4.43Å; V647-H708 HydrophobicContact CG2-CB 3.89Å; V647-V709 HydrophobicContact CG1-CB 3.96Å; V647-V709 HydrophobicContact CG1-CG2 3.4Å
648	S	69.4	Low	81.8	Confident	78 Å²	78	63 Å²	63	55%	0.545	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-52.9	-40.4	-170.4	-34.2	0	0	0	0	112.9	D646 K650	D646-S648 VanDerWaalsContact OD1-CB 3.3Å; D646-S648 WeakPolarHBondContact OD1-CB 3.28Å; D646-S648 PolarHBondContact OD1-N 3.19Å; D646-S648 PolarHBondContact OD1-OG 3.36Å; S648-K650 VanDerWaalsContact C-N 3.33Å; S648-K650 PolarHBondContact O-N 3.45Å
649	K	78	Confident	81.9	Confident	136 Å²	136	60.1 Å²	60.1	59%	0.591	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-84.5	3.5	-178.3	-56.9	-175.7	-176.4	-178.9	0	114.6	V647 N657	V647-K649 PolarHBondContact O-N 3.44Å; V647-K649 VanDerWaalsContact O-N 3.1Å; K649-N657 PolarHBondContact O-ND2 2.97Å
650	K	82.7	Confident	82.1	Confident	25 Å²	25	60.3 Å²	60.3	11%	0.109	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-80.3	-21.9	179.2	-66.8	-85.6	-174.6	152.1	0	112.6	L640 V647 S648 H660 Y705 Y764 L768	L640-K650 PolarHBondContact O-NZ 2.75Å; V647-K650 HydrophobicContact CG1-CB 4.19Å; V647-K650 HydrophobicContact CG1-CG 4.09Å; V647-K650 VanDerWaalsContact O-CB 3.29Å; V647-K650 WeakPolarHBondContact O-CB 3.13Å; V647-K650 PolarHBondContact O-N 3.15Å; S648-K650 VanDerWaalsContact C-N 3.33Å; S648-K650 PolarHBondContact O-N 3.45Å; K650-H660 PolarHBondContact NZ-CE1 2.91Å; K650-H660 PolarHBondContact NZ-ND1 3.26Å; K650-Y705 WeakPolarHBondContact CE-OH 3.15Å; K650-Y705 PolarHBondContact NZ-OH 3.41Å; K650-Y764 PolarHBondContact O-OH 3.4Å; K650-Y764 VanDerWaalsContact O-OH 3.13Å; K650-L768 WeakPolarHBondContact O-CD2 3.38Å
651	N	82	Confident	82.4	Confident	25 Å²	25	60.2 Å²	60.2	13%	0.134	30%	0.302	C	S	.	.	S	Bend	trans	-71.3	-38.5	173.5	-177.9	29.3	0	0	0	112.3	R653 L713 Y716 Y764 T765	N651-R653 PolarHBondContact O-N 3.36Å; N651-L713 HydrophobicContact CB-CD2 4.39Å; N651-L713 WeakPolarHBondContact OD1-CD2 3.37Å; N651-Y716 VanDerWaalsContact ND2-CB 3.3Å; N651-Y716 WeakPolarHBondContact ND2-CB 3.25Å; N651-Y764 WeakPolarHBondContact O-CE1 3.44Å; N651-T765 WeakPolarHBondContact OD1-CG2 3.36Å; N651-T765 PolarHBondContact OD1-OG1 3.03Å
652	E	86.8	Confident	83	Confident	125 Å²	125	60 Å²	60	58%	0.584	30%	0.299	S	S	*	.	S	Bend	trans	-62.4	130.9	177.5	-65.3	174.6	178.3	0	0	111.4	S654 N657	E652-S654 PolarHBondContact O-N 2.91Å; E652-N657 PolarHBondContact O-ND2 2.66Å
653	R	90.3	Very high	83.7	Confident	108 Å²	108	58.9 Å²	58.9	41%	0.408	29%	0.294	S	S	.	.			trans	-70.6	122.5	173.7	-175.4	-179.7	171.7	-171.9	-3.4	110.1	N651 E658 D759 F761 Y764	N651-R653 PolarHBondContact O-N 3.36Å; R653-E658 HydrophobicContact CG-CG 4.45Å; R653-E658 IonicContact CZ-OE1 3.75Å; R653-E658 VanDerWaalsContact CZ-OE1 3.27Å; R653-E658 IonicContact NE-OE1 3.25Å; R653-E658 PolarHBondContact NE-OE1 3.15Å; R653-E658 IonicContact NH2-OE1 2.73Å; R653-E658 PolarHBondContact NH2-OE1 2.84Å; R653-D759 IonicContact CZ-OD1 3.16Å; R653-D759 IonicContact CZ-OD2 2.91Å; R653-D759 VanDerWaalsContact CZ-OD2 3.27Å; R653-D759 IonicContact NH1-OD1 2.73Å; R653-D759 IonicContact NH1-OD2 3.99Å; R653-D759 PolarHBondContact NH1-OD2 3.3Å; R653-D759 VanDerWaalsContact NH2-CG 3.31Å; R653-D759 IonicContact NH2-OD1 3.34Å; R653-D759 PolarHBondContact NH2-OD1 3.36Å; R653-D759 IonicContact NH2-OD2 3.89Å; R653-D759 PolarHBondContact NH2-OD2 3.42Å; R653-F761 PolarHBondContact NH1-O 2.97Å; R653-Y764 HydrophobicContact CB-CD1 3.99Å; R653-Y764 HydrophobicContact CB-CG 4.02Å; R653-Y764 HydrophobicContact CG-CD1 4.44Å; R653-Y764 HydrophobicContact CG-CD2 4.39Å; R653-Y764 HydrophobicContact CG-CG 3.99Å
654	S	91.6	Very high	85.2	Confident	46 Å²	46	53.4 Å²	53.4	32%	0.322	27%	0.265	S	S	.	.			trans	-148.9	158.1	174.6	71.4	0	0	0	0	110.2	E652 L656 N657 E658	E652-S654 PolarHBondContact O-N 2.91Å; S654-L656 PolarHBondContact O-N 3.26Å; S654-N657 CarbonylContact O-C 3.59Å; S654-N657 WeakPolarHBondContact O-CA 3.41Å; S654-N657 PolarHBondContact O-N 3.47Å; S654-N657 WeakPolarHBondContact OG-CB 3.36Å; S654-N657 PolarHBondContact OG-N 3.14Å; S654-N657 PolarHBondContact OG-ND2 3.13Å; S654-N657 VanDerWaalsContact OG-ND2 3.14Å; S654-E658 WeakPolarHBondContact O-CG 3.44Å; S654-E658 PolarHBondContact O-N 3.15Å
655	A	89.9	Confident	86.5	Confident	40 Å²	40	48.7 Å²	48.7	33%	0.331	24%	0.244	S	C	.	.	H	α-helix	trans	-53.4	-39.5	-179.3	0	0	0	0	0	113.1	V659	A655-V659 WeakPolarHBondContact O-CG2 3.41Å; A655-V659 PolarHBondContact O-N 3.49Å; A655-V659 VanDerWaalsContact O-N 3.13Å
656	L	90.9	Very high	88.2	Confident	64 Å²	64	39.1 Å²	39.1	34%	0.335	20%	0.202	S	C	.	.	H	α-helix	trans	-67.8	-38.9	175.7	166.4	143.2	0	0	0	112.1	R597 S654 V659 H660	R597-L656 HydrophobicContact CB-CD1 4.2Å; R597-L656 HydrophobicContact CG-CD1 4.22Å; R597-L656 WeakPolarHBondContact O-CA 3.41Å; R597-L656 WeakPolarHBondContact O-CB 3.37Å; R597-L656 PolarHBondContact O-N 2.97Å; S654-L656 PolarHBondContact O-N 3.26Å; L656-V659 PolarHBondContact O-N 3.26Å; L656-H660 WeakPolarHBondContact CD2-CE1 3.23Å; L656-H660 VanDerWaalsContact O-CG 3.26Å; L656-H660 PolarHBondContact O-N 3.01Å; L656-H660 PolarHBondContact O-ND1 2.93Å
657	N	92.3	Very high	89.6	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.032	18%	0.176	C	C	.	.	H	α-helix	trans	-73.7	-32.8	177	-76.7	-22.9	0	0	0	113.3	K649 E652 S654 H660 L661 Y764	K649-N657 PolarHBondContact O-ND2 2.97Å; E652-N657 PolarHBondContact O-ND2 2.66Å; S654-N657 CarbonylContact O-C 3.59Å; S654-N657 WeakPolarHBondContact O-CA 3.41Å; S654-N657 PolarHBondContact O-N 3.47Å; S654-N657 WeakPolarHBondContact OG-CB 3.36Å; S654-N657 PolarHBondContact OG-N 3.14Å; S654-N657 PolarHBondContact OG-ND2 3.13Å; S654-N657 VanDerWaalsContact OG-ND2 3.14Å; N657-H660 PolarHBondContact O-N 3.31Å; N657-H660 PolarHBondContact OD1-ND1 3.43Å; N657-L661 WeakPolarHBondContact O-CB 3.31Å; N657-L661 PolarHBondContact O-N 3.46Å; N657-Y764 HydrophobicContact CB-CE2 4.35Å; N657-Y764 WeakPolarHBondContact CB-OH 3.09Å; N657-Y764 PolarHBondContact O-OH 2.73Å
658	E	94.1	Very high	90.5	Very high	21 Å²	21	33.9 Å²	33.9	10%	0.098	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-42.1	168.6	-65.1	178.6	167.3	0	0	111.3	G601 R653 S654 L661 V662 F761 Y764	G601-E658 PolarHBondContact N-OE2 3.09Å; R653-E658 HydrophobicContact CG-CG 4.45Å; R653-E658 IonicContact CZ-OE1 3.75Å; R653-E658 VanDerWaalsContact CZ-OE1 3.27Å; R653-E658 IonicContact NE-OE1 3.25Å; R653-E658 PolarHBondContact NE-OE1 3.15Å; R653-E658 IonicContact NH2-OE1 2.73Å; R653-E658 PolarHBondContact NH2-OE1 2.84Å; S654-E658 WeakPolarHBondContact O-CG 3.44Å; S654-E658 PolarHBondContact O-N 3.15Å; E658-L661 WeakPolarHBondContact O-CB 3.12Å; E658-L661 PolarHBondContact O-N 3.46Å; E658-V662 WeakPolarHBondContact O-CG2 3.41Å; E658-V662 PolarHBondContact O-N 2.98Å; E658-F761 HydrophobicContact CB-CD1 3.96Å; E658-F761 HydrophobicContact CB-CE1 3.87Å; E658-F761 HydrophobicContact CB-CZ 4.37Å; E658-F761 HydrophobicContact CG-CB 4.3Å; E658-F761 HydrophobicContact CG-CD1 3.76Å; E658-F761 HydrophobicContact CG-CE1 4.21Å; E658-F761 HydrophobicContact CG-CG 4.02Å; E658-Y764 HydrophobicContact CG-CD2 4.47Å
659	V	93.8	Very high	91.7	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-43.6	175.4	171.2	0	0	0	0	111.3	L596 A604 A655 L656 L661 V662 V663	L596-V659 HydrophobicContact CB-CG1 4.17Å; A604-V659 HydrophobicContact CB-CG2 3.94Å; A655-V659 WeakPolarHBondContact O-CG2 3.41Å; A655-V659 PolarHBondContact O-N 3.49Å; A655-V659 VanDerWaalsContact O-N 3.13Å; L656-V659 PolarHBondContact O-N 3.26Å; V659-L661 PolarHBondContact O-N 3.06Å; V659-V662 PolarHBondContact O-N 3.24Å; V659-V663 WeakPolarHBondContact O-CG2 3.35Å; V659-V663 PolarHBondContact O-N 2.89Å
660	H	93.7	Very high	92.5	Very high	13 Å²	13	24.7 Å²	24.7	6%	0.06	13%	0.126	C	C	.	.	H	α-helix	trans	-54.5	-41.3	171	-67.7	148.1	0	0	0	112.1	E639 L640 K650 L656 N657 V663 M664	E639-H660 PolarHBondContact O-NE2 3.32Å; L640-H660 HydrophobicContact CD2-CB 3.94Å; L640-H660 WeakPolarHBondContact CD2-O 3.43Å; K650-H660 PolarHBondContact NZ-CE1 2.91Å; K650-H660 PolarHBondContact NZ-ND1 3.26Å; L656-H660 WeakPolarHBondContact CD2-CE1 3.23Å; L656-H660 VanDerWaalsContact O-CG 3.26Å; L656-H660 PolarHBondContact O-N 3.01Å; L656-H660 PolarHBondContact O-ND1 2.93Å; N657-H660 PolarHBondContact O-N 3.31Å; N657-H660 PolarHBondContact OD1-ND1 3.43Å; H660-V663 PolarHBondContact O-N 3.1Å; H660-M664 WeakPolarHBondContact O-CG 3.47Å; H660-M664 PolarHBondContact O-N 2.84Å
661	L	95	Very high	92.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.2	-38.7	179.1	-177	63.4	0	0	0	112.4	N657 E658 V659 M664 R665 F761 Y764 L767 L768 M771	N657-L661 WeakPolarHBondContact O-CB 3.31Å; N657-L661 PolarHBondContact O-N 3.46Å; E658-L661 WeakPolarHBondContact O-CB 3.12Å; E658-L661 PolarHBondContact O-N 3.46Å; V659-L661 PolarHBondContact O-N 3.06Å; L661-M664 HydrophobicContact CD1-CE 4.28Å; L661-R665 PolarHBondContact O-N 3.45Å; L661-F761 HydrophobicContact CD2-CD1 4.05Å; L661-F761 HydrophobicContact CD2-CE1 4.01Å; L661-Y764 HydrophobicContact CB-CE2 4.14Å; L661-Y764 HydrophobicContact CD2-CD2 3.88Å; L661-Y764 HydrophobicContact CD2-CE2 3.78Å; L661-L767 HydrophobicContact CD2-CB 3.7Å; L661-L767 HydrophobicContact CD2-CD1 4.25Å; L661-L768 HydrophobicContact CD1-CD1 4.44Å; L661-M771 HydrophobicContact CD1-CB 4.07Å; L661-M771 HydrophobicContact CD1-CG 3.61Å
662	V	95.8	Very high	93.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-40.3	172.9	-178.3	0	0	0	0	111.2	I605 M608 E658 V659 R665 L666 F747 F761	I605-V662 HydrophobicContact CG1-CG1 4.26Å; I605-V662 HydrophobicContact CG1-CG2 4.04Å; M608-V662 HydrophobicContact CB-CG1 3.95Å; M608-V662 HydrophobicContact CG-CG1 3.78Å; E658-V662 WeakPolarHBondContact O-CG2 3.41Å; E658-V662 PolarHBondContact O-N 2.98Å; V659-V662 PolarHBondContact O-N 3.24Å; V662-R665 CarbonylContact O-C 3.48Å; V662-R665 PolarHBondContact O-N 2.81Å; V662-R665 VanDerWaalsContact O-N 3.16Å; V662-L666 PolarHBondContact O-N 3.45Å; V662-F747 HydrophobicContact CG1-CD2 4.03Å; V662-F747 HydrophobicContact CG1-CE2 4.17Å; V662-F747 HydrophobicContact CG1-CG 4.35Å; V662-F761 HydrophobicContact CG2-CE1 4.29Å; V662-F761 HydrophobicContact CG2-CZ 3.82Å
663	V	95.4	Very high	92.4	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-45.1	175.1	171.4	0	0	0	0	111.4	M608 L636 L640 V659 H660 R665 L666 L667	M608-V663 HydrophobicContact CE-CG2 3.54Å; M608-V663 HydrophobicContact SD-CG2 4.45Å; L636-V663 HydrophobicContact CB-CG1 4.2Å; L636-V663 HydrophobicContact CD2-CG1 4.14Å; L636-V663 HydrophobicContact CD2-CG2 4.44Å; L640-V663 HydrophobicContact CD1-CG1 4.15Å; L640-V663 HydrophobicContact CD2-CB 3.98Å; L640-V663 HydrophobicContact CD2-CG1 3.76Å; L640-V663 HydrophobicContact CG-CG1 3.76Å; V659-V663 WeakPolarHBondContact O-CG2 3.35Å; V659-V663 PolarHBondContact O-N 2.89Å; H660-V663 PolarHBondContact O-N 3.1Å; V663-R665 VanDerWaalsContact C-N 3.27Å; V663-R665 PolarHBondContact O-N 3.14Å; V663-L666 WeakPolarHBondContact O-CB 3.49Å; V663-L666 PolarHBondContact O-N 3.35Å; V663-L667 HydrophobicContact CG1-CD1 3.91Å; V663-L667 WeakPolarHBondContact O-CD1 3.32Å; V663-L667 WeakPolarHBondContact O-CG 3.36Å; V663-L667 PolarHBondContact O-N 3.22Å
664	M	95.5	Very high	90.8	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-36.2	173.4	-75.3	-174.8	-68.3	0	0	112.1	L640 H660 L661 S668 Y705 L768 M771 L775	L640-M664 HydrophobicContact CD1-CG 3.96Å; L640-M664 HydrophobicContact CD2-CG 3.82Å; H660-M664 WeakPolarHBondContact O-CG 3.47Å; H660-M664 PolarHBondContact O-N 2.84Å; L661-M664 HydrophobicContact CD1-CE 4.28Å; M664-S668 WeakPolarHBondContact O-CB 3.37Å; M664-S668 PolarHBondContact O-N 3.01Å; M664-Y705 HydrophobicContact SD-CE1 4.49Å; M664-L768 HydrophobicContact CE-CD1 3.53Å; M664-M771 HydrophobicContact CB-CE 4.34Å; M664-M771 WeakPolarHBondContact O-CE 3.16Å; M664-L775 HydrophobicContact CB-CD1 4Å; M664-L775 HydrophobicContact CG-CD1 3.92Å; M664-L775 HydrophobicContact SD-CD1 4.21Å
665	R	96.1	Very high	88.6	Confident	18 Å²	18	24.6 Å²	24.6	7%	0.068	13%	0.131	C	C	.	.	H	α-helix	trans	-69.7	-37.6	174	-79.9	-178.8	165	-165.7	2.5	112.8	L661 V662 V663 S668 V669 F747 E770 M771	L661-R665 PolarHBondContact O-N 3.45Å; V662-R665 CarbonylContact O-C 3.48Å; V662-R665 PolarHBondContact O-N 2.81Å; V662-R665 VanDerWaalsContact O-N 3.16Å; V663-R665 VanDerWaalsContact C-N 3.27Å; V663-R665 PolarHBondContact O-N 3.14Å; R665-S668 PolarHBondContact O-N 2.99Å; R665-V669 VanDerWaalsContact O-CG2 3.27Å; R665-V669 WeakPolarHBondContact O-CG2 3.21Å; R665-V669 PolarHBondContact O-N 2.93Å; R665-F747 HydrophobicContact CB-CD1 4.13Å; R665-F747 WeakPolarHBondContact CD-O 3.44Å; R665-F747 PolarHBondContact NH1-O 3.26Å; R665-E770 IonicContact CZ-OE2 3.66Å; R665-E770 IonicContact NH2-OE2 3.77Å; R665-E770 PolarHBondContact NH2-OE2 2.81Å; R665-M771 HydrophobicContact CB-CE 4.39Å; R665-M771 HydrophobicContact CG-CE 3.64Å; R665-M771 HydrophobicContact CG-CG 3.89Å; R665-M771 HydrophobicContact CG-SD 3.34Å; R665-M771 WeakPolarHBondContact CG-SD 3.48Å; R665-M771 PolarHBondContact NE-SD 3.24Å; R665-M771 VanDerWaalsContact NE-SD 3.44Å
666	L	95.9	Very high	86.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-48.5	172.8	178.8	58.9	0	0	0	112	M608 I611 L612 L636 V662 V663 S668 V669 F670 F747	M608-L666 HydrophobicContact SD-CD2 3.77Å; I611-L666 HydrophobicContact CG2-CD2 4.15Å; L612-L666 HydrophobicContact CB-CD1 3.82Å; L612-L666 HydrophobicContact CD1-CD1 3.82Å; L612-L666 HydrophobicContact CG-CD1 4.28Å; L636-L666 HydrophobicContact CD1-CD2 3.87Å; L636-L666 HydrophobicContact CD1-CG 4.43Å; L636-L666 HydrophobicContact CD2-CD2 4.13Å; V662-L666 PolarHBondContact O-N 3.45Å; V663-L666 WeakPolarHBondContact O-CB 3.49Å; V663-L666 PolarHBondContact O-N 3.35Å; L666-S668 VanDerWaalsContact C-N 3.33Å; L666-S668 PolarHBondContact O-N 3.29Å; L666-V669 PolarHBondContact O-N 3.26Å; L666-V669 VanDerWaalsContact O-N 3.1Å; L666-F670 HydrophobicContact CD1-CD1 4.36Å; L666-F670 HydrophobicContact CD1-CE1 3.67Å; L666-F670 HydrophobicContact CD1-CE2 4.2Å; L666-F670 HydrophobicContact CD1-CZ 3.57Å; L666-F670 HydrophobicContact CD2-CE2 4.43Å; L666-F670 HydrophobicContact CD2-CZ 4.19Å; L666-F670 HydrophobicContact CG-CE1 4.29Å; L666-F670 HydrophobicContact CG-CE2 3.92Å; L666-F670 HydrophobicContact CG-CZ 3.75Å; L666-F670 PolarHBondContact O-N 3.17Å; L666-F747 HydrophobicContact CB-CE1 3.98Å; L666-F747 HydrophobicContact CB-CZ 4.42Å; L666-F747 HydrophobicContact CD1-CE1 4.03Å; L666-F747 HydrophobicContact CD1-CZ 4.13Å
667	L	96.1	Very high	84.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.3	-38.8	176.8	-67.9	158	0	0	0	111.9	L633 L636 L640 V663 F670 M671 T693 L697	L633-L667 HydrophobicContact CD2-CD2 3.92Å; L636-L667 HydrophobicContact CB-CD2 4.39Å; L636-L667 HydrophobicContact CD1-CD2 4.2Å; L640-L667 HydrophobicContact CD1-CD1 3.78Å; V663-L667 HydrophobicContact CG1-CD1 3.91Å; V663-L667 WeakPolarHBondContact O-CD1 3.32Å; V663-L667 WeakPolarHBondContact O-CG 3.36Å; V663-L667 PolarHBondContact O-N 3.22Å; L667-F670 HydrophobicContact CD2-CD2 4.48Å; L667-F670 PolarHBondContact O-N 3.08Å; L667-M671 PolarHBondContact O-N 3.43Å; L667-M671 VanDerWaalsContact O-N 3.11Å; L667-T693 HydrophobicContact CB-CG2 4.4Å; L667-T693 HydrophobicContact CD2-CG2 3.91Å; L667-L697 HydrophobicContact CB-CD1 4.43Å; L667-L697 HydrophobicContact CD1-CD2 4.3Å
668	S	95.4	Very high	81.5	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-34.2	172.8	-175.4	0	0	0	0	113.3	M664 R665 L666 M671 S672 R774 Q778	M664-S668 WeakPolarHBondContact O-CB 3.37Å; M664-S668 PolarHBondContact O-N 3.01Å; R665-S668 PolarHBondContact O-N 2.99Å; L666-S668 VanDerWaalsContact C-N 3.33Å; L666-S668 PolarHBondContact O-N 3.29Å; S668-M671 CarbonylContact O-C 3.52Å; S668-S672 PolarHBondContact O-N 2.96Å; S668-S672 VanDerWaalsContact O-N 3.15Å; S668-S672 PolarHBondContact O-OG 3.43Å; S668-R774 PolarHBondContact OG-NE 3.39Å; S668-Q778 VanDerWaalsContact CB-OE1 3.32Å; S668-Q778 PolarHBondContact O-NE2 3.35Å; S668-Q778 VanDerWaalsContact OG-CD 3.28Å; S668-Q778 PolarHBondContact OG-NE2 2.86Å; S668-Q778 PolarHBondContact OG-OE1 3.32Å
669	V	95	Very high	79	Confident	20 Å²	20	42 Å²	42	12%	0.121	24%	0.242	C	C	.	.	H	α-helix	trans	-71.1	-41.2	175.8	168.5	0	0	0	0	111.1	L612 R665 L666 M671 S672 P746	L612-V669 HydrophobicContact CD1-CG1 3.66Å; L612-V669 HydrophobicContact CD2-CG1 4.03Å; R665-V669 VanDerWaalsContact O-CG2 3.27Å; R665-V669 WeakPolarHBondContact O-CG2 3.21Å; R665-V669 PolarHBondContact O-N 2.93Å; L666-V669 PolarHBondContact O-N 3.26Å; L666-V669 VanDerWaalsContact O-N 3.1Å; V669-M671 VanDerWaalsContact C-N 3.33Å; V669-M671 PolarHBondContact O-N 3.11Å; V669-S672 WeakPolarHBondContact O-CB 3.48Å; V669-S672 PolarHBondContact O-N 3.34Å; V669-P746 HydrophobicContact CG1-CG 3.94Å; V669-P746 HydrophobicContact CG2-CB 4.31Å; V669-P746 HydrophobicContact CG2-CG 3.98Å
670	F	93.6	Very high	77	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-46.8	171.4	-64.6	-26.3	0	0	0	111.4	L612 T615 L632 L633 L636 L666 L667 S672 R673 I689 T693	L612-F670 HydrophobicContact CD1-CD1 4.02Å; L612-F670 HydrophobicContact CD1-CE1 3.71Å; T615-F670 HydrophobicContact CG2-CE1 4.08Å; T615-F670 HydrophobicContact CG2-CZ 3.93Å; T615-F670 WeakPolarHBondContact OG1-CE1 3.42Å; L632-F670 HydrophobicContact CD2-CE2 4.24Å; L632-F670 HydrophobicContact CD2-CZ 4.12Å; L633-F670 HydrophobicContact CD2-CD2 4.29Å; L636-F670 HydrophobicContact CD1-CE2 3.96Å; L666-F670 HydrophobicContact CD1-CD1 4.36Å; L666-F670 HydrophobicContact CD1-CE1 3.67Å; L666-F670 HydrophobicContact CD1-CE2 4.2Å; L666-F670 HydrophobicContact CD1-CZ 3.57Å; L666-F670 HydrophobicContact CD2-CE2 4.43Å; L666-F670 HydrophobicContact CD2-CZ 4.19Å; L666-F670 HydrophobicContact CG-CE1 4.29Å; L666-F670 HydrophobicContact CG-CE2 3.92Å; L666-F670 HydrophobicContact CG-CZ 3.75Å; L666-F670 PolarHBondContact O-N 3.17Å; L667-F670 HydrophobicContact CD2-CD2 4.48Å; L667-F670 PolarHBondContact O-N 3.08Å; F670-S672 PolarHBondContact O-N 2.95Å; F670-S672 VanDerWaalsContact O-N 3.15Å; F670-R673 PolarHBondContact O-N 3.4Å; F670-I689 HydrophobicContact CB-CG2 3.98Å; F670-I689 HydrophobicContact CD1-CG2 4.18Å; F670-I689 HydrophobicContact CG-CG2 4.11Å; F670-T693 HydrophobicContact CB-CG2 4.12Å; F670-T693 WeakPolarHBondContact CB-OG1 3.39Å; F670-T693 HydrophobicContact CD2-CG2 4.43Å
671	M	91.7	Very high	75	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.03	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-1.3	173.7	-71.1	-166.7	-64.7	0	0	115.3	L667 S668 V669 S690 T693 A694 L697 L775 Q778 I779 I782	L667-M671 PolarHBondContact O-N 3.43Å; L667-M671 VanDerWaalsContact O-N 3.11Å; S668-M671 CarbonylContact O-C 3.52Å; V669-M671 VanDerWaalsContact C-N 3.33Å; V669-M671 PolarHBondContact O-N 3.11Å; M671-S690 WeakPolarHBondContact CA-OG 3.27Å; M671-T693 HydrophobicContact CG-CG2 3.72Å; M671-T693 HydrophobicContact SD-CG2 4.4Å; M671-A694 HydrophobicContact SD-CB 4.05Å; M671-L697 HydrophobicContact CE-CD1 3.48Å; M671-L697 VanDerWaalsContact CE-CD1 3.48Å; M671-L697 HydrophobicContact SD-CD1 3.82Å; M671-L775 HydrophobicContact CE-CD2 3.41Å; M671-L775 VanDerWaalsContact CE-CD2 3.41Å; M671-Q778 HydrophobicContact CB-CB 4.2Å; M671-Q778 HydrophobicContact CE-CB 3.92Å; M671-Q778 HydrophobicContact SD-CB 4.11Å; M671-I779 HydrophobicContact CE-CG1 4.21Å; M671-I779 HydrophobicContact SD-CG1 3.79Å; M671-I782 HydrophobicContact CB-CD1 3.65Å; M671-I782 HydrophobicContact CG-CD1 3.66Å; M671-I782 HydrophobicContact SD-CD1 3.97Å
672	S	87.4	Confident	73.1	Confident	58 Å²	58	52.2 Å²	52.2	41%	0.406	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-10.4	176	-58.1	0	0	0	0	113.3	S668 V669 F670 T674 Q778	S668-S672 PolarHBondContact O-N 2.96Å; S668-S672 VanDerWaalsContact O-N 3.15Å; S668-S672 PolarHBondContact O-OG 3.43Å; V669-S672 WeakPolarHBondContact O-CB 3.48Å; V669-S672 PolarHBondContact O-N 3.34Å; F670-S672 PolarHBondContact O-N 2.95Å; F670-S672 VanDerWaalsContact O-N 3.15Å; S672-T674 PolarHBondContact O-N 3.42Å; S672-Q778 PolarHBondContact OG-NE2 2.89Å
673	R	71.6	Confident	71	Confident	58 Å²	58	53.3 Å²	53.3	22%	0.219	31%	0.314	C	S	.	.			trans	-76	28.1	-176.3	-69.3	-176.9	168.7	164.2	-2.5	114.2	L612 T615 T616 F670 S686	L612-R673 PolarHBondContact O-NH2 3.33Å; T615-R673 PolarHBondContact OG1-NH1 2.89Å; T616-R673 VanDerWaalsContact CG2-NH2 3.29Å; F670-R673 PolarHBondContact O-N 3.4Å; R673-S686 WeakPolarHBondContact O-CB 3.48Å; R673-S686 PolarHBondContact O-OG 2.89Å
674	T	55.2	Low	69.4	Low	59 Å²	59	59 Å²	59	36%	0.362	34%	0.34	S	S	.	.			trans	-98.7	80.5	-176.4	63.3	0	0	0	0	112.7	S672 S690	S672-T674 PolarHBondContact O-N 3.42Å; T674-S690 WeakPolarHBondContact CG2-OG 3.1Å
675	K	45.8	Very low	67.9	Low	147 Å²	147	59.7 Å²	59.7	64%	0.639	35%	0.345	S	S	*	.			trans	-117.6	87.5	164.5	-85.5	-164.4	171.7	-173.9	0	110.8	G677 C683	K675-G677 PolarHBondContact O-N 2.91Å; K675-C683 PolarHBondContact O-SG 2.7Å
676	S	43.6	Very low	66.6	Low	126 Å²	126	60 Å²	60	88%	0.881	35%	0.35	S	S	*	.			trans	-61.7	126.1	162.4	-179.3	0	0	0	0	108.8
677	G	42.3	Very low	65.8	Low	74 Å²	74	62.4 Å²	62.4	76%	0.763	37%	0.367	S	S	*	.			trans	173.6	-16.9	-177.7	0	0	0	0	0	116.8	K675	K675-G677 PolarHBondContact O-N 2.91Å
678	S	39.5	Very low	65.3	Low	78 Å²	78	66 Å²	66	55%	0.545	39%	0.386	S	S	.	.	S	Bend	trans	-145.9	140.9	176.5	62.1	0	0	0	0	112.4	S680	S678-S680 PolarHBondContact O-N 3.01Å
679	K	40.7	Very low	65.1	Low	218 Å²	218	66.2 Å²	66.2	95%	0.948	39%	0.387	S	S	*	.			trans	-76	88	174.5	-69.8	-174.1	177.1	-177.7	0	109.9
680	S	51.9	Low	64.9	Low	50 Å²	50	65.2 Å²	65.2	35%	0.35	38%	0.381	S	S	.	.			trans	-146.8	142.6	170.8	62.4	0	0	0	0	109.5	S678 I682 C683	S678-S680 PolarHBondContact O-N 3.01Å; S680-I682 PolarHBondContact O-N 2.76Å; S680-I682 VanDerWaalsContact O-N 3.11Å; S680-C683 VanDerWaalsContact O-CB 3.26Å; S680-C683 WeakPolarHBondContact O-CB 3.47Å; S680-C683 PolarHBondContact O-N 2.79Å
681	S	52.3	Low	64.8	Low	81 Å²	81	66.4 Å²	66.4	57%	0.566	39%	0.389	S	S	*	.	H	α-helix	trans	-57.3	-29.3	-175.9	50	0	0	0	0	113.7	C683 E684 S685	S681-C683 VanDerWaalsContact C-N 3.28Å; S681-C683 PolarHBondContact O-N 3.09Å; S681-E684 PolarHBondContact O-N 3.05Å; S681-E684 VanDerWaalsContact O-N 3.16Å; S681-S685 PolarHBondContact O-N 2.77Å; S681-S685 PolarHBondContact O-OG 3.43Å
682	I	55	Low	64.8	Low	98 Å²	98	67.3 Å²	67.3	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-38	174.6	-52.8	175.9	0	0	0	111.2	S680 S686	S680-I682 PolarHBondContact O-N 2.76Å; S680-I682 VanDerWaalsContact O-N 3.11Å; I682-S686 WeakPolarHBondContact O-CB 3.2Å; I682-S686 PolarHBondContact O-N 3.22Å
683	C	52	Low	65.1	Low	24 Å²	24	64.6 Å²	64.6	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-70.2	-32.8	176.8	-174.7	0	0	0	0	112.3	K675 S680 S681 S686 S687	K675-C683 PolarHBondContact O-SG 2.7Å; S680-C683 VanDerWaalsContact O-CB 3.26Å; S680-C683 WeakPolarHBondContact O-CB 3.47Å; S680-C683 PolarHBondContact O-N 2.79Å; S681-C683 VanDerWaalsContact C-N 3.28Å; S681-C683 PolarHBondContact O-N 3.09Å; C683-S686 PolarHBondContact O-OG 3.47Å; C683-S687 PolarHBondContact O-N 2.83Å
684	E	61.7	Low	66.2	Low	119 Å²	119	61.8 Å²	61.8	56%	0.556	37%	0.368	S	S	*	.	H	α-helix	trans	-74.5	-48.5	179.4	-70.5	167.5	158.7	0	0	109.7	S681 S686 S687 L688	S681-E684 PolarHBondContact O-N 3.05Å; S681-E684 VanDerWaalsContact O-N 3.16Å; E684-S686 VanDerWaalsContact C-N 3.31Å; E684-S686 PolarHBondContact O-N 3.3Å; E684-S687 WeakPolarHBondContact O-CB 3.27Å; E684-S687 PolarHBondContact O-N 2.99Å; E684-S687 VanDerWaalsContact O-N 3.08Å; E684-S687 PolarHBondContact O-OG 3.14Å; E684-L688 WeakPolarHBondContact O-CG 3.39Å; E684-L688 PolarHBondContact O-N 3.38Å
685	S	63.1	Low	68	Low	17 Å²	17	60.8 Å²	60.8	12%	0.119	37%	0.366	C	S	.	.	H	α-helix	trans	-55	-43.1	172.5	-52.8	0	0	0	0	112.4	S681 S687 L688 I689	S681-S685 PolarHBondContact O-N 2.77Å; S681-S685 PolarHBondContact O-OG 3.43Å; S685-S687 VanDerWaalsContact C-N 3.33Å; S685-S687 PolarHBondContact O-N 2.99Å; S685-L688 PolarHBondContact O-N 2.9Å; S685-I689 WeakPolarHBondContact O-CG1 3.46Å; S685-I689 PolarHBondContact O-N 3.1Å
686	S	69	Low	70.3	Confident	25 Å²	25	54.8 Å²	54.8	18%	0.175	34%	0.343	C	S	.	.	H	α-helix	trans	-66.8	-33.5	178.7	91.5	0	0	0	0	112.9	R673 I682 C683 E684 S690	R673-S686 WeakPolarHBondContact O-CB 3.48Å; R673-S686 PolarHBondContact O-OG 2.89Å; I682-S686 WeakPolarHBondContact O-CB 3.2Å; I682-S686 PolarHBondContact O-N 3.22Å; C683-S686 PolarHBondContact O-OG 3.47Å; E684-S686 VanDerWaalsContact C-N 3.31Å; E684-S686 PolarHBondContact O-N 3.3Å; S686-S690 PolarHBondContact O-N 2.91Å
687	S	79.9	Confident	72.7	Confident	51 Å²	51	48.8 Å²	48.8	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-71.3	-33.4	174.7	81.7	0	0	0	0	112.9	C683 E684 S685 S691	C683-S687 PolarHBondContact O-N 2.83Å; E684-S687 WeakPolarHBondContact O-CB 3.27Å; E684-S687 PolarHBondContact O-N 2.99Å; E684-S687 VanDerWaalsContact O-N 3.08Å; E684-S687 PolarHBondContact O-OG 3.14Å; S685-S687 VanDerWaalsContact C-N 3.33Å; S685-S687 PolarHBondContact O-N 2.99Å; S687-S691 WeakPolarHBondContact O-CB 3.37Å; S687-S691 PolarHBondContact O-N 3.42Å; S687-S691 PolarHBondContact O-OG 2.85Å
688	L	84.9	Confident	75.1	Confident	75 Å²	75	46.8 Å²	46.8	39%	0.393	27%	0.273	S	S	.	.	H	α-helix	trans	-72.7	-46.6	177.9	-69.8	165.7	0	0	0	111.2	E684 S685 S690 S691 A692	E684-L688 WeakPolarHBondContact O-CG 3.39Å; E684-L688 PolarHBondContact O-N 3.38Å; S685-L688 PolarHBondContact O-N 2.9Å; L688-S690 VanDerWaalsContact C-N 3.28Å; L688-S690 PolarHBondContact O-N 2.88Å; L688-S691 PolarHBondContact O-N 3.49Å; L688-S691 VanDerWaalsContact O-N 3.08Å; L688-A692 WeakPolarHBondContact O-CB 3.32Å; L688-A692 PolarHBondContact O-N 3.5Å
689	I	90.3	Very high	77.6	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-54.9	-45.1	173	-68.3	163.4	0	0	0	110.9	T615 L629 F670 S685 T693	T615-I689 WeakPolarHBondContact O-CD1 3.43Å; L629-I689 HydrophobicContact CD1-CG1 4.4Å; L629-I689 HydrophobicContact CD1-CG2 4.5Å; L629-I689 HydrophobicContact CD2-CG1 4.06Å; F670-I689 HydrophobicContact CB-CG2 3.98Å; F670-I689 HydrophobicContact CD1-CG2 4.18Å; F670-I689 HydrophobicContact CG-CG2 4.11Å; S685-I689 WeakPolarHBondContact O-CG1 3.46Å; S685-I689 PolarHBondContact O-N 3.1Å; I689-T693 WeakPolarHBondContact O-CB 3.44Å; I689-T693 PolarHBondContact O-N 2.79Å; I689-T693 PolarHBondContact O-OG1 3.38Å
690	S	91.8	Very high	80.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-40.1	176.9	-174.7	0	0	0	0	112.9	M671 T674 S686 L688 A694 I782	M671-S690 WeakPolarHBondContact CA-OG 3.27Å; T674-S690 WeakPolarHBondContact CG2-OG 3.1Å; S686-S690 PolarHBondContact O-N 2.91Å; L688-S690 VanDerWaalsContact C-N 3.28Å; L688-S690 PolarHBondContact O-N 2.88Å; S690-A694 PolarHBondContact O-N 3.44Å; S690-A694 VanDerWaalsContact O-N 3.15Å; S690-I782 VanDerWaalsContact OG-CD1 3.27Å; S690-I782 WeakPolarHBondContact OG-CD1 3.4Å
691	S	90.6	Very high	81.9	Confident	24 Å²	24	38.5 Å²	38.5	17%	0.168	25%	0.247	C	C	.	.	H	α-helix	trans	-71.4	-44.8	-179.3	-62.5	0	0	0	0	112	S687 L688 A694 A695 N786 I789	S687-S691 WeakPolarHBondContact O-CB 3.37Å; S687-S691 PolarHBondContact O-N 3.42Å; S687-S691 PolarHBondContact O-OG 2.85Å; L688-S691 PolarHBondContact O-N 3.49Å; L688-S691 VanDerWaalsContact O-N 3.08Å; S691-A694 PolarHBondContact O-N 2.91Å; S691-A695 WeakPolarHBondContact O-CB 3.25Å; S691-A695 PolarHBondContact O-N 3.28Å; S691-N786 PolarHBondContact OG-ND2 2.95Å; S691-N786 VanDerWaalsContact OG-ND2 3.13Å; S691-I789 WeakPolarHBondContact O-CD1 3.41Å
692	A	92.5	Very high	83.8	Confident	26 Å²	26	34.7 Å²	34.7	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-44.4	175.2	0	0	0	0	0	111.3	L629 L633 L688 A694 A695 A696	L629-A692 HydrophobicContact CD2-CB 3.97Å; L633-A692 HydrophobicContact CD1-CB 3.97Å; L688-A692 WeakPolarHBondContact O-CB 3.32Å; L688-A692 PolarHBondContact O-N 3.5Å; A692-A694 PolarHBondContact O-N 2.96Å; A692-A695 PolarHBondContact O-N 2.87Å; A692-A696 VanDerWaalsContact O-CB 3.31Å; A692-A696 WeakPolarHBondContact O-CB 3.31Å; A692-A696 PolarHBondContact O-N 3.12Å
693	T	94.4	Very high	85.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-46	176.4	-55	0	0	0	0	111.7	L633 L667 F670 M671 I689 L697	L633-T693 HydrophobicContact CD2-CG2 3.99Å; L667-T693 HydrophobicContact CB-CG2 4.4Å; L667-T693 HydrophobicContact CD2-CG2 3.91Å; F670-T693 HydrophobicContact CB-CG2 4.12Å; F670-T693 WeakPolarHBondContact CB-OG1 3.39Å; F670-T693 HydrophobicContact CD2-CG2 4.43Å; M671-T693 HydrophobicContact CG-CG2 3.72Å; M671-T693 HydrophobicContact SD-CG2 4.4Å; I689-T693 WeakPolarHBondContact O-CB 3.44Å; I689-T693 PolarHBondContact O-N 2.79Å; I689-T693 PolarHBondContact O-OG1 3.38Å; T693-L697 HydrophobicContact CG2-CD1 3.96Å; T693-L697 HydrophobicContact CG2-CG 4.49Å; T693-L697 WeakPolarHBondContact O-CB 3.46Å; T693-L697 VanDerWaalsContact O-CG 3.28Å; T693-L697 WeakPolarHBondContact O-CG 3.41Å; T693-L697 PolarHBondContact O-N 2.98Å
694	A	94.1	Very high	87.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-40.5	178.5	0	0	0	0	0	112.5	M671 S690 S691 A692 L698 I782 I789	M671-A694 HydrophobicContact SD-CB 4.05Å; S690-A694 PolarHBondContact O-N 3.44Å; S690-A694 VanDerWaalsContact O-N 3.15Å; S691-A694 PolarHBondContact O-N 2.91Å; A692-A694 PolarHBondContact O-N 2.96Å; A694-L698 WeakPolarHBondContact O-CB 3.45Å; A694-L698 PolarHBondContact O-N 2.88Å; A694-I782 HydrophobicContact CB-CB 3.98Å; A694-I782 HydrophobicContact CB-CD1 3.9Å; A694-I782 HydrophobicContact CB-CG2 3.69Å; A694-I789 HydrophobicContact CB-CD1 4.38Å
695	A	93.4	Very high	88.9	Confident	38 Å²	38	28.4 Å²	28.4	31%	0.314	19%	0.189	S	C	.	.	H	α-helix	trans	-65.9	-46.4	177.2	0	0	0	0	0	112.3	S691 A692 L698 S699 I789	S691-A695 WeakPolarHBondContact O-CB 3.25Å; S691-A695 PolarHBondContact O-N 3.28Å; A692-A695 PolarHBondContact O-N 2.87Å; A695-L698 PolarHBondContact O-N 3.35Å; A695-S699 PolarHBondContact O-N 3.26Å; A695-S699 PolarHBondContact O-OG 3.41Å; A695-I789 HydrophobicContact CB-CD1 4.29Å; A695-I789 HydrophobicContact CB-CG1 4.34Å; A695-I789 HydrophobicContact CB-CG2 4.2Å
696	A	94.2	Very high	90.4	Very high	20 Å²	20	27.6 Å²	27.6	17%	0.165	18%	0.184	C	C	.	.	H	α-helix	trans	-65.1	-39.3	178.9	0	0	0	0	0	112.5	L633 I637 A692 S699 S700	L633-A696 HydrophobicContact CB-CB 4.22Å; L633-A696 HydrophobicContact CD1-CB 4.17Å; I637-A696 HydrophobicContact CD1-CB 3.88Å; A692-A696 VanDerWaalsContact O-CB 3.31Å; A692-A696 WeakPolarHBondContact O-CB 3.31Å; A692-A696 PolarHBondContact O-N 3.12Å; A696-S699 PolarHBondContact O-OG 3Å; A696-S699 VanDerWaalsContact O-OG 3.08Å; A696-S700 VanDerWaalsContact O-CB 3.23Å; A696-S700 WeakPolarHBondContact O-CB 3.33Å; A696-S700 PolarHBondContact O-N 3.42Å; A696-S700 VanDerWaalsContact O-N 3.14Å; A696-S700 PolarHBondContact O-OG 3.49Å
697	L	94.3	Very high	91.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-42.8	172.8	-76.3	171.8	0	0	0	111.8	I637 M642 L667 M671 T693 S700 G701 A702 I779	I637-L697 HydrophobicContact CD1-CD2 4.14Å; I637-L697 HydrophobicContact CD1-CG 4.44Å; I637-L697 HydrophobicContact CG1-CD2 4.11Å; M642-L697 HydrophobicContact SD-CD2 4.49Å; L667-L697 HydrophobicContact CB-CD1 4.43Å; L667-L697 HydrophobicContact CD1-CD2 4.3Å; M671-L697 HydrophobicContact CE-CD1 3.48Å; M671-L697 VanDerWaalsContact CE-CD1 3.48Å; M671-L697 HydrophobicContact SD-CD1 3.82Å; T693-L697 HydrophobicContact CG2-CD1 3.96Å; T693-L697 HydrophobicContact CG2-CG 4.49Å; T693-L697 WeakPolarHBondContact O-CB 3.46Å; T693-L697 VanDerWaalsContact O-CG 3.28Å; T693-L697 WeakPolarHBondContact O-CG 3.41Å; T693-L697 PolarHBondContact O-N 2.98Å; L697-S700 PolarHBondContact O-N 2.91Å; L697-G701 PolarHBondContact O-N 3.41Å; L697-A702 HydrophobicContact CB-CB 3.84Å; L697-A702 HydrophobicContact CD2-CB 4.01Å; L697-A702 WeakPolarHBondContact O-CB 3.48Å; L697-A702 PolarHBondContact O-N 3.12Å; L697-I779 HydrophobicContact CB-CD1 3.86Å; L697-I779 HydrophobicContact CB-CG1 4.39Å; L697-I779 HydrophobicContact CD1-CD1 4.25Å; L697-I779 HydrophobicContact CD1-CG1 4.41Å
698	L	92.7	Very high	92	Very high	32 Å²	32	28.1 Å²	28.1	17%	0.168	18%	0.177	C	C	.	.	H	α-helix	trans	-68.4	-44	-179	-176.6	57.6	0	0	0	112.3	A694 A695 S700 G701 V703 I779 T783 I789 P790 P792	A694-L698 WeakPolarHBondContact O-CB 3.45Å; A694-L698 PolarHBondContact O-N 2.88Å; A695-L698 PolarHBondContact O-N 3.35Å; L698-S700 PolarHBondContact O-N 3.01Å; L698-G701 PolarHBondContact O-N 2.86Å; L698-V703 HydrophobicContact CD1-CG2 4.12Å; L698-I779 HydrophobicContact CB-CG2 4.33Å; L698-T783 HydrophobicContact CD2-CG2 4.38Å; L698-I789 HydrophobicContact CD2-CG2 4.2Å; L698-P790 HydrophobicContact CD2-CG 4.19Å; L698-P790 WeakPolarHBondContact CD2-O 3.33Å; L698-P792 HydrophobicContact CD1-CB 3.98Å
699	S	91.9	Very high	92.3	Very high	99 Å²	99	24.6 Å²	24.6	69%	0.692	16%	0.159	S	C	*	.	H	α-helix	trans	-63.9	-27.6	175.5	62.6	0	0	0	0	112.9	A695 A696 G701	A695-S699 PolarHBondContact O-N 3.26Å; A695-S699 PolarHBondContact O-OG 3.41Å; A696-S699 PolarHBondContact O-OG 3Å; A696-S699 VanDerWaalsContact O-OG 3.08Å; S699-G701 VanDerWaalsContact C-N 3.31Å; S699-G701 PolarHBondContact O-N 2.93Å
700	S	91.4	Very high	92.4	Very high	49 Å²	49	24.4 Å²	24.4	34%	0.343	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	11.6	177.3	-52.3	0	0	0	0	114.1	A696 L697 L698 A702	A696-S700 VanDerWaalsContact O-CB 3.23Å; A696-S700 WeakPolarHBondContact O-CB 3.33Å; A696-S700 PolarHBondContact O-N 3.42Å; A696-S700 VanDerWaalsContact O-N 3.14Å; A696-S700 PolarHBondContact O-OG 3.49Å; L697-S700 PolarHBondContact O-N 2.91Å; L698-S700 PolarHBondContact O-N 3.01Å; S700-A702 PolarHBondContact O-N 3.28Å
701	G	90.7	Very high	92.4	Very high	25 Å²	25	27.7 Å²	27.7	26%	0.258	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	25.5	175.1	0	0	0	0	0	114.8	L697 L698 S699 V703 D704 Y705	L697-G701 PolarHBondContact O-N 3.41Å; L698-G701 PolarHBondContact O-N 2.86Å; S699-G701 VanDerWaalsContact C-N 3.31Å; S699-G701 PolarHBondContact O-N 2.93Å; G701-V703 PolarHBondContact O-N 2.98Å; G701-V703 VanDerWaalsContact O-N 3.14Å; G701-D704 PolarHBondContact O-N 2.99Å; G701-D704 VanDerWaalsContact O-N 3.08Å; G701-Y705 PolarHBondContact O-N 3.31Å
702	A	92.6	Very high	92.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-29.8	-175.5	0	0	0	0	0	114.1	M642 L697 S700 C706 I779	M642-A702 HydrophobicContact CE-CB 3.69Å; L697-A702 HydrophobicContact CB-CB 3.84Å; L697-A702 HydrophobicContact CD2-CB 4.01Å; L697-A702 WeakPolarHBondContact O-CB 3.48Å; L697-A702 PolarHBondContact O-N 3.12Å; S700-A702 PolarHBondContact O-N 3.28Å; A702-C706 WeakPolarHBondContact O-CB 3.25Å; A702-C706 PolarHBondContact O-N 2.79Å; A702-C706 PolarHBondContact O-SG 3.18Å; A702-I779 HydrophobicContact CB-CD1 4.1Å
703	V	92.6	Very high	92.2	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.024	16%	0.163	C	C	.	.	H	α-helix	trans	-64.9	-50.1	174.5	177.3	0	0	0	0	110.4	L698 G701 C706 L707 P792 F794 W798	L698-V703 HydrophobicContact CD1-CG2 4.12Å; G701-V703 PolarHBondContact O-N 2.98Å; G701-V703 VanDerWaalsContact O-N 3.14Å; V703-C706 PolarHBondContact O-N 2.93Å; V703-L707 PolarHBondContact O-N 3.23Å; V703-P792 HydrophobicContact CG2-CB 4.07Å; V703-F794 HydrophobicContact CG1-CD1 4.12Å; V703-F794 HydrophobicContact CG1-CE1 3.88Å; V703-F794 HydrophobicContact CG1-CZ 4.49Å; V703-W798 HydrophobicContact CG1-CZ2 4.01Å; V703-W798 VanDerWaalsContact O-CZ2 3.3Å; V703-W798 WeakPolarHBondContact O-CZ2 3.24Å
704	D	91.4	Very high	91.9	Very high	94 Å²	94	27 Å²	27	50%	0.503	17%	0.166	S	C	.	.	H	α-helix	trans	-64.7	-42.4	177.7	-65.8	-67.6	0	0	0	112.3	G701 C706 L707 H708	G701-D704 PolarHBondContact O-N 2.99Å; G701-D704 VanDerWaalsContact O-N 3.08Å; D704-C706 VanDerWaalsContact C-N 3.35Å; D704-C706 PolarHBondContact O-N 3.24Å; D704-L707 WeakPolarHBondContact O-CB 3.44Å; D704-L707 PolarHBondContact O-N 2.91Å; D704-H708 PolarHBondContact O-N 2.92Å; D704-H708 PolarHBondContact O-ND1 2.91Å
705	Y	91.8	Very high	91.5	Very high	11 Å²	11	34.4 Å²	34.4	4%	0.043	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-47.7	174.3	172.6	-90.8	0	0	0	111.3	M642 K650 M664 G701 L707 H708 V709	M642-Y705 HydrophobicContact CB-CD2 4.11Å; M642-Y705 HydrophobicContact CB-CG 4.29Å; M642-Y705 HydrophobicContact CE-CD1 3.4Å; M642-Y705 VanDerWaalsContact CE-CD1 3.4Å; M642-Y705 HydrophobicContact CE-CD2 4.46Å; M642-Y705 HydrophobicContact CE-CE1 4.06Å; M642-Y705 HydrophobicContact CE-CG 3.64Å; M642-Y705 HydrophobicContact CG-CD2 4.41Å; M642-Y705 HydrophobicContact CG-CG 4.44Å; K650-Y705 WeakPolarHBondContact CE-OH 3.15Å; K650-Y705 PolarHBondContact NZ-OH 3.41Å; M664-Y705 HydrophobicContact SD-CE1 4.49Å; G701-Y705 PolarHBondContact O-N 3.31Å; Y705-L707 VanDerWaalsContact C-N 3.31Å; Y705-L707 PolarHBondContact O-N 2.93Å; Y705-H708 PolarHBondContact O-N 3.23Å; Y705-H708 VanDerWaalsContact O-N 3.14Å; Y705-V709 HydrophobicContact CD1-CG2 4.16Å; Y705-V709 HydrophobicContact CE1-CG2 3.73Å; Y705-V709 HydrophobicContact CE2-CG2 4.34Å; Y705-V709 WeakPolarHBondContact O-CG2 3.2Å; Y705-V709 PolarHBondContact O-N 3.12Å
706	C	93.6	Very high	91.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-40.2	178.8	-71.5	0	0	0	0	112.2	A702 V703 D704 H708 V709 L710 V772 P776 W798	A702-C706 WeakPolarHBondContact O-CB 3.25Å; A702-C706 PolarHBondContact O-N 2.79Å; A702-C706 PolarHBondContact O-SG 3.18Å; V703-C706 PolarHBondContact O-N 2.93Å; D704-C706 VanDerWaalsContact C-N 3.35Å; D704-C706 PolarHBondContact O-N 3.24Å; C706-H708 PolarHBondContact O-N 3.36Å; C706-V709 PolarHBondContact O-N 3.01Å; C706-L710 PolarHBondContact O-N 3.34Å; C706-V772 HydrophobicContact CB-CG1 3.68Å; C706-V772 WeakPolarHBondContact O-CG1 3.36Å; C706-P776 HydrophobicContact CB-CG 3.74Å; C706-W798 HydrophobicContact CB-CH2 4.2Å; C706-W798 HydrophobicContact CB-CZ2 4.24Å
707	L	92.4	Very high	90.7	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-45.1	174.1	-179.6	63.4	0	0	0	111.7	V703 D704 Y705 V709 L710 K711 W798 F801	V703-L707 PolarHBondContact O-N 3.23Å; D704-L707 WeakPolarHBondContact O-CB 3.44Å; D704-L707 PolarHBondContact O-N 2.91Å; Y705-L707 VanDerWaalsContact C-N 3.31Å; Y705-L707 PolarHBondContact O-N 2.93Å; L707-V709 VanDerWaalsContact C-N 3.35Å; L707-V709 PolarHBondContact O-N 2.98Å; L707-L710 PolarHBondContact O-N 3.3Å; L707-K711 WeakPolarHBondContact O-CG 3.41Å; L707-K711 PolarHBondContact O-N 3.4Å; L707-W798 HydrophobicContact CB-CD2 4.41Å; L707-W798 HydrophobicContact CB-CZ2 3.8Å; L707-W798 HydrophobicContact CD1-CD2 3.9Å; L707-W798 HydrophobicContact CD1-CE3 4.25Å; L707-W798 HydrophobicContact CD1-CG 4.06Å; L707-W798 HydrophobicContact CD2-CG 4.46Å; L707-F801 HydrophobicContact CD1-CB 4.41Å; L707-F801 HydrophobicContact CD1-CD2 4.14Å
708	H	91	Very high	90.3	Very high	82 Å²	82	41.2 Å²	41.2	38%	0.38	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-36.6	179	-71.8	84.1	0	0	0	112.5	V647 D704 Y705 C706 K711 S712	V647-H708 HydrophobicContact CB-CB 4.43Å; V647-H708 HydrophobicContact CG2-CB 3.89Å; D704-H708 PolarHBondContact O-N 2.92Å; D704-H708 PolarHBondContact O-ND1 2.91Å; Y705-H708 PolarHBondContact O-N 3.23Å; Y705-H708 VanDerWaalsContact O-N 3.14Å; C706-H708 PolarHBondContact O-N 3.36Å; H708-K711 PolarHBondContact O-N 2.69Å; H708-S712 PolarHBondContact O-N 3Å
709	V	91.6	Very high	89.7	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-41.8	173.2	-176	0	0	0	0	110.6	V647 Y705 C706 L707 K711 S712 L713 L768 V772	V647-V709 HydrophobicContact CG1-CB 3.96Å; V647-V709 HydrophobicContact CG1-CG2 3.4Å; Y705-V709 HydrophobicContact CD1-CG2 4.16Å; Y705-V709 HydrophobicContact CE1-CG2 3.73Å; Y705-V709 HydrophobicContact CE2-CG2 4.34Å; Y705-V709 WeakPolarHBondContact O-CG2 3.2Å; Y705-V709 PolarHBondContact O-N 3.12Å; C706-V709 PolarHBondContact O-N 3.01Å; L707-V709 VanDerWaalsContact C-N 3.35Å; L707-V709 PolarHBondContact O-N 2.98Å; V709-K711 VanDerWaalsContact C-N 3.32Å; V709-K711 PolarHBondContact O-N 3Å; V709-S712 PolarHBondContact O-N 2.98Å; V709-L713 HydrophobicContact CG1-CD1 3.79Å; V709-L713 HydrophobicContact CG1-CG 4.22Å; V709-L713 WeakPolarHBondContact O-CB 3.48Å; V709-L713 WeakPolarHBondContact O-CG 3.23Å; V709-L713 PolarHBondContact O-N 3.08Å; V709-L768 HydrophobicContact CG1-CD1 4.47Å; V709-L768 HydrophobicContact CG1-CD2 4.06Å; V709-L768 HydrophobicContact CG1-CG 4.26Å; V709-V772 HydrophobicContact CB-CG1 4.02Å; V709-V772 HydrophobicContact CB-CG2 4.14Å; V709-V772 HydrophobicContact CG1-CG1 4.35Å; V709-V772 HydrophobicContact CG1-CG2 3.8Å
710	L	92	Very high	88.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-33.4	176.4	-77.3	164.4	0	0	0	113.6	C706 L707 L714 V772 L773 W798 Y805	C706-L710 PolarHBondContact O-N 3.34Å; L707-L710 PolarHBondContact O-N 3.3Å; L710-L714 WeakPolarHBondContact O-CB 3.4Å; L710-L714 PolarHBondContact O-N 3.32Å; L710-L714 VanDerWaalsContact O-N 3.09Å; L710-V772 HydrophobicContact CD1-CG1 4.04Å; L710-V772 HydrophobicContact CD2-CG1 4.28Å; L710-V772 HydrophobicContact CG-CG1 3.65Å; L710-L773 HydrophobicContact CD1-CD2 3.82Å; L710-L773 HydrophobicContact CD2-CD2 3.94Å; L710-L773 HydrophobicContact CD2-CG 4.12Å; L710-W798 HydrophobicContact CD1-CH2 3.67Å; L710-W798 HydrophobicContact CD1-CZ3 3.48Å; L710-W798 VanDerWaalsContact CD1-CZ3 3.48Å; L710-Y805 HydrophobicContact CB-CE2 4.08Å; L710-Y805 HydrophobicContact CD2-CD2 4.4Å; L710-Y805 HydrophobicContact CD2-CE2 3.72Å; L710-Y805 HydrophobicContact CG-CE2 4.47Å; L710-Y805 WeakPolarHBondContact O-CE2 3.45Å; L710-Y805 PolarHBondContact O-OH 2.99Å
711	K	91.2	Very high	87.8	Confident	70 Å²	70	42.5 Å²	42.5	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-63.6	-47.7	174.2	-64.1	-176.7	-166	-178	0	111.4	L707 H708 V709 L714 F801	L707-K711 WeakPolarHBondContact O-CG 3.41Å; L707-K711 PolarHBondContact O-N 3.4Å; H708-K711 PolarHBondContact O-N 2.69Å; V709-K711 VanDerWaalsContact C-N 3.32Å; V709-K711 PolarHBondContact O-N 3Å; K711-L714 PolarHBondContact O-N 2.81Å; K711-F801 HydrophobicContact CB-CE1 4.34Å; K711-F801 HydrophobicContact CD-CD2 4.38Å; K711-F801 HydrophobicContact CD-CE1 4.43Å; K711-F801 HydrophobicContact CD-CE2 3.79Å; K711-F801 HydrophobicContact CD-CZ 3.83Å; K711-F801 VanDerWaalsContact CE-CE2 3.43Å; K711-F801 HydrophobicContact CG-CD1 4.04Å; K711-F801 HydrophobicContact CG-CD2 4.01Å; K711-F801 HydrophobicContact CG-CE1 3.78Å; K711-F801 HydrophobicContact CG-CE2 3.78Å; K711-F801 HydrophobicContact CG-CG 4.17Å; K711-F801 HydrophobicContact CG-CZ 3.67Å
712	S	89.6	Confident	86.2	Confident	27 Å²	27	47.9 Å²	47.9	19%	0.189	23%	0.234	C	C	.	.	H	α-helix	trans	-65.7	-39.9	178.2	173.5	0	0	0	0	112.5	H708 V709 L714	H708-S712 PolarHBondContact O-N 3Å; V709-S712 PolarHBondContact O-N 2.98Å; S712-L714 VanDerWaalsContact C-N 3.31Å; S712-L714 PolarHBondContact O-N 3.13Å
713	L	90.1	Very high	84.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-32.1	175.9	-77.5	169.8	0	0	0	113.2	N651 V709 E715 Y716 W717 T765 L768 Y805	N651-L713 HydrophobicContact CB-CD2 4.39Å; N651-L713 WeakPolarHBondContact OD1-CD2 3.37Å; V709-L713 HydrophobicContact CG1-CD1 3.79Å; V709-L713 HydrophobicContact CG1-CG 4.22Å; V709-L713 WeakPolarHBondContact O-CB 3.48Å; V709-L713 WeakPolarHBondContact O-CG 3.23Å; V709-L713 PolarHBondContact O-N 3.08Å; L713-E715 VanDerWaalsContact C-N 3.3Å; L713-E715 PolarHBondContact O-N 3.24Å; L713-Y716 PolarHBondContact O-N 3.05Å; L713-W717 PolarHBondContact O-N 3.24Å; L713-W717 VanDerWaalsContact O-N 3.07Å; L713-T765 HydrophobicContact CD2-CG2 3.46Å; L713-T765 VanDerWaalsContact CD2-CG2 3.46Å; L713-L768 HydrophobicContact CD1-CD2 4.35Å; L713-L768 HydrophobicContact CD1-CG 4.29Å; L713-L768 HydrophobicContact CD2-CD2 4.19Å; L713-Y805 VanDerWaalsContact C-OH 3.27Å; L713-Y805 WeakPolarHBondContact CB-OH 3.22Å
714	L	88.6	Confident	82	Confident	9 Å²	9	61 Å²	61	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-34.4	-174.8	179	60.4	0	0	0	112	L710 K711 S712 W717 K718 F801 E804 Y805 I808	L710-L714 WeakPolarHBondContact O-CB 3.4Å; L710-L714 PolarHBondContact O-N 3.32Å; L710-L714 VanDerWaalsContact O-N 3.09Å; K711-L714 PolarHBondContact O-N 2.81Å; S712-L714 VanDerWaalsContact C-N 3.31Å; S712-L714 PolarHBondContact O-N 3.13Å; L714-W717 PolarHBondContact O-N 2.9Å; L714-K718 HydrophobicContact CD1-CD 4.44Å; L714-K718 HydrophobicContact CD1-CG 4.36Å; L714-K718 HydrophobicContact CG-CD 4.35Å; L714-K718 WeakPolarHBondContact O-CB 3.17Å; L714-K718 WeakPolarHBondContact O-CG 3.46Å; L714-K718 PolarHBondContact O-N 3.47Å; L714-F801 HydrophobicContact CD2-CD1 3.69Å; L714-F801 HydrophobicContact CD2-CE1 4.03Å; L714-E804 HydrophobicContact CD1-CB 4.28Å; L714-E804 HydrophobicContact CD2-CB 3.7Å; L714-E804 HydrophobicContact CD2-CG 4.07Å; L714-Y805 WeakPolarHBondContact CA-OH 3.19Å; L714-Y805 HydrophobicContact CB-CE2 4.01Å; L714-Y805 HydrophobicContact CD1-CD1 4.47Å; L714-Y805 HydrophobicContact CD1-CD2 4.34Å; L714-Y805 HydrophobicContact CD1-CE1 4.39Å; L714-Y805 HydrophobicContact CD1-CE2 4.2Å; L714-Y805 HydrophobicContact CD1-CG 4.44Å; L714-Y805 PolarHBondContact N-OH 3.37Å; L714-I808 HydrophobicContact CD1-CD1 3.67Å
715	E	84.3	Confident	79.3	Confident	154 Å²	154	64.2 Å²	64.2	72%	0.72	31%	0.311	S	S	*	.	H	α-helix	trans	-64.3	-43.7	177.6	-170.5	165.6	-157.7	0	0	111.4	L713 K718 S719	L713-E715 VanDerWaalsContact C-N 3.3Å; L713-E715 PolarHBondContact O-N 3.24Å; E715-K718 PolarHBondContact O-N 3.28Å; E715-S719 PolarHBondContact O-N 3.13Å
716	Y	85.3	Confident	76.7	Confident	76 Å²	76	69.9 Å²	69.9	30%	0.298	35%	0.349	S	S	.	.	H	α-helix	trans	-64.4	-44.1	174.8	171.4	-84.9	0	0	0	113.1	N651 L713 K718 S719 Q720 T765	N651-Y716 VanDerWaalsContact ND2-CB 3.3Å; N651-Y716 WeakPolarHBondContact ND2-CB 3.25Å; L713-Y716 PolarHBondContact O-N 3.05Å; Y716-K718 PolarHBondContact O-N 2.78Å; Y716-S719 PolarHBondContact O-N 3.07Å; Y716-S719 PolarHBondContact O-OG 3.3Å; Y716-Q720 HydrophobicContact CD1-CG 4.36Å; Y716-Q720 HydrophobicContact CE1-CG 3.92Å; Y716-Q720 WeakPolarHBondContact O-CG 3.38Å; Y716-Q720 PolarHBondContact O-N 3.16Å; Y716-Q720 VanDerWaalsContact O-N 3.14Å; Y716-Q720 PolarHBondContact OH-NE2 3.5Å; Y716-Q720 VanDerWaalsContact OH-NE2 3.09Å; Y716-T765 HydrophobicContact CD1-CG2 3.7Å; Y716-T765 HydrophobicContact CE1-CG2 3.64Å; Y716-T765 HydrophobicContact CG-CG2 4.45Å
717	W	86.6	Confident	73.9	Confident	34 Å²	34	75.6 Å²	75.6	13%	0.129	38%	0.383	C	S	.	.	H	α-helix	trans	-68.7	-20.1	177.6	-70.2	117.4	0	0	0	112.8	L713 L714 T765 Q766 T769 Y805 I808 T811	L713-W717 PolarHBondContact O-N 3.24Å; L713-W717 VanDerWaalsContact O-N 3.07Å; L714-W717 PolarHBondContact O-N 2.9Å; W717-T765 HydrophobicContact CZ2-CG2 4.01Å; W717-Q766 HydrophobicContact CH2-CB 4.35Å; W717-Q766 HydrophobicContact CZ2-CB 4.4Å; W717-T769 PolarHBondContact NE1-OG1 3.06Å; W717-T769 VanDerWaalsContact NE1-OG1 3.11Å; W717-Y805 AromaticContact CD1-CE1 3.69Å; W717-Y805 HydrophobicContact CG-CE1 4.43Å; W717-I808 HydrophobicContact CB-CD1 3.74Å; W717-T811 HydrophobicContact CD2-CG2 4.13Å; W717-T811 HydrophobicContact CE3-CG2 3.51Å; W717-T811 HydrophobicContact CH2-CG2 4.25Å; W717-T811 HydrophobicContact CZ3-CG2 3.58Å
718	K	84.5	Confident	71.3	Confident	91 Å²	91	79.9 Å²	79.9	40%	0.396	42%	0.42	S	S	.	.	H	α-helix	trans	-84.5	-31.5	171	-76	-177.7	175.7	-165.9	0	113.8	L714 E715 Y716 Q721 E804	L714-K718 HydrophobicContact CD1-CD 4.44Å; L714-K718 HydrophobicContact CD1-CG 4.36Å; L714-K718 HydrophobicContact CG-CD 4.35Å; L714-K718 WeakPolarHBondContact O-CB 3.17Å; L714-K718 WeakPolarHBondContact O-CG 3.46Å; L714-K718 PolarHBondContact O-N 3.47Å; E715-K718 PolarHBondContact O-N 3.28Å; Y716-K718 PolarHBondContact O-N 2.78Å; K718-Q721 PolarHBondContact O-N 3.13Å; K718-E804 VanDerWaalsContact CE-OE2 3.28Å; K718-E804 WeakPolarHBondContact CE-OE2 3.3Å; K718-E804 IonicContact NZ-OE2 2.6Å; K718-E804 PolarHBondContact NZ-OE2 3.48Å
719	S	80.4	Confident	68.8	Low	53 Å²	53	81.7 Å²	81.7	37%	0.371	44%	0.436	S	S	.	.	H	α-helix	trans	-69.4	-43.6	175.3	66	0	0	0	0	111.3	E715 Y716 Q721 N722	E715-S719 PolarHBondContact O-N 3.13Å; Y716-S719 PolarHBondContact O-N 3.07Å; Y716-S719 PolarHBondContact O-OG 3.3Å; S719-Q721 PolarHBondContact O-N 2.97Å; S719-Q721 VanDerWaalsContact O-N 3.13Å; S719-N722 PolarHBondContact O-N 3.4Å
720	Q	75.4	Confident	66.3	Low	80 Å²	80	86.3 Å²	86.3	37%	0.374	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-53	-33.7	174.5	-73.1	-76.3	-12.4	0	0	113.1	Y716 N722 D723	Y716-Q720 HydrophobicContact CD1-CG 4.36Å; Y716-Q720 HydrophobicContact CE1-CG 3.92Å; Y716-Q720 WeakPolarHBondContact O-CG 3.38Å; Y716-Q720 PolarHBondContact O-N 3.16Å; Y716-Q720 VanDerWaalsContact O-N 3.14Å; Y716-Q720 PolarHBondContact OH-NE2 3.5Å; Y716-Q720 VanDerWaalsContact OH-NE2 3.09Å; Q720-N722 PolarHBondContact O-N 3.03Å; Q720-D723 PolarHBondContact O-N 3.02Å
721	Q	68.4	Low	63.7	Low	74 Å²	74	95 Å²	95	35%	0.346	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-69.1	-15.2	179.5	-168	172.4	-9.1	0	0	114	K718 S719	K718-Q721 PolarHBondContact O-N 3.13Å; S719-Q721 PolarHBondContact O-N 2.97Å; S719-Q721 VanDerWaalsContact O-N 3.13Å
722	N	57.6	Low	61.3	Low	138 Å²	138	98.7 Å²	98.7	74%	0.738	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-100.8	-11.7	-178.4	-62.8	-30.3	0	0	0	114.3	S719 Q720	S719-N722 PolarHBondContact O-N 3.4Å; Q720-N722 PolarHBondContact O-N 3.03Å
723	D	54.9	Low	58.9	Low	129 Å²	129	105.6 Å²	105.6	69%	0.69	57%	0.566	S	S	*	*			trans	-99.1	4.5	-169.6	-73.8	-36	0	0	0	114.1	Q720 E725	Q720-D723 PolarHBondContact O-N 3.02Å; D723-E725 PolarHBondContact O-N 3.47Å
724	E	41.5	Very low	56.9	Low	151 Å²	151	112.4 Å²	112.4	71%	0.706	60%	0.595	S	S	*	*			trans	-76.2	80.7	179.3	-76.1	-167.2	138.7	0	0	113.5	Q810	E724-Q810 PolarHBondContact OE2-NE2 3.39Å
725	E	34.3	Very low	54.9	Low	163 Å²	163	117.5 Å²	117.5	76%	0.762	63%	0.629	S	S	*	*			trans	-81.5	143.4	135.7	-86.9	-154.3	147.9	0	0	109.3	D723 V727	D723-E725 PolarHBondContact O-N 3.47Å; E725-V727 PolarHBondContact O-N 2.83Å
726	P	37.1	Very low	52.9	Low	130 Å²	130	119 Å²	119	84%	0.844	64%	0.636	S	S	*	*			trans	-75.7	72.9	-178.8	32.2	-36.2	0	0	0	111.7	A728	P726-A728 VanDerWaalsContact C-N 3.34Å; P726-A728 PolarHBondContact O-N 3.23Å
727	V	35.8	Very low	51.4	Low	119 Å²	119	118.9 Å²	118.9	72%	0.721	64%	0.643	S	S	*	*			trans	-69.9	91.4	173.1	-177.5	0	0	0	0	108.9	E725 T729	E725-V727 PolarHBondContact O-N 2.83Å; V727-T729 PolarHBondContact O-N 3.42Å
728	A	36.6	Very low	49.7	Very low	95 Å²	95	123.2 Å²	123.2	79%	0.785	67%	0.673	S	S	*	*			trans	-49.7	108	178.3	0	0	0	0	0	110.9	P726 S730	P726-A728 VanDerWaalsContact C-N 3.34Å; P726-A728 PolarHBondContact O-N 3.23Å; A728-S730 PolarHBondContact O-N 2.9Å; A728-S730 VanDerWaalsContact O-N 3.12Å
729	T	38.6	Very low	48.6	Very low	119 Å²	119	122.9 Å²	122.9	73%	0.73	68%	0.682	S	S	*	*			trans	-70.1	113.9	-170	49.3	0	0	0	0	110.4	V727 Q731	V727-T729 PolarHBondContact O-N 3.42Å; T729-Q731 PolarHBondContact O-N 2.82Å
730	S	39.7	Very low	48.1	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	70%	0.7	S	S	*	*			trans	-65.4	103.8	176.8	56	0	0	0	0	109.4	A728 L732	A728-S730 PolarHBondContact O-N 2.9Å; A728-S730 VanDerWaalsContact O-N 3.12Å; S730-L732 PolarHBondContact O-N 3.17Å
731	Q	36.7	Very low	48.2	Very low	185 Å²	185	123.7 Å²	123.7	86%	0.864	70%	0.696	S	S	*	*			trans	-68.8	77.3	178	-66.2	-169.6	6.6	0	0	111.1	T729	T729-Q731 PolarHBondContact O-N 2.82Å
732	L	42.4	Very low	49	Very low	146 Å²	146	122 Å²	122	76%	0.764	69%	0.691	S	S	*	*			trans	-58.2	136.7	164.1	-68.3	172.6	0	0	0	108.7	S730 K734	S730-L732 PolarHBondContact O-N 3.17Å; L732-K734 PolarHBondContact O-N 3.21Å
733	L	37.8	Very low	50.4	Low	172 Å²	172	117.7 Å²	117.7	90%	0.901	67%	0.668	S	S	*	*			trans	-58.1	100.7	-178.2	-65.8	168.7	0	0	0	110.4
734	K	48.5	Very low	52.1	Low	144 Å²	144	111.9 Å²	111.9	63%	0.626	64%	0.637	S	S	*	*			trans	-57.2	128.9	175.7	-73.8	-163	173	-164.9	0	108.3	L732 H736 E762	L732-K734 PolarHBondContact O-N 3.21Å; K734-H736 PolarHBondContact O-N 3.06Å; K734-E762 IonicContact NZ-OE1 2.94Å; K734-E762 PolarHBondContact NZ-OE1 3.49Å; K734-E762 IonicContact NZ-OE2 3.11Å
735	P	46	Very low	54.4	Low	116 Å²	116	106.9 Å²	106.9	75%	0.753	62%	0.618	S	S	*	*			trans	-55.4	126	-175.8	-28.3	35.2	0	0	0	112.6	T737	P735-T737 PolarHBondContact O-N 3.01Å; P735-T737 VanDerWaalsContact O-N 3.16Å
736	H	43.8	Very low	57.2	Low	185 Å²	185	101.3 Å²	101.3	86%	0.856	60%	0.596	S	S	*	*			trans	-75.4	105.9	-179.3	-129.9	62.8	0	0	0	110	K734 T738	K734-H736 PolarHBondContact O-N 3.06Å; H736-T738 PolarHBondContact O-N 3.39Å
737	T	52.1	Low	59.9	Low	74 Å²	74	95.1 Å²	95.1	45%	0.454	56%	0.556	S	S	.	*			trans	-70.1	113	177.4	52.8	0	0	0	0	109.8	P735 S739	P735-T737 PolarHBondContact O-N 3.01Å; P735-T737 VanDerWaalsContact O-N 3.16Å; T737-S739 PolarHBondContact O-N 3.22Å; T737-S739 VanDerWaalsContact O-N 3.07Å
738	T	51.9	Low	62.7	Low	124 Å²	124	89.6 Å²	89.6	76%	0.761	52%	0.523	S	S	*	.	S	Bend	trans	-74	4.6	-174.2	56.7	0	0	0	0	114.8	F284 H736	F284-T738 HydrophobicContact CZ-CG2 4.46Å; H736-T738 PolarHBondContact O-N 3.39Å
739	S	61.8	Low	65.2	Low	84 Å²	84	88.3 Å²	88.3	59%	0.587	50%	0.502	S	S	*	.	S	Bend	trans	-130.1	140.4	177.2	56.2	0	0	0	0	109.8	T737	T737-S739 PolarHBondContact O-N 3.22Å; T737-S739 VanDerWaalsContact O-N 3.07Å
740	S	68.4	Low	67.5	Low	107 Å²	107	88.4 Å²	88.4	75%	0.748	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-58.1	137.6	170.8	51.4	0	0	0	0	111.3
741	P	78.2	Confident	69.8	Low	44 Å²	44	90.5 Å²	90.5	29%	0.286	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-66.2	150	177.7	29.3	-35.9	0	0	0	111.3	V753 A757	P741-V753 HydrophobicContact CB-CG1 3.79Å; P741-V753 HydrophobicContact CG-CG1 3.95Å; P741-A757 HydrophobicContact CB-CB 4.28Å; P741-A757 HydrophobicContact CG-CB 4.03Å
742	P	84.6	Confident	72.3	Confident	38 Å²	38	84.4 Å²	84.4	25%	0.247	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-74.4	158.1	-173.6	30.7	-36.5	0	0	0	113.2	F338 M744	F338-P742 HydrophobicContact CB-CB 4.37Å; F338-P742 HydrophobicContact CD1-CB 3.7Å; F338-P742 HydrophobicContact CD1-CG 4.35Å; F338-P742 HydrophobicContact CD2-CB 3.73Å; F338-P742 HydrophobicContact CD2-CG 3.81Å; F338-P742 HydrophobicContact CE1-CB 3.81Å; F338-P742 HydrophobicContact CE1-CG 4.05Å; F338-P742 HydrophobicContact CE2-CB 3.85Å; F338-P742 HydrophobicContact CE2-CG 3.47Å; F338-P742 VanDerWaalsContact CE2-CG 3.47Å; F338-P742 HydrophobicContact CG-CB 3.65Å; F338-P742 HydrophobicContact CG-CG 4.23Å; F338-P742 HydrophobicContact CZ-CB 3.88Å; F338-P742 HydrophobicContact CZ-CG 3.6Å; P742-M744 HydrophobicContact CG-CE 3.96Å; P742-M744 PolarHBondContact O-N 2.83Å; P742-M744 VanDerWaalsContact O-N 3.11Å
743	D	86.9	Confident	74.5	Confident	47 Å²	47	77.7 Å²	77.7	25%	0.251	42%	0.423	S	S	.	.			trans	-73.7	103.7	-178.3	-164.9	-21.1	0	0	0	112	Q609 S745 R750	Q609-D743 PolarHBondContact NE2-O 3.47Å; D743-S745 WeakPolarHBondContact OD1-CB 3.43Å; D743-S745 PolarHBondContact OD1-N 3.14Å; D743-S745 PolarHBondContact OD1-OG 3.1Å; D743-R750 IonicContact OD2-CZ 3.01Å; D743-R750 IonicContact OD2-NE 3.91Å; D743-R750 PolarHBondContact OD2-NE 2.78Å; D743-R750 VanDerWaalsContact OD2-NE 3.11Å; D743-R750 IonicContact OD2-NH2 2.82Å; D743-R750 PolarHBondContact OD2-NH2 2.92Å
744	M	91.4	Very high	76.8	Confident	8 Å²	8	77.5 Å²	77.5	4%	0.039	41%	0.414	C	S	.	.			trans	-94.4	12.5	177.7	-55.7	-170.3	-169.9	0	0	113.7	F338 V602 I605 P742 F747 F748 V753 V760	F338-M744 HydrophobicContact CE1-CG 4.28Å; F338-M744 HydrophobicContact CZ-CE 4.34Å; F338-M744 HydrophobicContact CZ-CG 4.14Å; V602-M744 HydrophobicContact CG1-CE 3.9Å; I605-M744 HydrophobicContact CD1-CB 4.26Å; I605-M744 HydrophobicContact CD1-CG 4.21Å; I605-M744 HydrophobicContact CD1-SD 3.56Å; I605-M744 VanDerWaalsContact CD1-SD 3.56Å; I605-M744 HydrophobicContact CG2-CB 3.95Å; I605-M744 HydrophobicContact CG2-CG 4.05Å; P742-M744 HydrophobicContact CG-CE 3.96Å; P742-M744 PolarHBondContact O-N 2.83Å; P742-M744 VanDerWaalsContact O-N 3.11Å; M744-F747 PolarHBondContact O-N 3.26Å; M744-F747 VanDerWaalsContact O-N 3.1Å; M744-F748 HydrophobicContact CB-CB 4.28Å; M744-F748 HydrophobicContact CB-CD2 4.38Å; M744-F748 PolarHBondContact O-N 3.01Å; M744-F748 VanDerWaalsContact O-N 3.15Å; M744-V753 HydrophobicContact CB-CG2 4.15Å; M744-V753 HydrophobicContact CG-CG2 4.43Å; M744-V753 HydrophobicContact SD-CG2 4.44Å; M744-V760 HydrophobicContact CE-CG2 3.97Å; M744-V760 HydrophobicContact SD-CB 4.36Å; M744-V760 HydrophobicContact SD-CG1 4.1Å; M744-V760 HydrophobicContact SD-CG2 3.93Å
745	S	90.3	Very high	78.5	Confident	45 Å²	45	73.7 Å²	73.7	32%	0.315	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	150.3	175.9	65.4	0	0	0	0	112	Q609 D743	Q609-S745 PolarHBondContact NE2-O 3.3Å; D743-S745 WeakPolarHBondContact OD1-CB 3.43Å; D743-S745 PolarHBondContact OD1-N 3.14Å; D743-S745 PolarHBondContact OD1-OG 3.1Å
746	P	92.4	Very high	80.5	Confident	46 Å²	46	70.6 Å²	70.6	30%	0.299	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.5	13.9	-2.5	36.9	-34.6	0	0	0	113.8	M417 L612 V669	M417-P746 WeakPolarHBondContact CE-O 3.37Å; L612-P746 VanDerWaalsContact CD2-CD 3.47Å; L612-P746 HydrophobicContact CD2-CG 3.42Å; L612-P746 VanDerWaalsContact CD2-CG 3.42Å; V669-P746 HydrophobicContact CG1-CG 3.94Å; V669-P746 HydrophobicContact CG2-CB 4.31Å; V669-P746 HydrophobicContact CG2-CG 3.98Å
747	F	94.1	Very high	82.2	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-29.6	179.3	-52.7	-44.4	0	0	0	112.6	I605 M608 Q609 L612 V662 R665 L666 M744	I605-F747 HydrophobicContact CG1-CD2 4.23Å; I605-F747 HydrophobicContact CG2-CD2 4.15Å; M608-F747 HydrophobicContact CB-CE2 3.51Å; M608-F747 HydrophobicContact CB-CZ 3.64Å; Q609-F747 HydrophobicContact CG-CD2 4.23Å; Q609-F747 HydrophobicContact CG-CE2 3.74Å; L612-F747 HydrophobicContact CD2-CE1 4.22Å; L612-F747 HydrophobicContact CD2-CZ 4.24Å; V662-F747 HydrophobicContact CG1-CD2 4.03Å; V662-F747 HydrophobicContact CG1-CE2 4.17Å; V662-F747 HydrophobicContact CG1-CG 4.35Å; R665-F747 HydrophobicContact CB-CD1 4.13Å; R665-F747 WeakPolarHBondContact CD-O 3.44Å; R665-F747 PolarHBondContact NH1-O 3.26Å; L666-F747 HydrophobicContact CB-CE1 3.98Å; L666-F747 HydrophobicContact CB-CZ 4.42Å; L666-F747 HydrophobicContact CD1-CE1 4.03Å; L666-F747 HydrophobicContact CD1-CZ 4.13Å; M744-F747 PolarHBondContact O-N 3.26Å; M744-F747 VanDerWaalsContact O-N 3.1Å
748	F	93.6	Very high	83.5	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.013	38%	0.376	C	S	.	.	S	Bend	trans	-135.6	144.9	172.7	-65.3	-96.1	0	0	0	110.5	I605 M744 Y752 V753 V760 F761 L767	I605-F748 HydrophobicContact CD1-CD2 3.94Å; I605-F748 HydrophobicContact CD1-CE2 3.75Å; M744-F748 HydrophobicContact CB-CB 4.28Å; M744-F748 HydrophobicContact CB-CD2 4.38Å; M744-F748 PolarHBondContact O-N 3.01Å; M744-F748 VanDerWaalsContact O-N 3.15Å; F748-Y752 HydrophobicContact CB-CD1 4.49Å; F748-Y752 AromaticContact CD1-CD1 3.66Å; F748-Y752 HydrophobicContact CD1-CD1 3.66Å; F748-Y752 AromaticContact CD1-CE1 3.65Å; F748-Y752 HydrophobicContact CD1-CE1 3.65Å; F748-Y752 HydrophobicContact CE1-CD1 4.43Å; F748-Y752 AromaticContact CE1-CE1 3.95Å; F748-Y752 HydrophobicContact CE1-CE1 3.95Å; F748-V753 HydrophobicContact CB-CG2 3.53Å; F748-V753 HydrophobicContact CG-CG2 4.46Å; F748-V760 HydrophobicContact CB-CG1 4.43Å; F748-V760 HydrophobicContact CD1-CG1 3.45Å; F748-V760 VanDerWaalsContact CD1-CG1 3.45Å; F748-V760 HydrophobicContact CD2-CG1 3.98Å; F748-V760 HydrophobicContact CE1-CG1 3.5Å; F748-V760 HydrophobicContact CE2-CG1 4.06Å; F748-V760 HydrophobicContact CG-CG1 3.7Å; F748-V760 HydrophobicContact CZ-CG1 3.83Å; F748-F761 HydrophobicContact CE2-CE1 4.44Å; F748-F761 HydrophobicContact CE2-CE2 4.35Å; F748-F761 AromaticContact CE2-CZ 3.92Å; F748-F761 HydrophobicContact CE2-CZ 3.92Å; F748-F761 HydrophobicContact CZ-CD1 4.39Å; F748-F761 AromaticContact CZ-CE1 3.87Å; F748-F761 HydrophobicContact CZ-CE1 3.87Å; F748-F761 HydrophobicContact CZ-CE2 4.18Å; F748-F761 AromaticContact CZ-CZ 3.74Å; F748-F761 HydrophobicContact CZ-CZ 3.74Å; F748-L767 HydrophobicContact CE1-CD1 3.98Å; F748-L767 HydrophobicContact CE1-CD2 4.26Å
749	L	89.7	Confident	85.2	Confident	67 Å²	67	60.3 Å²	60.3	35%	0.351	35%	0.352	S	S	.	.			trans	-69.1	140	174.1	-80.9	173.2	0	0	0	111	M417 Q751 Y752 V753	M417-L749 HydrophobicContact CB-CD1 4.2Å; M417-L749 HydrophobicContact CB-CD2 4Å; M417-L749 HydrophobicContact CB-CG 4.15Å; M417-L749 HydrophobicContact CG-CD2 4.08Å; M417-L749 HydrophobicContact CG-CG 4.4Å; M417-L749 HydrophobicContact SD-CD2 3.87Å; M417-L749 HydrophobicContact SD-CG 3.78Å; L749-Q751 PolarHBondContact O-N 3.02Å; L749-Y752 PolarHBondContact O-N 3.1Å; L749-V753 WeakPolarHBondContact O-CG2 3.18Å; L749-V753 PolarHBondContact O-N 2.81Å
750	R	87.7	Confident	86.6	Confident	122 Å²	122	56.6 Å²	56.6	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-50.9	-40.6	175.4	-69.2	177.5	173.5	167.4	-3.3	112	E411 D743 K754	E411-R750 IonicContact OE1-CZ 3.11Å; E411-R750 IonicContact OE1-NH1 3.36Å; E411-R750 PolarHBondContact OE1-NH1 3.42Å; E411-R750 IonicContact OE1-NH2 3.97Å; D743-R750 IonicContact OD2-CZ 3.01Å; D743-R750 IonicContact OD2-NE 3.91Å; D743-R750 PolarHBondContact OD2-NE 2.78Å; D743-R750 VanDerWaalsContact OD2-NE 3.11Å; D743-R750 IonicContact OD2-NH2 2.82Å; D743-R750 PolarHBondContact OD2-NH2 2.92Å; R750-K754 WeakPolarHBondContact O-CB 3.32Å; R750-K754 PolarHBondContact O-N 3.46Å
751	Q	87.3	Confident	87.8	Confident	142 Å²	142	51.5 Å²	51.5	66%	0.664	29%	0.29	S	S	*	.	H	α-helix	trans	-63.9	-46.8	176	-59.5	179.5	10.9	0	0	112.6	L749 V753 K754 G755	L749-Q751 PolarHBondContact O-N 3.02Å; Q751-V753 PolarHBondContact O-N 2.97Å; Q751-K754 PolarHBondContact O-N 2.97Å; Q751-G755 PolarHBondContact O-N 3.33Å
752	Y	89.3	Confident	88.3	Confident	58 Å²	58	54.3 Å²	54.3	23%	0.227	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-43.9	178.3	179	-86.7	0	0	0	111.6	F748 L749 K754 G755 H756 V760 L767	F748-Y752 HydrophobicContact CB-CD1 4.49Å; F748-Y752 AromaticContact CD1-CD1 3.66Å; F748-Y752 HydrophobicContact CD1-CD1 3.66Å; F748-Y752 AromaticContact CD1-CE1 3.65Å; F748-Y752 HydrophobicContact CD1-CE1 3.65Å; F748-Y752 HydrophobicContact CE1-CD1 4.43Å; F748-Y752 AromaticContact CE1-CE1 3.95Å; F748-Y752 HydrophobicContact CE1-CE1 3.95Å; L749-Y752 PolarHBondContact O-N 3.1Å; Y752-K754 VanDerWaalsContact C-N 3.31Å; Y752-K754 PolarHBondContact O-N 3.42Å; Y752-G755 PolarHBondContact O-N 2.88Å; Y752-H756 AromaticContact CD1-ND1 3.91Å; Y752-H756 AromaticContact CD2-CE1 3.61Å; Y752-H756 AromaticContact CD2-ND1 3.58Å; Y752-H756 HydrophobicContact CE1-CB 4.26Å; Y752-H756 AromaticContact CE1-ND1 3.74Å; Y752-H756 AromaticContact CE2-CE1 3.2Å; Y752-H756 WeakPolarHBondContact CE2-CE1 3.43Å; Y752-H756 AromaticContact CE2-ND1 3.39Å; Y752-H756 WeakPolarHBondContact CE2-ND1 3.42Å; Y752-H756 AromaticContact CE2-NE2 3.88Å; Y752-H756 AromaticContact CG-ND1 3.83Å; Y752-H756 AromaticContact CZ-CE1 3.61Å; Y752-H756 AromaticContact CZ-CG 3.81Å; Y752-H756 AromaticContact CZ-ND1 3.45Å; Y752-H756 PolarHBondContact O-N 2.81Å; Y752-H756 PolarHBondContact O-ND1 2.92Å; Y752-V760 HydrophobicContact CD1-CG1 4.36Å; Y752-V760 HydrophobicContact CE1-CG1 4Å; Y752-V760 WeakPolarHBondContact CE1-O 3.27Å; Y752-V760 PolarHBondContact OH-O 3.05Å; Y752-L767 HydrophobicContact CE2-CD2 4.36Å
753	V	89.1	Confident	88.6	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-35.5	176.7	176.9	0	0	0	0	111.5	P741 M744 F748 L749 Q751 H756 A757 V760	P741-V753 HydrophobicContact CB-CG1 3.79Å; P741-V753 HydrophobicContact CG-CG1 3.95Å; M744-V753 HydrophobicContact CB-CG2 4.15Å; M744-V753 HydrophobicContact CG-CG2 4.43Å; M744-V753 HydrophobicContact SD-CG2 4.44Å; F748-V753 HydrophobicContact CB-CG2 3.53Å; F748-V753 HydrophobicContact CG-CG2 4.46Å; L749-V753 WeakPolarHBondContact O-CG2 3.18Å; L749-V753 PolarHBondContact O-N 2.81Å; Q751-V753 PolarHBondContact O-N 2.97Å; V753-H756 CarbonylContact O-C 3.56Å; V753-H756 PolarHBondContact O-N 2.79Å; V753-A757 VanDerWaalsContact O-CA 3.27Å; V753-A757 WeakPolarHBondContact O-CA 3.45Å; V753-A757 PolarHBondContact O-N 3.34Å; V753-A757 VanDerWaalsContact O-N 3.09Å; V753-V760 HydrophobicContact CG1-CG2 4.33Å; V753-V760 HydrophobicContact CG2-CG1 4.42Å
754	K	85.9	Confident	88.8	Confident	168 Å²	168	51.7 Å²	51.7	73%	0.73	29%	0.286	S	S	*	.	H	α-helix	trans	-67.2	-38.3	174.5	-171.2	179.6	178.9	-176	0	112.4	R750 Q751 Y752	R750-K754 WeakPolarHBondContact O-CB 3.32Å; R750-K754 PolarHBondContact O-N 3.46Å; Q751-K754 PolarHBondContact O-N 2.97Å; Y752-K754 VanDerWaalsContact C-N 3.31Å; Y752-K754 PolarHBondContact O-N 3.42Å
755	G	84.8	Confident	88.8	Confident	64 Å²	64	52 Å²	52	66%	0.66	29%	0.289	S	S	*	.	H	α-helix	trans	-69.1	-38.2	174.4	0	0	0	0	0	113.3	Q751 Y752	Q751-G755 PolarHBondContact O-N 3.33Å; Y752-G755 PolarHBondContact O-N 2.88Å
756	H	86.6	Confident	88.8	Confident	50 Å²	50	53.6 Å²	53.6	23%	0.231	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	37.8	-176.7	-56.3	84.2	0	0	0	112.2	Y752 V753 A758 D759 V760 E762	Y752-H756 AromaticContact CD1-ND1 3.91Å; Y752-H756 AromaticContact CD2-CE1 3.61Å; Y752-H756 AromaticContact CD2-ND1 3.58Å; Y752-H756 HydrophobicContact CE1-CB 4.26Å; Y752-H756 AromaticContact CE1-ND1 3.74Å; Y752-H756 AromaticContact CE2-CE1 3.2Å; Y752-H756 WeakPolarHBondContact CE2-CE1 3.43Å; Y752-H756 AromaticContact CE2-ND1 3.39Å; Y752-H756 WeakPolarHBondContact CE2-ND1 3.42Å; Y752-H756 AromaticContact CE2-NE2 3.88Å; Y752-H756 AromaticContact CG-ND1 3.83Å; Y752-H756 AromaticContact CZ-CE1 3.61Å; Y752-H756 AromaticContact CZ-CG 3.81Å; Y752-H756 AromaticContact CZ-ND1 3.45Å; Y752-H756 PolarHBondContact O-N 2.81Å; Y752-H756 PolarHBondContact O-ND1 2.92Å; V753-H756 CarbonylContact O-C 3.56Å; V753-H756 PolarHBondContact O-N 2.79Å; H756-A758 PolarHBondContact O-N 3.18Å; H756-A758 VanDerWaalsContact O-N 3.11Å; H756-D759 CarbonylContact O-C 3.58Å; H756-D759 VanDerWaalsContact O-C 3.27Å; H756-D759 PolarHBondContact O-N 2.87Å; H756-V760 PolarHBondContact O-N 3.05Å; H756-E762 IonicContact CD2-OE2 3.89Å
757	A	80.3	Confident	88.9	Confident	35 Å²	35	51.9 Å²	51.9	29%	0.289	28%	0.279	S	S	.	.	S	Bend	trans	-62.5	-22.5	-171.1	0	0	0	0	0	114.3	P741 V753	P741-A757 HydrophobicContact CB-CB 4.28Å; P741-A757 HydrophobicContact CG-CB 4.03Å; V753-A757 VanDerWaalsContact O-CA 3.27Å; V753-A757 WeakPolarHBondContact O-CA 3.45Å; V753-A757 PolarHBondContact O-N 3.34Å; V753-A757 VanDerWaalsContact O-N 3.09Å
758	A	79.6	Confident	88.9	Confident	84 Å²	84	51.9 Å²	51.9	69%	0.694	28%	0.28	S	S	*	.	S	Bend	trans	-82.8	-36	174.2	0	0	0	0	0	113.1	H756	H756-A758 PolarHBondContact O-N 3.18Å; H756-A758 VanDerWaalsContact O-N 3.11Å
759	D	87.4	Confident	88.9	Confident	48 Å²	48	51.8 Å²	51.8	26%	0.257	28%	0.279	S	S	.	.			trans	-156.6	96.9	-178.2	-172.4	-3.5	0	0	0	112.2	R653 H756 F761 E762	R653-D759 IonicContact CZ-OD1 3.16Å; R653-D759 IonicContact CZ-OD2 2.91Å; R653-D759 VanDerWaalsContact CZ-OD2 3.27Å; R653-D759 IonicContact NH1-OD1 2.73Å; R653-D759 IonicContact NH1-OD2 3.99Å; R653-D759 PolarHBondContact NH1-OD2 3.3Å; R653-D759 VanDerWaalsContact NH2-CG 3.31Å; R653-D759 IonicContact NH2-OD1 3.34Å; R653-D759 PolarHBondContact NH2-OD1 3.36Å; R653-D759 IonicContact NH2-OD2 3.89Å; R653-D759 PolarHBondContact NH2-OD2 3.42Å; H756-D759 CarbonylContact O-C 3.58Å; H756-D759 VanDerWaalsContact O-C 3.27Å; H756-D759 PolarHBondContact O-N 2.87Å; D759-F761 PolarHBondContact O-N 3.09Å; D759-F761 VanDerWaalsContact O-N 3.07Å; D759-F761 PolarHBondContact OD1-N 2.85Å; D759-E762 HydrophobicContact CB-CB 4.29Å; D759-E762 VanDerWaalsContact O-CB 3.3Å; D759-E762 WeakPolarHBondContact O-CB 3.42Å; D759-E762 PolarHBondContact O-N 2.89Å; D759-E762 VanDerWaalsContact O-N 3.08Å; D759-E762 PolarHBondContact OD1-N 2.73Å
760	V	91.3	Very high	89	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.036	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.1	-178.6	-178.1	0	0	0	0	112.8	M744 F748 Y752 V753 H756	M744-V760 HydrophobicContact CE-CG2 3.97Å; M744-V760 HydrophobicContact SD-CB 4.36Å; M744-V760 HydrophobicContact SD-CG1 4.1Å; M744-V760 HydrophobicContact SD-CG2 3.93Å; F748-V760 HydrophobicContact CB-CG1 4.43Å; F748-V760 HydrophobicContact CD1-CG1 3.45Å; F748-V760 VanDerWaalsContact CD1-CG1 3.45Å; F748-V760 HydrophobicContact CD2-CG1 3.98Å; F748-V760 HydrophobicContact CE1-CG1 3.5Å; F748-V760 HydrophobicContact CE2-CG1 4.06Å; F748-V760 HydrophobicContact CG-CG1 3.7Å; F748-V760 HydrophobicContact CZ-CG1 3.83Å; Y752-V760 HydrophobicContact CD1-CG1 4.36Å; Y752-V760 HydrophobicContact CE1-CG1 4Å; Y752-V760 WeakPolarHBondContact CE1-O 3.27Å; Y752-V760 PolarHBondContact OH-O 3.05Å; V753-V760 HydrophobicContact CG1-CG2 4.33Å; V753-V760 HydrophobicContact CG2-CG1 4.42Å; H756-V760 PolarHBondContact O-N 3.05Å
761	F	92.9	Very high	89.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	15.1	177.3	-64.5	-98.9	0	0	0	112.8	V602 I605 R653 E658 L661 V662 F748 D759 A763 Y764	V602-F761 HydrophobicContact CG2-CD2 3.83Å; V602-F761 HydrophobicContact CG2-CE2 3.72Å; I605-F761 HydrophobicContact CD1-CE2 4.33Å; I605-F761 HydrophobicContact CD1-CZ 4.4Å; R653-F761 PolarHBondContact NH1-O 2.97Å; E658-F761 HydrophobicContact CB-CD1 3.96Å; E658-F761 HydrophobicContact CB-CE1 3.87Å; E658-F761 HydrophobicContact CB-CZ 4.37Å; E658-F761 HydrophobicContact CG-CB 4.3Å; E658-F761 HydrophobicContact CG-CD1 3.76Å; E658-F761 HydrophobicContact CG-CE1 4.21Å; E658-F761 HydrophobicContact CG-CG 4.02Å; L661-F761 HydrophobicContact CD2-CD1 4.05Å; L661-F761 HydrophobicContact CD2-CE1 4.01Å; V662-F761 HydrophobicContact CG2-CE1 4.29Å; V662-F761 HydrophobicContact CG2-CZ 3.82Å; F748-F761 HydrophobicContact CE2-CE1 4.44Å; F748-F761 HydrophobicContact CE2-CE2 4.35Å; F748-F761 AromaticContact CE2-CZ 3.92Å; F748-F761 HydrophobicContact CE2-CZ 3.92Å; F748-F761 HydrophobicContact CZ-CD1 4.39Å; F748-F761 AromaticContact CZ-CE1 3.87Å; F748-F761 HydrophobicContact CZ-CE1 3.87Å; F748-F761 HydrophobicContact CZ-CE2 4.18Å; F748-F761 AromaticContact CZ-CZ 3.74Å; F748-F761 HydrophobicContact CZ-CZ 3.74Å; D759-F761 PolarHBondContact O-N 3.09Å; D759-F761 VanDerWaalsContact O-N 3.07Å; D759-F761 PolarHBondContact OD1-N 2.85Å; F761-A763 VanDerWaalsContact C-N 3.27Å; F761-A763 PolarHBondContact O-N 3.24Å; F761-Y764 HydrophobicContact CD1-CD2 4.44Å; F761-Y764 WeakPolarHBondContact O-CB 3.31Å; F761-Y764 PolarHBondContact O-N 3.38Å
762	E	90.1	Very high	89.7	Confident	103 Å²	103	37.4 Å²	37.4	48%	0.481	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-48.1	173	-171.5	170.4	-163.8	0	0	110.6	K734 H756 D759 Y764	K734-E762 IonicContact NZ-OE1 2.94Å; K734-E762 PolarHBondContact NZ-OE1 3.49Å; K734-E762 IonicContact NZ-OE2 3.11Å; H756-E762 IonicContact CD2-OE2 3.89Å; D759-E762 HydrophobicContact CB-CB 4.29Å; D759-E762 VanDerWaalsContact O-CB 3.3Å; D759-E762 WeakPolarHBondContact O-CB 3.42Å; D759-E762 PolarHBondContact O-N 2.89Å; D759-E762 VanDerWaalsContact O-N 3.08Å; D759-E762 PolarHBondContact OD1-N 2.73Å; E762-Y764 VanDerWaalsContact C-N 3.32Å; E762-Y764 PolarHBondContact O-N 3.43Å
763	A	89.4	Confident	90	Very high	25 Å²	25	34.7 Å²	34.7	21%	0.207	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	34.9	178	0	0	0	0	0	114.7	F761 T765 Q766 L767	F761-A763 VanDerWaalsContact C-N 3.27Å; F761-A763 PolarHBondContact O-N 3.24Å; A763-T765 PolarHBondContact O-N 3.5Å; A763-T765 VanDerWaalsContact O-N 3.15Å; A763-Q766 HydrophobicContact CB-CB 4.38Å; A763-Q766 WeakPolarHBondContact O-CB 3.43Å; A763-Q766 PolarHBondContact O-N 3.43Å; A763-L767 WeakPolarHBondContact O-CG 3.44Å; A763-L767 PolarHBondContact O-N 2.9Å; A763-L767 VanDerWaalsContact O-N 3.1Å
764	Y	92.8	Very high	90.2	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.02	21%	0.21	C	C	.	.	H	α-helix	trans	-44.5	-51.7	-171.5	176.1	-98.5	0	0	0	114.4	K650 N651 R653 N657 E658 L661 F761 E762 Q766 L767 L768	K650-Y764 PolarHBondContact O-OH 3.4Å; K650-Y764 VanDerWaalsContact O-OH 3.13Å; N651-Y764 WeakPolarHBondContact O-CE1 3.44Å; R653-Y764 HydrophobicContact CB-CD1 3.99Å; R653-Y764 HydrophobicContact CB-CG 4.02Å; R653-Y764 HydrophobicContact CG-CD1 4.44Å; R653-Y764 HydrophobicContact CG-CD2 4.39Å; R653-Y764 HydrophobicContact CG-CG 3.99Å; N657-Y764 HydrophobicContact CB-CE2 4.35Å; N657-Y764 WeakPolarHBondContact CB-OH 3.09Å; N657-Y764 PolarHBondContact O-OH 2.73Å; E658-Y764 HydrophobicContact CG-CD2 4.47Å; L661-Y764 HydrophobicContact CB-CE2 4.14Å; L661-Y764 HydrophobicContact CD2-CD2 3.88Å; L661-Y764 HydrophobicContact CD2-CE2 3.78Å; F761-Y764 HydrophobicContact CD1-CD2 4.44Å; F761-Y764 WeakPolarHBondContact O-CB 3.31Å; F761-Y764 PolarHBondContact O-N 3.38Å; E762-Y764 VanDerWaalsContact C-N 3.32Å; E762-Y764 PolarHBondContact O-N 3.43Å; Y764-Q766 VanDerWaalsContact C-N 3.33Å; Y764-Q766 PolarHBondContact O-N 2.89Å; Y764-L767 PolarHBondContact O-N 2.96Å; Y764-L768 HydrophobicContact CE1-CB 4.38Å; Y764-L768 HydrophobicContact CE1-CD2 4.01Å; Y764-L768 PolarHBondContact O-N 2.99Å
765	T	90.9	Very high	90.6	Very high	16 Å²	16	28.4 Å²	28.4	10%	0.098	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-33.4	-175.7	-53.8	0	0	0	0	113	N651 L713 Y716 W717 A763 T769	N651-T765 WeakPolarHBondContact OD1-CG2 3.36Å; N651-T765 PolarHBondContact OD1-OG1 3.03Å; L713-T765 HydrophobicContact CD2-CG2 3.46Å; L713-T765 VanDerWaalsContact CD2-CG2 3.46Å; Y716-T765 HydrophobicContact CD1-CG2 3.7Å; Y716-T765 HydrophobicContact CE1-CG2 3.64Å; Y716-T765 HydrophobicContact CG-CG2 4.45Å; W717-T765 HydrophobicContact CZ2-CG2 4.01Å; A763-T765 PolarHBondContact O-N 3.5Å; A763-T765 VanDerWaalsContact O-N 3.15Å; T765-T769 WeakPolarHBondContact O-CB 3.47Å; T765-T769 PolarHBondContact O-N 2.89Å; T765-T769 PolarHBondContact O-OG1 3.26Å
766	Q	90.5	Very high	91.1	Very high	77 Å²	77	25.3 Å²	25.3	36%	0.36	14%	0.144	S	C	.	.	H	α-helix	trans	-69.1	-44.8	173	-178.6	-177.1	-9	0	0	111.3	W717 A763 Y764 L768 T769 E770 F813	W717-Q766 HydrophobicContact CH2-CB 4.35Å; W717-Q766 HydrophobicContact CZ2-CB 4.4Å; A763-Q766 HydrophobicContact CB-CB 4.38Å; A763-Q766 WeakPolarHBondContact O-CB 3.43Å; A763-Q766 PolarHBondContact O-N 3.43Å; Y764-Q766 VanDerWaalsContact C-N 3.33Å; Y764-Q766 PolarHBondContact O-N 2.89Å; Q766-L768 VanDerWaalsContact C-N 3.32Å; Q766-L768 PolarHBondContact O-N 2.7Å; Q766-T769 PolarHBondContact O-N 3.36Å; Q766-E770 PolarHBondContact O-N 3.34Å; Q766-F813 HydrophobicContact CG-CD1 4.34Å
767	L	93.1	Very high	91.4	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-40.2	177.7	-60.2	166.2	0	0	0	111.3	L661 F748 Y752 A763 Y764 E770 M771	L661-L767 HydrophobicContact CD2-CB 3.7Å; L661-L767 HydrophobicContact CD2-CD1 4.25Å; F748-L767 HydrophobicContact CE1-CD1 3.98Å; F748-L767 HydrophobicContact CE1-CD2 4.26Å; Y752-L767 HydrophobicContact CE2-CD2 4.36Å; A763-L767 WeakPolarHBondContact O-CG 3.44Å; A763-L767 PolarHBondContact O-N 2.9Å; A763-L767 VanDerWaalsContact O-N 3.1Å; Y764-L767 PolarHBondContact O-N 2.96Å; L767-E770 PolarHBondContact O-N 3.03Å; L767-M771 WeakPolarHBondContact O-CG 3.47Å; L767-M771 PolarHBondContact O-N 3.19Å; L767-M771 VanDerWaalsContact O-N 3.12Å
768	L	94.2	Very high	92.1	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-63.5	-47.3	173.5	-178.2	64.2	0	0	0	111.3	K650 L661 M664 V709 L713 Y764 Q766 E770 M771 V772	K650-L768 WeakPolarHBondContact O-CD2 3.38Å; L661-L768 HydrophobicContact CD1-CD1 4.44Å; M664-L768 HydrophobicContact CE-CD1 3.53Å; V709-L768 HydrophobicContact CG1-CD1 4.47Å; V709-L768 HydrophobicContact CG1-CD2 4.06Å; V709-L768 HydrophobicContact CG1-CG 4.26Å; L713-L768 HydrophobicContact CD1-CD2 4.35Å; L713-L768 HydrophobicContact CD1-CG 4.29Å; L713-L768 HydrophobicContact CD2-CD2 4.19Å; Y764-L768 HydrophobicContact CE1-CB 4.38Å; Y764-L768 HydrophobicContact CE1-CD2 4.01Å; Y764-L768 PolarHBondContact O-N 2.99Å; Q766-L768 VanDerWaalsContact C-N 3.32Å; Q766-L768 PolarHBondContact O-N 2.7Å; L768-E770 VanDerWaalsContact C-N 3.32Å; L768-E770 PolarHBondContact O-N 3.21Å; L768-M771 PolarHBondContact O-N 2.94Å; L768-M771 VanDerWaalsContact O-N 3.17Å; L768-V772 HydrophobicContact CD1-CG2 3.85Å; L768-V772 HydrophobicContact CG-CG2 4.18Å; L768-V772 WeakPolarHBondContact O-CB 3.19Å; L768-V772 WeakPolarHBondContact O-CG2 3.39Å; L768-V772 PolarHBondContact O-N 3.38Å
769	T	93.3	Very high	92.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.9	-42.1	178.1	-53.7	0	0	0	0	111.4	W717 T765 Q766 L773 Y805 V814	W717-T769 PolarHBondContact NE1-OG1 3.06Å; W717-T769 VanDerWaalsContact NE1-OG1 3.11Å; T765-T769 WeakPolarHBondContact O-CB 3.47Å; T765-T769 PolarHBondContact O-N 2.89Å; T765-T769 PolarHBondContact O-OG1 3.26Å; Q766-T769 PolarHBondContact O-N 3.36Å; T769-L773 HydrophobicContact CG2-CD1 4.1Å; T769-L773 WeakPolarHBondContact O-CD1 3.34Å; T769-L773 VanDerWaalsContact O-CG 3.31Å; T769-L773 WeakPolarHBondContact O-CG 3.24Å; T769-L773 PolarHBondContact O-N 3.21Å; T769-Y805 HydrophobicContact CG2-CE1 4.4Å; T769-V814 HydrophobicContact CG2-CB 4.49Å; T769-V814 HydrophobicContact CG2-CG1 3.67Å; T769-V814 HydrophobicContact CG2-CG2 3.97Å
770	E	93.2	Very high	92.9	Very high	28 Å²	28	18.8 Å²	18.8	13%	0.131	9%	0.091	C	C	.	.	H	α-helix	trans	-56.4	-54	172.8	-170.9	-141.7	149.9	0	0	111.2	R665 Q766 L767 L768 V772 L773 R774 F813	R665-E770 IonicContact CZ-OE2 3.66Å; R665-E770 IonicContact NH2-OE2 3.77Å; R665-E770 PolarHBondContact NH2-OE2 2.81Å; Q766-E770 PolarHBondContact O-N 3.34Å; L767-E770 PolarHBondContact O-N 3.03Å; L768-E770 VanDerWaalsContact C-N 3.32Å; L768-E770 PolarHBondContact O-N 3.21Å; E770-V772 VanDerWaalsContact C-N 3.35Å; E770-V772 PolarHBondContact O-N 3.27Å; E770-L773 PolarHBondContact O-N 3.41Å; E770-R774 WeakPolarHBondContact O-CB 3.23Å; E770-R774 PolarHBondContact O-N 3.3Å; E770-R774 WeakPolarHBondContact OE1-CD 3.43Å; E770-R774 IonicContact OE1-CZ 3.03Å; E770-R774 IonicContact OE1-NH1 2.89Å; E770-R774 PolarHBondContact OE1-NH1 2.95Å; E770-F813 HydrophobicContact CB-CE1 4.1Å; E770-F813 HydrophobicContact CG-CE1 3.98Å; E770-F813 HydrophobicContact CG-CZ 4.07Å
771	M	94.5	Very high	92.9	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-64	-39.4	-173.5	-71.6	-50.2	-53.5	0	0	113.1	L661 M664 R665 L767 L768 L773 R774 L775	L661-M771 HydrophobicContact CD1-CB 4.07Å; L661-M771 HydrophobicContact CD1-CG 3.61Å; M664-M771 HydrophobicContact CB-CE 4.34Å; M664-M771 WeakPolarHBondContact O-CE 3.16Å; R665-M771 HydrophobicContact CB-CE 4.39Å; R665-M771 HydrophobicContact CG-CE 3.64Å; R665-M771 HydrophobicContact CG-CG 3.89Å; R665-M771 HydrophobicContact CG-SD 3.34Å; R665-M771 WeakPolarHBondContact CG-SD 3.48Å; R665-M771 PolarHBondContact NE-SD 3.24Å; R665-M771 VanDerWaalsContact NE-SD 3.44Å; L767-M771 WeakPolarHBondContact O-CG 3.47Å; L767-M771 PolarHBondContact O-N 3.19Å; L767-M771 VanDerWaalsContact O-N 3.12Å; L768-M771 PolarHBondContact O-N 2.94Å; L768-M771 VanDerWaalsContact O-N 3.17Å; M771-L773 VanDerWaalsContact C-N 3.31Å; M771-L773 PolarHBondContact O-N 3.08Å; M771-R774 PolarHBondContact O-N 3.44Å; M771-R774 VanDerWaalsContact O-N 3.17Å; M771-L775 HydrophobicContact CE-CG 4.43Å; M771-L775 WeakPolarHBondContact O-CG 3.47Å; M771-L775 PolarHBondContact O-N 3.46Å
772	V	94.9	Very high	92.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-71.2	-26.8	-179.3	176.7	0	0	0	0	112	C706 V709 L710 L768 E770 P776	C706-V772 HydrophobicContact CB-CG1 3.68Å; C706-V772 WeakPolarHBondContact O-CG1 3.36Å; V709-V772 HydrophobicContact CB-CG1 4.02Å; V709-V772 HydrophobicContact CB-CG2 4.14Å; V709-V772 HydrophobicContact CG1-CG1 4.35Å; V709-V772 HydrophobicContact CG1-CG2 3.8Å; L710-V772 HydrophobicContact CD1-CG1 4.04Å; L710-V772 HydrophobicContact CD2-CG1 4.28Å; L710-V772 HydrophobicContact CG-CG1 3.65Å; L768-V772 HydrophobicContact CD1-CG2 3.85Å; L768-V772 HydrophobicContact CG-CG2 4.18Å; L768-V772 WeakPolarHBondContact O-CB 3.19Å; L768-V772 WeakPolarHBondContact O-CG2 3.39Å; L768-V772 PolarHBondContact O-N 3.38Å; E770-V772 VanDerWaalsContact C-N 3.35Å; E770-V772 PolarHBondContact O-N 3.27Å; V772-P776 WeakPolarHBondContact O-CD 3.33Å; V772-P776 WeakPolarHBondContact O-CG 3.4Å
773	L	94.6	Very high	92.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-82.8	-28.7	168.9	-64.9	165.9	0	0	0	112.7	L710 T769 E770 M771 L802 V814 Q817 V818 L821	L710-L773 HydrophobicContact CD1-CD2 3.82Å; L710-L773 HydrophobicContact CD2-CD2 3.94Å; L710-L773 HydrophobicContact CD2-CG 4.12Å; T769-L773 HydrophobicContact CG2-CD1 4.1Å; T769-L773 WeakPolarHBondContact O-CD1 3.34Å; T769-L773 VanDerWaalsContact O-CG 3.31Å; T769-L773 WeakPolarHBondContact O-CG 3.24Å; T769-L773 PolarHBondContact O-N 3.21Å; E770-L773 PolarHBondContact O-N 3.41Å; M771-L773 VanDerWaalsContact C-N 3.31Å; M771-L773 PolarHBondContact O-N 3.08Å; L773-L802 HydrophobicContact CD2-CD2 3.53Å; L773-V814 HydrophobicContact CD1-CG1 4.23Å; L773-Q817 HydrophobicContact CB-CG 3.69Å; L773-Q817 HydrophobicContact CD1-CB 4.24Å; L773-Q817 HydrophobicContact CD1-CG 4.02Å; L773-V818 HydrophobicContact CD1-CG2 3.49Å; L773-V818 VanDerWaalsContact CD1-CG2 3.49Å; L773-V818 HydrophobicContact CD2-CG2 3.92Å; L773-V818 HydrophobicContact CG-CG2 4.38Å; L773-L821 HydrophobicContact CB-CD2 4.4Å; L773-L821 HydrophobicContact CD2-CD2 3.82Å
774	R	94.1	Very high	92.5	Very high	40 Å²	40	22.4 Å²	22.4	15%	0.151	11%	0.105	C	C	.	.	H	α-helix	trans	-77.3	-40.8	-176.3	-178.6	176.7	177.4	138.1	6.2	113	S668 E770 M771 Y777 Q778	S668-R774 PolarHBondContact OG-NE 3.39Å; E770-R774 WeakPolarHBondContact O-CB 3.23Å; E770-R774 PolarHBondContact O-N 3.3Å; E770-R774 WeakPolarHBondContact OE1-CD 3.43Å; E770-R774 IonicContact OE1-CZ 3.03Å; E770-R774 IonicContact OE1-NH1 2.89Å; E770-R774 PolarHBondContact OE1-NH1 2.95Å; M771-R774 PolarHBondContact O-N 3.44Å; M771-R774 VanDerWaalsContact O-N 3.17Å; R774-Y777 WeakPolarHBondContact O-CB 3.45Å; R774-Y777 PolarHBondContact O-N 3.06Å; R774-Q778 WeakPolarHBondContact O-CG 3.24Å; R774-Q778 PolarHBondContact O-N 3.21Å
775	L	94.9	Very high	92.1	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-49.8	-179.4	-70.2	172.7	0	0	0	112.7	M664 M671 M771 Y777 Q778 I779	M664-L775 HydrophobicContact CB-CD1 4Å; M664-L775 HydrophobicContact CG-CD1 3.92Å; M664-L775 HydrophobicContact SD-CD1 4.21Å; M671-L775 HydrophobicContact CE-CD2 3.41Å; M671-L775 VanDerWaalsContact CE-CD2 3.41Å; M771-L775 HydrophobicContact CE-CG 4.43Å; M771-L775 WeakPolarHBondContact O-CG 3.47Å; M771-L775 PolarHBondContact O-N 3.46Å; L775-Y777 VanDerWaalsContact C-N 3.31Å; L775-Y777 PolarHBondContact O-N 3.1Å; L775-Q778 PolarHBondContact O-N 2.88Å; L775-I779 VanDerWaalsContact O-CG1 3.31Å; L775-I779 WeakPolarHBondContact O-CG1 3.31Å; L775-I779 PolarHBondContact O-N 2.9Å
776	P	94.3	Very high	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-33.2	176.7	-22.1	34.9	0	0	0	113.3	C706 V772 K780 F794 W798	C706-P776 HydrophobicContact CB-CG 3.74Å; V772-P776 WeakPolarHBondContact O-CD 3.33Å; V772-P776 WeakPolarHBondContact O-CG 3.4Å; P776-K780 PolarHBondContact O-N 3.01Å; P776-F794 HydrophobicContact CB-CE1 4.04Å; P776-F794 HydrophobicContact CB-CZ 4.16Å; P776-W798 HydrophobicContact CB-CH2 4.28Å; P776-W798 HydrophobicContact CB-CZ2 4.42Å; P776-W798 HydrophobicContact CG-CH2 3.81Å; P776-W798 HydrophobicContact CG-CZ2 4.08Å
777	Y	93.9	Very high	91.2	Very high	31 Å²	31	31.2 Å²	31.2	12%	0.122	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-46.2	173.3	178.3	-102.9	0	0	0	111.6	R774 L775 K781 K820 F824	R774-Y777 WeakPolarHBondContact O-CB 3.45Å; R774-Y777 PolarHBondContact O-N 3.06Å; L775-Y777 VanDerWaalsContact C-N 3.31Å; L775-Y777 PolarHBondContact O-N 3.1Å; Y777-K781 WeakPolarHBondContact O-CB 3.15Å; Y777-K781 PolarHBondContact O-N 3.08Å; Y777-K820 HydrophobicContact CE2-CG 4.12Å; Y777-K820 WeakPolarHBondContact OH-CE 3.31Å; Y777-F824 HydrophobicContact CD2-CB 4.21Å; Y777-F824 AromaticContact CD2-CD1 3.55Å; Y777-F824 HydrophobicContact CD2-CD1 3.55Å; Y777-F824 HydrophobicContact CD2-CE1 4.25Å; Y777-F824 HydrophobicContact CD2-CG 4.11Å; Y777-F824 HydrophobicContact CE2-CB 3.91Å; Y777-F824 AromaticContact CE2-CD1 3.46Å; Y777-F824 HydrophobicContact CE2-CD1 3.46Å; Y777-F824 VanDerWaalsContact CE2-CD1 3.46Å; Y777-F824 HydrophobicContact CE2-CD2 4.43Å; Y777-F824 HydrophobicContact CE2-CE1 4.07Å; Y777-F824 AromaticContact CE2-CG 3.68Å; Y777-F824 HydrophobicContact CE2-CG 3.68Å
778	Q	94.1	Very high	90.5	Very high	17 Å²	17	41.6 Å²	41.6	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-68.3	-44.4	178.9	-72	177.3	-65	0	0	112.5	S668 M671 S672 R774 L775 K780 K781 I782	S668-Q778 VanDerWaalsContact CB-OE1 3.32Å; S668-Q778 PolarHBondContact O-NE2 3.35Å; S668-Q778 VanDerWaalsContact OG-CD 3.28Å; S668-Q778 PolarHBondContact OG-NE2 2.86Å; S668-Q778 PolarHBondContact OG-OE1 3.32Å; M671-Q778 HydrophobicContact CB-CB 4.2Å; M671-Q778 HydrophobicContact CE-CB 3.92Å; M671-Q778 HydrophobicContact SD-CB 4.11Å; S672-Q778 PolarHBondContact OG-NE2 2.89Å; R774-Q778 WeakPolarHBondContact O-CG 3.24Å; R774-Q778 PolarHBondContact O-N 3.21Å; L775-Q778 PolarHBondContact O-N 2.88Å; Q778-K780 PolarHBondContact O-N 2.69Å; Q778-K781 PolarHBondContact O-N 2.94Å; Q778-I782 WeakPolarHBondContact O-CG1 3.49Å; Q778-I782 PolarHBondContact O-N 2.82Å
779	I	93	Very high	90	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.1	-53.4	175.6	-67.1	164.3	0	0	0	109.2	M671 L697 L698 A702 L775 K781 I782 T783 P792	M671-I779 HydrophobicContact CE-CG1 4.21Å; M671-I779 HydrophobicContact SD-CG1 3.79Å; L697-I779 HydrophobicContact CB-CD1 3.86Å; L697-I779 HydrophobicContact CB-CG1 4.39Å; L697-I779 HydrophobicContact CD1-CD1 4.25Å; L697-I779 HydrophobicContact CD1-CG1 4.41Å; L698-I779 HydrophobicContact CB-CG2 4.33Å; A702-I779 HydrophobicContact CB-CD1 4.1Å; L775-I779 VanDerWaalsContact O-CG1 3.31Å; L775-I779 WeakPolarHBondContact O-CG1 3.31Å; L775-I779 PolarHBondContact O-N 2.9Å; I779-K781 PolarHBondContact O-N 2.81Å; I779-I782 PolarHBondContact O-N 3.32Å; I779-T783 HydrophobicContact CG2-CG2 4.48Å; I779-T783 WeakPolarHBondContact O-CG2 3.4Å; I779-T783 PolarHBondContact O-N 3.25Å; I779-T783 PolarHBondContact O-OG1 3.42Å; I779-P792 HydrophobicContact CG2-CB 4.47Å; I779-P792 HydrophobicContact CG2-CG 4.48Å
780	K	91.3	Very high	89.6	Confident	32 Å²	32	46.5 Å²	46.5	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-44.1	177.7	-176.5	177.6	169.9	175.9	0	112.3	P776 Q778 I782 T783 D784 P792 F794 F824	P776-K780 PolarHBondContact O-N 3.01Å; Q778-K780 PolarHBondContact O-N 2.69Å; K780-I782 PolarHBondContact O-N 3.4Å; K780-T783 WeakPolarHBondContact CA-OG1 3.42Å; K780-T783 PolarHBondContact O-N 2.99Å; K780-T783 PolarHBondContact O-OG1 3.27Å; K780-D784 WeakPolarHBondContact CE-OD1 3.46Å; K780-D784 WeakPolarHBondContact CE-OD2 3.34Å; K780-D784 IonicContact NZ-OD2 2.89Å; K780-D784 WeakPolarHBondContact O-CB 3.32Å; K780-D784 VanDerWaalsContact O-CG 3.22Å; K780-D784 PolarHBondContact O-N 3.08Å; K780-P792 HydrophobicContact CB-CG 3.88Å; K780-P792 HydrophobicContact CG-CG 4.19Å; K780-F794 HydrophobicContact CB-CE2 4.24Å; K780-F794 HydrophobicContact CB-CZ 4.48Å; K780-F794 HydrophobicContact CD-CE2 4.08Å; K780-F824 HydrophobicContact CB-CD1 4.41Å; K780-F824 HydrophobicContact CB-CE1 3.84Å; K780-F824 HydrophobicContact CD-CD1 3.93Å; K780-F824 HydrophobicContact CD-CE1 3.75Å; K780-F824 HydrophobicContact CD-CZ 4.37Å; K780-F824 HydrophobicContact CG-CD1 4.23Å; K780-F824 HydrophobicContact CG-CE1 3.59Å; K780-F824 HydrophobicContact CG-CZ 4.19Å; K780-F824 PolarHBondContact NZ-O 3.41Å
781	K	91.3	Very high	89.2	Confident	96 Å²	96	49.9 Å²	49.9	42%	0.417	26%	0.262	S	S	.	.	H	α-helix	trans	-57.7	-38.6	178.9	-172.9	-171.8	175.3	-167.1	0	111.6	Y777 Q778 I779 T785 F824	Y777-K781 WeakPolarHBondContact O-CB 3.15Å; Y777-K781 PolarHBondContact O-N 3.08Å; Q778-K781 PolarHBondContact O-N 2.94Å; I779-K781 PolarHBondContact O-N 2.81Å; K781-T785 PolarHBondContact O-N 2.85Å; K781-T785 PolarHBondContact O-OG1 2.69Å; K781-F824 HydrophobicContact CB-CE1 4.23Å; K781-F824 HydrophobicContact CB-CZ 4.33Å
782	I	89.8	Confident	88.8	Confident	13 Å²	13	50.6 Å²	50.6	7%	0.067	27%	0.267	C	S	.	.	H	α-helix	trans	-74.4	-43.5	179.2	-66.4	161.5	0	0	0	111	M671 S690 A694 Q778 I779 K780 D784 T785 N786 I789	M671-I782 HydrophobicContact CB-CD1 3.65Å; M671-I782 HydrophobicContact CG-CD1 3.66Å; M671-I782 HydrophobicContact SD-CD1 3.97Å; S690-I782 VanDerWaalsContact OG-CD1 3.27Å; S690-I782 WeakPolarHBondContact OG-CD1 3.4Å; A694-I782 HydrophobicContact CB-CB 3.98Å; A694-I782 HydrophobicContact CB-CD1 3.9Å; A694-I782 HydrophobicContact CB-CG2 3.69Å; Q778-I782 WeakPolarHBondContact O-CG1 3.49Å; Q778-I782 PolarHBondContact O-N 2.82Å; I779-I782 PolarHBondContact O-N 3.32Å; K780-I782 PolarHBondContact O-N 3.4Å; I782-D784 PolarHBondContact O-N 3.04Å; I782-T785 CarbonylContact O-C 3.56Å; I782-T785 PolarHBondContact O-N 3.16Å; I782-T785 VanDerWaalsContact O-N 3.09Å; I782-N786 WeakPolarHBondContact O-CB 3.37Å; I782-N786 PolarHBondContact O-N 3.25Å; I782-I789 HydrophobicContact CG2-CD1 4.11Å
783	T	88.4	Confident	88.5	Confident	9 Å²	9	56.4 Å²	56.4	6%	0.055	30%	0.302	C	S	.	.	H	α-helix	trans	-65.8	-37.7	177.6	58.8	0	0	0	0	113	L698 I779 K780 T785 N786 I789 P792	L698-T783 HydrophobicContact CD2-CG2 4.38Å; I779-T783 HydrophobicContact CG2-CG2 4.48Å; I779-T783 WeakPolarHBondContact O-CG2 3.4Å; I779-T783 PolarHBondContact O-N 3.25Å; I779-T783 PolarHBondContact O-OG1 3.42Å; K780-T783 WeakPolarHBondContact CA-OG1 3.42Å; K780-T783 PolarHBondContact O-N 2.99Å; K780-T783 PolarHBondContact O-OG1 3.27Å; T783-T785 PolarHBondContact O-N 3.07Å; T783-N786 CarbonylContact O-C 3.42Å; T783-N786 PolarHBondContact O-N 3.36Å; T783-I789 HydrophobicContact CG2-CB 3.94Å; T783-I789 HydrophobicContact CG2-CG2 3.6Å; T783-P792 WeakPolarHBondContact OG1-CD 3.47Å
784	D	85.3	Confident	88.3	Confident	91 Å²	91	57.8 Å²	57.8	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-65.2	-21.1	174.8	-69.9	2.7	0	0	0	111.9	K780 I782 F824	K780-D784 WeakPolarHBondContact CE-OD1 3.46Å; K780-D784 WeakPolarHBondContact CE-OD2 3.34Å; K780-D784 IonicContact NZ-OD2 2.89Å; K780-D784 WeakPolarHBondContact O-CB 3.32Å; K780-D784 VanDerWaalsContact O-CG 3.22Å; K780-D784 PolarHBondContact O-N 3.08Å; I782-D784 PolarHBondContact O-N 3.04Å; D784-F824 WeakPolarHBondContact OD2-CZ 3.46Å
785	T	85.6	Confident	88	Confident	120 Å²	120	58.8 Å²	58.8	74%	0.736	32%	0.317	S	S	*	.	H	α-helix	trans	-95.4	-28.3	176.9	-50.8	0	0	0	0	112.7	K781 I782 T783	K781-T785 PolarHBondContact O-N 2.85Å; K781-T785 PolarHBondContact O-OG1 2.69Å; I782-T785 CarbonylContact O-C 3.56Å; I782-T785 PolarHBondContact O-N 3.16Å; I782-T785 VanDerWaalsContact O-N 3.09Å; T783-T785 PolarHBondContact O-N 3.07Å
786	N	83.2	Confident	87.7	Confident	40 Å²	40	65 Å²	65	21%	0.214	35%	0.345	C	S	.	.			trans	-126.3	94.7	-173.6	-175.3	-7.5	0	0	0	111.4	S691 I782 T783 R788 I789	S691-N786 PolarHBondContact OG-ND2 2.95Å; S691-N786 VanDerWaalsContact OG-ND2 3.13Å; I782-N786 WeakPolarHBondContact O-CB 3.37Å; I782-N786 PolarHBondContact O-N 3.25Å; T783-N786 CarbonylContact O-C 3.42Å; T783-N786 PolarHBondContact O-N 3.36Å; N786-R788 PolarHBondContact O-N 3.47Å; N786-R788 WeakPolarHBondContact OD1-CB 3.43Å; N786-R788 PolarHBondContact OD1-N 3.05Å; N786-I789 PolarHBondContact O-N 2.62Å; N786-I789 VanDerWaalsContact O-N 3.17Å
787	S	77.3	Confident	87.5	Confident	123 Å²	123	66.7 Å²	66.7	86%	0.86	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-1	-177.6	57	0	0	0	0	115.9	I789	S787-I789 VanDerWaalsContact C-N 3.33Å
788	R	80.1	Confident	87.5	Confident	229 Å²	229	65.2 Å²	65.2	86%	0.864	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-20.2	171	-60.4	-174	-177.6	-172.7	3	112.9	N786	N786-R788 PolarHBondContact O-N 3.47Å; N786-R788 WeakPolarHBondContact OD1-CB 3.43Å; N786-R788 PolarHBondContact OD1-N 3.05Å
789	I	83.3	Confident	87.4	Confident	16 Å²	16	65.7 Å²	65.7	8%	0.082	35%	0.353	C	S	.	.	S	Bend	trans	-97.7	133.3	-179.3	-50.2	174.4	0	0	0	108.1	S691 A694 A695 L698 I782 T783 N786 S787	S691-I789 WeakPolarHBondContact O-CD1 3.41Å; A694-I789 HydrophobicContact CB-CD1 4.38Å; A695-I789 HydrophobicContact CB-CD1 4.29Å; A695-I789 HydrophobicContact CB-CG1 4.34Å; A695-I789 HydrophobicContact CB-CG2 4.2Å; L698-I789 HydrophobicContact CD2-CG2 4.2Å; I782-I789 HydrophobicContact CG2-CD1 4.11Å; T783-I789 HydrophobicContact CG2-CB 3.94Å; T783-I789 HydrophobicContact CG2-CG2 3.6Å; N786-I789 PolarHBondContact O-N 2.62Å; N786-I789 VanDerWaalsContact O-N 3.17Å; S787-I789 VanDerWaalsContact C-N 3.33Å
790	P	84.7	Confident	87.3	Confident	89 Å²	89	69.9 Å²	69.9	58%	0.578	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-60.7	146.2	176.4	25.3	-34.4	0	0	0	111.1	L698	L698-P790 HydrophobicContact CD2-CG 4.19Å; L698-P790 WeakPolarHBondContact CD2-O 3.33Å
791	P	84.1	Confident	87.3	Confident	99 Å²	99	70.2 Å²	70.2	64%	0.643	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-70.1	138.8	-179.8	28.3	-34.4	0	0	0	111.3	V793	P791-V793 PolarHBondContact O-N 2.99Å
792	P	87.7	Confident	87.4	Confident	15 Å²	15	65.7 Å²	65.7	10%	0.097	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-66.2	131.4	176.1	26.2	-33.9	0	0	0	111.4	L698 V703 I779 K780 T783 F794	L698-P792 HydrophobicContact CD1-CB 3.98Å; V703-P792 HydrophobicContact CG2-CB 4.07Å; I779-P792 HydrophobicContact CG2-CB 4.47Å; I779-P792 HydrophobicContact CG2-CG 4.48Å; K780-P792 HydrophobicContact CB-CG 3.88Å; K780-P792 HydrophobicContact CG-CG 4.19Å; T783-P792 WeakPolarHBondContact OG1-CD 3.47Å; P792-F794 HydrophobicContact CB-CE2 3.89Å; P792-F794 HydrophobicContact CB-CZ 4.32Å; P792-F794 HydrophobicContact CG-CE2 3.76Å; P792-F794 HydrophobicContact CG-CZ 4.4Å
793	V	87.2	Confident	87.4	Confident	123 Å²	123	65.3 Å²	65.3	75%	0.745	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-83.9	123.5	176.7	-178.3	0	0	0	0	109.4	P791	P791-V793 PolarHBondContact O-N 2.99Å
794	F	90.8	Very high	87.5	Confident	29 Å²	29	65.8 Å²	65.8	13%	0.127	35%	0.351	C	S	.	.			trans	-111.6	114.1	171.3	-66.3	-83.3	0	0	0	108.8	V703 P776 K780 P792 W798 I825	V703-F794 HydrophobicContact CG1-CD1 4.12Å; V703-F794 HydrophobicContact CG1-CE1 3.88Å; V703-F794 HydrophobicContact CG1-CZ 4.49Å; P776-F794 HydrophobicContact CB-CE1 4.04Å; P776-F794 HydrophobicContact CB-CZ 4.16Å; K780-F794 HydrophobicContact CB-CE2 4.24Å; K780-F794 HydrophobicContact CB-CZ 4.48Å; K780-F794 HydrophobicContact CD-CE2 4.08Å; P792-F794 HydrophobicContact CB-CE2 3.89Å; P792-F794 HydrophobicContact CB-CZ 4.32Å; P792-F794 HydrophobicContact CG-CE2 3.76Å; P792-F794 HydrophobicContact CG-CZ 4.4Å; F794-W798 HydrophobicContact CB-CB 4.33Å; F794-W798 HydrophobicContact CB-CG 4.41Å; F794-W798 HydrophobicContact CD1-CB 4.31Å; F794-W798 AromaticContact CD1-CD1 3.75Å; F794-W798 AromaticContact CD1-CD2 3.81Å; F794-W798 HydrophobicContact CD1-CD2 3.81Å; F794-W798 AromaticContact CD1-CE2 3.87Å; F794-W798 AromaticContact CD1-CG 3.7Å; F794-W798 HydrophobicContact CD1-CG 3.7Å; F794-W798 AromaticContact CD1-NE1 3.81Å; F794-W798 HydrophobicContact CE1-CD2 4.24Å; F794-W798 HydrophobicContact CE1-CZ2 4.35Å; F794-I825 HydrophobicContact CB-CG2 3.66Å; F794-I825 HydrophobicContact CD1-CD1 3.5Å; F794-I825 VanDerWaalsContact CD1-CD1 3.5Å; F794-I825 HydrophobicContact CD1-CG1 4.08Å; F794-I825 HydrophobicContact CD1-CG2 4.41Å; F794-I825 HydrophobicContact CD2-CD1 4.36Å; F794-I825 HydrophobicContact CD2-CG1 4.02Å; F794-I825 HydrophobicContact CD2-CG2 3.85Å; F794-I825 HydrophobicContact CE1-CD1 3.58Å; F794-I825 HydrophobicContact CE1-CG1 4.06Å; F794-I825 HydrophobicContact CE2-CD1 4.41Å; F794-I825 HydrophobicContact CE2-CG1 3.99Å; F794-I825 HydrophobicContact CG-CD1 3.91Å; F794-I825 HydrophobicContact CG-CG1 4.06Å; F794-I825 HydrophobicContact CG-CG2 3.72Å; F794-I825 HydrophobicContact CZ-CD1 4.05Å; F794-I825 HydrophobicContact CZ-CG1 4.02Å
795	D	87.9	Confident	87.7	Confident	62 Å²	62	61.4 Å²	61.4	33%	0.332	33%	0.328	S	S	.	.			trans	-82.3	-176.5	-175.7	86.7	-49.8	0	0	0	112.7	S797 W798 F799	D795-S797 VanDerWaalsContact C-N 3.3Å; D795-S797 PolarHBondContact O-N 2.81Å; D795-S797 VanDerWaalsContact OD1-CB 3.3Å; D795-S797 WeakPolarHBondContact OD1-CB 3.4Å; D795-S797 PolarHBondContact OD1-N 3.12Å; D795-S797 WeakPolarHBondContact OD2-CB 3.19Å; D795-S797 PolarHBondContact OD2-N 3.05Å; D795-S797 PolarHBondContact OD2-OG 3.28Å; D795-W798 PolarHBondContact O-N 2.98Å; D795-W798 PolarHBondContact OD1-N 3.21Å; D795-F799 WeakPolarHBondContact O-CD2 3.43Å; D795-F799 WeakPolarHBondContact O-CE2 3.21Å
796	H	87.6	Confident	87.9	Confident	131 Å²	131	56.8 Å²	56.8	61%	0.606	30%	0.299	S	S	*	.	H	α-helix	trans	-66.5	-30.8	176.8	-161.8	43.2	0	0	0	113.2	W798 F799 Y800	H796-W798 VanDerWaalsContact C-N 3.32Å; H796-W798 PolarHBondContact O-N 2.96Å; H796-F799 PolarHBondContact O-N 3.16Å; H796-Y800 PolarHBondContact O-N 3.32Å
797	S	91.3	Very high	88	Confident	35 Å²	35	57.8 Å²	57.8	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-58	-43.9	175.3	-48.9	0	0	0	0	111.4	D795 F799 Y800 F801	D795-S797 VanDerWaalsContact C-N 3.3Å; D795-S797 PolarHBondContact O-N 2.81Å; D795-S797 VanDerWaalsContact OD1-CB 3.3Å; D795-S797 WeakPolarHBondContact OD1-CB 3.4Å; D795-S797 PolarHBondContact OD1-N 3.12Å; D795-S797 WeakPolarHBondContact OD2-CB 3.19Å; D795-S797 PolarHBondContact OD2-N 3.05Å; D795-S797 PolarHBondContact OD2-OG 3.28Å; S797-F799 VanDerWaalsContact C-N 3.34Å; S797-F799 PolarHBondContact O-N 2.85Å; S797-Y800 PolarHBondContact O-N 2.94Å; S797-F801 VanDerWaalsContact O-CD2 3.24Å; S797-F801 WeakPolarHBondContact O-CD2 3.07Å; S797-F801 PolarHBondContact O-N 3.12Å
798	W	93.6	Very high	88.3	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-55.4	-46.3	176.6	-92.9	106.2	0	0	0	113	V703 C706 L707 L710 P776 F794 D795 H796 L802 L821	V703-W798 HydrophobicContact CG1-CZ2 4.01Å; V703-W798 VanDerWaalsContact O-CZ2 3.3Å; V703-W798 WeakPolarHBondContact O-CZ2 3.24Å; C706-W798 HydrophobicContact CB-CH2 4.2Å; C706-W798 HydrophobicContact CB-CZ2 4.24Å; L707-W798 HydrophobicContact CB-CD2 4.41Å; L707-W798 HydrophobicContact CB-CZ2 3.8Å; L707-W798 HydrophobicContact CD1-CD2 3.9Å; L707-W798 HydrophobicContact CD1-CE3 4.25Å; L707-W798 HydrophobicContact CD1-CG 4.06Å; L707-W798 HydrophobicContact CD2-CG 4.46Å; L710-W798 HydrophobicContact CD1-CH2 3.67Å; L710-W798 HydrophobicContact CD1-CZ3 3.48Å; L710-W798 VanDerWaalsContact CD1-CZ3 3.48Å; P776-W798 HydrophobicContact CB-CH2 4.28Å; P776-W798 HydrophobicContact CB-CZ2 4.42Å; P776-W798 HydrophobicContact CG-CH2 3.81Å; P776-W798 HydrophobicContact CG-CZ2 4.08Å; F794-W798 HydrophobicContact CB-CB 4.33Å; F794-W798 HydrophobicContact CB-CG 4.41Å; F794-W798 HydrophobicContact CD1-CB 4.31Å; F794-W798 AromaticContact CD1-CD1 3.75Å; F794-W798 AromaticContact CD1-CD2 3.81Å; F794-W798 HydrophobicContact CD1-CD2 3.81Å; F794-W798 AromaticContact CD1-CE2 3.87Å; F794-W798 AromaticContact CD1-CG 3.7Å; F794-W798 HydrophobicContact CD1-CG 3.7Å; F794-W798 AromaticContact CD1-NE1 3.81Å; F794-W798 HydrophobicContact CE1-CD2 4.24Å; F794-W798 HydrophobicContact CE1-CZ2 4.35Å; D795-W798 PolarHBondContact O-N 2.98Å; D795-W798 PolarHBondContact OD1-N 3.21Å; H796-W798 VanDerWaalsContact C-N 3.32Å; H796-W798 PolarHBondContact O-N 2.96Å; W798-L802 HydrophobicContact CE3-CD1 3.75Å; W798-L802 HydrophobicContact CE3-CD2 4.34Å; W798-L802 HydrophobicContact CE3-CG 3.93Å; W798-L802 HydrophobicContact CZ3-CD1 4.26Å; W798-L802 HydrophobicContact CZ3-CD2 4.2Å; W798-L802 HydrophobicContact CZ3-CG 4.3Å; W798-L802 VanDerWaalsContact O-CB 3.27Å; W798-L802 WeakPolarHBondContact O-CB 3.32Å; W798-L802 WeakPolarHBondContact O-CG 3.13Å; W798-L802 PolarHBondContact O-N 3.35Å; W798-L821 HydrophobicContact CZ3-CD2 3.9Å
799	F	91.4	Very high	88	Confident	27 Å²	27	48 Å²	48	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-68	-35.4	178.2	-59.4	-76.3	0	0	0	112.4	D795 H796 S797 S803 L822 I825 L835	D795-F799 WeakPolarHBondContact O-CD2 3.43Å; D795-F799 WeakPolarHBondContact O-CE2 3.21Å; H796-F799 PolarHBondContact O-N 3.16Å; S797-F799 VanDerWaalsContact C-N 3.34Å; S797-F799 PolarHBondContact O-N 2.85Å; F799-S803 WeakPolarHBondContact O-CB 3.35Å; F799-S803 PolarHBondContact O-N 2.87Å; F799-S803 PolarHBondContact O-OG 2.72Å; F799-L822 HydrophobicContact CD1-CD1 3.72Å; F799-L822 HydrophobicContact CE1-CD1 4.44Å; F799-I825 HydrophobicContact CE1-CB 4.37Å; F799-I825 HydrophobicContact CE1-CG2 3.56Å; F799-I825 HydrophobicContact CZ-CG2 3.53Å; F799-L835 HydrophobicContact CB-CD1 4.46Å; F799-L835 HydrophobicContact CD1-CD1 3.6Å; F799-L835 HydrophobicContact CE1-CD1 4.06Å; F799-L835 HydrophobicContact CG-CD1 4.1Å
800	Y	91.1	Very high	87.3	Confident	88 Å²	88	50.5 Å²	50.5	35%	0.345	27%	0.265	S	S	.	.	H	α-helix	trans	-64.9	-61.2	174.3	176.1	-99.7	0	0	0	111.4	H796 S797 L802 S803 E804 H839	H796-Y800 PolarHBondContact O-N 3.32Å; S797-Y800 PolarHBondContact O-N 2.94Å; Y800-L802 VanDerWaalsContact C-N 3.34Å; Y800-L802 PolarHBondContact O-N 2.8Å; Y800-S803 WeakPolarHBondContact O-CA 3.44Å; Y800-S803 WeakPolarHBondContact O-CB 3.23Å; Y800-S803 PolarHBondContact O-N 2.97Å; Y800-E804 HydrophobicContact CD1-CG 4.27Å; Y800-E804 HydrophobicContact CE1-CG 3.76Å; Y800-E804 HydrophobicContact CE2-CG 4.18Å; Y800-E804 PolarHBondContact O-N 3.08Å; Y800-E804 PolarHBondContact OH-OE1 3.37Å; Y800-H839 AromaticContact CD2-CD2 3.69Å; Y800-H839 AromaticContact CD2-NE2 3.23Å; Y800-H839 WeakPolarHBondContact CD2-NE2 3.13Å; Y800-H839 AromaticContact CE2-NE2 3.32Å; Y800-H839 VanDerWaalsContact CE2-NE2 3.32Å; Y800-H839 WeakPolarHBondContact CE2-NE2 3.37Å; Y800-H839 PolarHBondContact O-NE2 3.07Å
801	F	92	Very high	86.8	Confident	39 Å²	39	46.9 Å²	46.9	17%	0.171	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-38.6	-176	-75	-74	0	0	0	112.4	L707 K711 L714 S797 S803 E804 Y805	L707-F801 HydrophobicContact CD1-CB 4.41Å; L707-F801 HydrophobicContact CD1-CD2 4.14Å; K711-F801 HydrophobicContact CB-CE1 4.34Å; K711-F801 HydrophobicContact CD-CD2 4.38Å; K711-F801 HydrophobicContact CD-CE1 4.43Å; K711-F801 HydrophobicContact CD-CE2 3.79Å; K711-F801 HydrophobicContact CD-CZ 3.83Å; K711-F801 VanDerWaalsContact CE-CE2 3.43Å; K711-F801 HydrophobicContact CG-CD1 4.04Å; K711-F801 HydrophobicContact CG-CD2 4.01Å; K711-F801 HydrophobicContact CG-CE1 3.78Å; K711-F801 HydrophobicContact CG-CE2 3.78Å; K711-F801 HydrophobicContact CG-CG 4.17Å; K711-F801 HydrophobicContact CG-CZ 3.67Å; L714-F801 HydrophobicContact CD2-CD1 3.69Å; L714-F801 HydrophobicContact CD2-CE1 4.03Å; S797-F801 VanDerWaalsContact O-CD2 3.24Å; S797-F801 WeakPolarHBondContact O-CD2 3.07Å; S797-F801 PolarHBondContact O-N 3.12Å; F801-S803 VanDerWaalsContact C-N 3.27Å; F801-S803 PolarHBondContact O-N 2.88Å; F801-E804 WeakPolarHBondContact O-CB 3.45Å; F801-E804 PolarHBondContact O-N 2.98Å; F801-Y805 VanDerWaalsContact O-CD2 3.23Å; F801-Y805 WeakPolarHBondContact O-CD2 3.36Å; F801-Y805 PolarHBondContact O-N 2.98Å; F801-Y805 VanDerWaalsContact O-N 3.08Å
802	L	92.6	Very high	86.6	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-31	173.4	-69.3	173.7	0	0	0	112.7	L773 W798 Y800 L806 V818 L821 L822 I825	L773-L802 HydrophobicContact CD2-CD2 3.53Å; W798-L802 HydrophobicContact CE3-CD1 3.75Å; W798-L802 HydrophobicContact CE3-CD2 4.34Å; W798-L802 HydrophobicContact CE3-CG 3.93Å; W798-L802 HydrophobicContact CZ3-CD1 4.26Å; W798-L802 HydrophobicContact CZ3-CD2 4.2Å; W798-L802 HydrophobicContact CZ3-CG 4.3Å; W798-L802 VanDerWaalsContact O-CB 3.27Å; W798-L802 WeakPolarHBondContact O-CB 3.32Å; W798-L802 WeakPolarHBondContact O-CG 3.13Å; W798-L802 PolarHBondContact O-N 3.35Å; Y800-L802 VanDerWaalsContact C-N 3.34Å; Y800-L802 PolarHBondContact O-N 2.8Å; L802-L806 WeakPolarHBondContact O-CG 3.16Å; L802-L806 PolarHBondContact O-N 3.46Å; L802-V818 HydrophobicContact CB-CG1 4.13Å; L802-V818 HydrophobicContact CD2-CG1 3.99Å; L802-V818 HydrophobicContact CD2-CG2 4.43Å; L802-V818 WeakPolarHBondContact O-CG1 3.31Å; L802-L821 HydrophobicContact CD1-CD2 4.04Å; L802-L821 HydrophobicContact CD1-CG 4.07Å; L802-L821 HydrophobicContact CD2-CD2 3.95Å; L802-L822 HydrophobicContact CB-CB 4.36Å; L802-L822 HydrophobicContact CB-CD1 3.99Å; L802-L822 HydrophobicContact CB-CD2 4.33Å; L802-L822 HydrophobicContact CB-CG 4.45Å; L802-L822 HydrophobicContact CD1-CB 4.19Å; L802-L822 HydrophobicContact CD1-CD1 3.97Å; L802-I825 HydrophobicContact CD1-CD1 3.9Å
803	S	90.9	Very high	86.3	Confident	5 Å²	5	50.4 Å²	50.4	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-77.1	-36.4	176.6	-57.3	0	0	0	0	112.2	F799 Y800 F801 Y805 L806 H839	F799-S803 WeakPolarHBondContact O-CB 3.35Å; F799-S803 PolarHBondContact O-N 2.87Å; F799-S803 PolarHBondContact O-OG 2.72Å; Y800-S803 WeakPolarHBondContact O-CA 3.44Å; Y800-S803 WeakPolarHBondContact O-CB 3.23Å; Y800-S803 PolarHBondContact O-N 2.97Å; F801-S803 VanDerWaalsContact C-N 3.27Å; F801-S803 PolarHBondContact O-N 2.88Å; S803-Y805 VanDerWaalsContact C-N 3.33Å; S803-Y805 PolarHBondContact O-N 3.34Å; S803-L806 WeakPolarHBondContact O-CB 3.49Å; S803-L806 PolarHBondContact O-N 3.47Å; S803-H839 WeakPolarHBondContact CB-CD2 3.46Å
804	E	90.4	Very high	86.2	Confident	18 Å²	18	44.8 Å²	44.8	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-53.5	-48	167.1	-73.3	-79.8	130.4	0	0	111.4	L714 K718 Y800 F801 L806 M807 H839	L714-E804 HydrophobicContact CD1-CB 4.28Å; L714-E804 HydrophobicContact CD2-CB 3.7Å; L714-E804 HydrophobicContact CD2-CG 4.07Å; K718-E804 VanDerWaalsContact CE-OE2 3.28Å; K718-E804 WeakPolarHBondContact CE-OE2 3.3Å; K718-E804 IonicContact NZ-OE2 2.6Å; K718-E804 PolarHBondContact NZ-OE2 3.48Å; Y800-E804 HydrophobicContact CD1-CG 4.27Å; Y800-E804 HydrophobicContact CE1-CG 3.76Å; Y800-E804 HydrophobicContact CE2-CG 4.18Å; Y800-E804 PolarHBondContact O-N 3.08Å; Y800-E804 PolarHBondContact OH-OE1 3.37Å; F801-E804 WeakPolarHBondContact O-CB 3.45Å; F801-E804 PolarHBondContact O-N 2.98Å; E804-L806 PolarHBondContact O-N 3.21Å; E804-M807 WeakPolarHBondContact O-CB 3.47Å; E804-M807 PolarHBondContact O-N 3.23Å; E804-H839 IonicContact OE1-CE1 3.85Å; E804-H839 PolarHBondContact OE1-CE1 3.2Å; E804-H839 IonicContact OE1-NE2 2.85Å
805	Y	89.9	Confident	86.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-20.9	176.6	-87.8	-78.2	0	0	0	114.5	L710 L713 L714 W717 T769 F801 S803 M807 I808 V814 V818	L710-Y805 HydrophobicContact CB-CE2 4.08Å; L710-Y805 HydrophobicContact CD2-CD2 4.4Å; L710-Y805 HydrophobicContact CD2-CE2 3.72Å; L710-Y805 HydrophobicContact CG-CE2 4.47Å; L710-Y805 WeakPolarHBondContact O-CE2 3.45Å; L710-Y805 PolarHBondContact O-OH 2.99Å; L713-Y805 VanDerWaalsContact C-OH 3.27Å; L713-Y805 WeakPolarHBondContact CB-OH 3.22Å; L714-Y805 WeakPolarHBondContact CA-OH 3.19Å; L714-Y805 HydrophobicContact CB-CE2 4.01Å; L714-Y805 HydrophobicContact CD1-CD1 4.47Å; L714-Y805 HydrophobicContact CD1-CD2 4.34Å; L714-Y805 HydrophobicContact CD1-CE1 4.39Å; L714-Y805 HydrophobicContact CD1-CE2 4.2Å; L714-Y805 HydrophobicContact CD1-CG 4.44Å; L714-Y805 PolarHBondContact N-OH 3.37Å; W717-Y805 AromaticContact CD1-CE1 3.69Å; W717-Y805 HydrophobicContact CG-CE1 4.43Å; T769-Y805 HydrophobicContact CG2-CE1 4.4Å; F801-Y805 VanDerWaalsContact O-CD2 3.23Å; F801-Y805 WeakPolarHBondContact O-CD2 3.36Å; F801-Y805 PolarHBondContact O-N 2.98Å; F801-Y805 VanDerWaalsContact O-N 3.08Å; S803-Y805 VanDerWaalsContact C-N 3.33Å; S803-Y805 PolarHBondContact O-N 3.34Å; Y805-M807 VanDerWaalsContact C-N 3.3Å; Y805-I808 HydrophobicContact CD1-CD1 3.77Å; Y805-I808 HydrophobicContact CE1-CD1 4.21Å; Y805-I808 HydrophobicContact CG-CD1 4.45Å; Y805-V814 HydrophobicContact CD1-CG1 3.98Å; Y805-V814 HydrophobicContact CE1-CG1 4.44Å; Y805-V818 HydrophobicContact CG-CG2 4.4Å
806	L	88.9	Confident	86.1	Confident	23 Å²	23	52.5 Å²	52.5	12%	0.12	24%	0.243	C	C	.	.	H	α-helix	trans	-75.9	-18.8	173.9	-68	-178	0	0	0	113.2	L802 S803 E804 V818 R819 L822 Y832 R836	L802-L806 WeakPolarHBondContact O-CG 3.16Å; L802-L806 PolarHBondContact O-N 3.46Å; S803-L806 WeakPolarHBondContact O-CB 3.49Å; S803-L806 PolarHBondContact O-N 3.47Å; E804-L806 PolarHBondContact O-N 3.21Å; L806-V818 HydrophobicContact CD2-CB 4.1Å; L806-V818 HydrophobicContact CD2-CG1 3.61Å; L806-V818 HydrophobicContact CG-CG1 3.86Å; L806-R819 HydrophobicContact CD2-CB 4.48Å; L806-R819 HydrophobicContact CD2-CG 3.48Å; L806-R819 VanDerWaalsContact CD2-CG 3.48Å; L806-L822 HydrophobicContact CD1-CD2 3.9Å; L806-Y832 HydrophobicContact CD1-CE2 4.49Å; L806-R836 HydrophobicContact CD1-CG 4.43Å
807	M	85.3	Confident	86.2	Confident	61 Å²	61	47.5 Å²	47.5	30%	0.3	22%	0.22	S	C	.	.	H	α-helix	trans	-85.3	-16.5	-178.2	-56	-96.8	49.8	0	0	112.7	E804 Y805 Q809 T840	E804-M807 WeakPolarHBondContact O-CB 3.47Å; E804-M807 PolarHBondContact O-N 3.23Å; Y805-M807 VanDerWaalsContact C-N 3.3Å; M807-Q809 PolarHBondContact O-N 3.26Å; M807-T840 HydrophobicContact CE-CG2 3.84Å; M807-T840 HydrophobicContact SD-CG2 4.02Å
808	I	83.7	Confident	86.3	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.015	21%	0.208	C	C	.	.			trans	-74.9	111.5	-178.5	-48.2	179	0	0	0	110.1	L714 W717 Y805 T811 R815	L714-I808 HydrophobicContact CD1-CD1 3.67Å; W717-I808 HydrophobicContact CB-CD1 3.74Å; Y805-I808 HydrophobicContact CD1-CD1 3.77Å; Y805-I808 HydrophobicContact CE1-CD1 4.21Å; Y805-I808 HydrophobicContact CG-CD1 4.45Å; I808-T811 HydrophobicContact CG2-CG2 4.36Å; I808-R815 WeakPolarHBondContact O-CD 3.23Å; I808-R815 PolarHBondContact O-NE 2.86Å
809	Q	74	Confident	86.2	Confident	144 Å²	144	50.5 Å²	50.5	67%	0.673	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-46.1	-171.5	-64.3	-174.5	-0.9	0	0	112.7	M807 T811 R815	M807-Q809 PolarHBondContact O-N 3.26Å; Q809-T811 PolarHBondContact O-N 2.9Å; Q809-R815 PolarHBondContact O-NE 3.45Å; Q809-R815 PolarHBondContact O-NH2 3.43Å
810	Q	68.3	Low	86.2	Confident	68 Å²	68	52.5 Å²	52.5	32%	0.318	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-5.2	-171.7	-68.2	160.7	-17.8	0	0	116.2	E724 P812	E724-Q810 PolarHBondContact OE2-NE2 3.39Å; Q810-P812 VanDerWaalsContact C-CD 3.47Å; Q810-P812 WeakPolarHBondContact O-CD 3.07Å
811	T	75.1	Confident	86.2	Confident	12 Å²	12	48.3 Å²	48.3	7%	0.074	22%	0.218	C	C	.	.			trans	-118.7	64	-170.6	58.6	0	0	0	0	115.2	W717 I808 Q809 F813 V814 R815	W717-T811 HydrophobicContact CD2-CG2 4.13Å; W717-T811 HydrophobicContact CE3-CG2 3.51Å; W717-T811 HydrophobicContact CH2-CG2 4.25Å; W717-T811 HydrophobicContact CZ3-CG2 3.58Å; I808-T811 HydrophobicContact CG2-CG2 4.36Å; Q809-T811 PolarHBondContact O-N 2.9Å; T811-F813 VanDerWaalsContact C-N 3.33Å; T811-F813 PolarHBondContact O-N 2.95Å; T811-V814 PolarHBondContact O-N 3.34Å; T811-V814 VanDerWaalsContact O-N 3.15Å; T811-R815 PolarHBondContact O-N 3.11Å
812	P	79.3	Confident	86.2	Confident	84 Å²	84	46.4 Å²	46.4	55%	0.545	21%	0.21	S	C	.	.	H	α-helix	trans	-58.4	-36.9	-174.3	23.4	-33.8	0	0	0	114.4	Q810 R815 R816	Q810-P812 VanDerWaalsContact C-CD 3.47Å; Q810-P812 WeakPolarHBondContact O-CD 3.07Å; P812-R815 PolarHBondContact O-N 3.16Å; P812-R816 PolarHBondContact O-N 3.03Å
813	F	81.1	Confident	86.2	Confident	104 Å²	104	49.6 Å²	49.6	46%	0.456	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-46.4	176.4	178.3	-97.7	0	0	0	112.3	Q766 E770 T811 R816 Q817	Q766-F813 HydrophobicContact CG-CD1 4.34Å; E770-F813 HydrophobicContact CB-CE1 4.1Å; E770-F813 HydrophobicContact CG-CE1 3.98Å; E770-F813 HydrophobicContact CG-CZ 4.07Å; T811-F813 VanDerWaalsContact C-N 3.33Å; T811-F813 PolarHBondContact O-N 2.95Å; F813-R816 PolarHBondContact O-N 3.36Å; F813-Q817 PolarHBondContact O-N 3.34Å
814	V	85.5	Confident	86.2	Confident	6 Å²	6	52.1 Å²	52.1	4%	0.036	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-48.2	176.1	178.8	0	0	0	0	109.5	T769 L773 Y805 T811 R816 Q817 V818	T769-V814 HydrophobicContact CG2-CB 4.49Å; T769-V814 HydrophobicContact CG2-CG1 3.67Å; T769-V814 HydrophobicContact CG2-CG2 3.97Å; L773-V814 HydrophobicContact CD1-CG1 4.23Å; Y805-V814 HydrophobicContact CD1-CG1 3.98Å; Y805-V814 HydrophobicContact CE1-CG1 4.44Å; T811-V814 PolarHBondContact O-N 3.34Å; T811-V814 VanDerWaalsContact O-N 3.15Å; V814-R816 VanDerWaalsContact C-N 3.27Å; V814-R816 PolarHBondContact O-N 3.38Å; V814-Q817 PolarHBondContact O-N 2.94Å; V814-Q817 VanDerWaalsContact O-N 3.07Å; V814-V818 HydrophobicContact CG1-CG2 3.91Å; V814-V818 WeakPolarHBondContact O-CB 3.37Å; V814-V818 VanDerWaalsContact O-CG2 3.27Å; V814-V818 WeakPolarHBondContact O-CG2 3.35Å; V814-V818 PolarHBondContact O-N 3.38Å
815	R	87.6	Confident	86.2	Confident	59 Å²	59	52.1 Å²	52.1	22%	0.223	24%	0.237	C	C	.	.	H	α-helix	trans	-53	-41.1	175	-73.4	-170.2	-80.6	121.1	-2.1	112.2	I808 Q809 T811 P812 R819	I808-R815 WeakPolarHBondContact O-CD 3.23Å; I808-R815 PolarHBondContact O-NE 2.86Å; Q809-R815 PolarHBondContact O-NE 3.45Å; Q809-R815 PolarHBondContact O-NH2 3.43Å; T811-R815 PolarHBondContact O-N 3.11Å; P812-R815 PolarHBondContact O-N 3.16Å; R815-R819 WeakPolarHBondContact O-CB 3.48Å; R815-R819 WeakPolarHBondContact O-CG 3.42Å; R815-R819 PolarHBondContact O-N 2.9Å
816	R	89.3	Confident	86.2	Confident	194 Å²	194	52.6 Å²	52.6	73%	0.732	24%	0.24	S	C	*	.	H	α-helix	trans	-61.9	-45.1	176.6	-168.6	175.9	-174.2	170.2	1.7	112.5	P812 F813 V814 K820	P812-R816 PolarHBondContact O-N 3.03Å; F813-R816 PolarHBondContact O-N 3.36Å; V814-R816 VanDerWaalsContact C-N 3.27Å; V814-R816 PolarHBondContact O-N 3.38Å; R816-K820 PolarHBondContact O-N 2.97Å
817	Q	89.9	Confident	86	Confident	25 Å²	25	54.6 Å²	54.6	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-38	179.8	-175.4	61.5	10.1	0	0	112.3	L773 F813 V814 K820 L821	L773-Q817 HydrophobicContact CB-CG 3.69Å; L773-Q817 HydrophobicContact CD1-CB 4.24Å; L773-Q817 HydrophobicContact CD1-CG 4.02Å; F813-Q817 PolarHBondContact O-N 3.34Å; V814-Q817 PolarHBondContact O-N 2.94Å; V814-Q817 VanDerWaalsContact O-N 3.07Å; Q817-K820 PolarHBondContact O-N 2.86Å; Q817-L821 PolarHBondContact O-N 3.2Å
818	V	92.5	Very high	86.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-46.4	174.7	172.5	0	0	0	0	111.3	L773 L802 Y805 L806 V814 K820 L821 L822	L773-V818 HydrophobicContact CD1-CG2 3.49Å; L773-V818 VanDerWaalsContact CD1-CG2 3.49Å; L773-V818 HydrophobicContact CD2-CG2 3.92Å; L773-V818 HydrophobicContact CG-CG2 4.38Å; L802-V818 HydrophobicContact CB-CG1 4.13Å; L802-V818 HydrophobicContact CD2-CG1 3.99Å; L802-V818 HydrophobicContact CD2-CG2 4.43Å; L802-V818 WeakPolarHBondContact O-CG1 3.31Å; Y805-V818 HydrophobicContact CG-CG2 4.4Å; L806-V818 HydrophobicContact CD2-CB 4.1Å; L806-V818 HydrophobicContact CD2-CG1 3.61Å; L806-V818 HydrophobicContact CG-CG1 3.86Å; V814-V818 HydrophobicContact CG1-CG2 3.91Å; V814-V818 WeakPolarHBondContact O-CB 3.37Å; V814-V818 VanDerWaalsContact O-CG2 3.27Å; V814-V818 WeakPolarHBondContact O-CG2 3.35Å; V814-V818 PolarHBondContact O-N 3.38Å; V818-K820 VanDerWaalsContact C-N 3.28Å; V818-K820 PolarHBondContact O-N 3.36Å; V818-L821 PolarHBondContact O-N 3.41Å; V818-L822 VanDerWaalsContact O-CB 3.3Å; V818-L822 WeakPolarHBondContact O-CB 3.33Å; V818-L822 PolarHBondContact O-N 3.49Å
819	R	90.6	Very high	86.4	Confident	100 Å²	100	60.7 Å²	60.7	38%	0.377	30%	0.298	S	S	.	.	H	α-helix	trans	-54.4	-45.1	173.2	-73.7	174.3	-176.6	-177.1	-1.1	111.1	L806 R815 L823	L806-R819 HydrophobicContact CD2-CB 4.48Å; L806-R819 HydrophobicContact CD2-CG 3.48Å; L806-R819 VanDerWaalsContact CD2-CG 3.48Å; R815-R819 WeakPolarHBondContact O-CB 3.48Å; R815-R819 WeakPolarHBondContact O-CG 3.42Å; R815-R819 PolarHBondContact O-N 2.9Å; R819-L823 VanDerWaalsContact O-CB 3.22Å; R819-L823 WeakPolarHBondContact O-CB 3.44Å; R819-L823 PolarHBondContact O-N 3.36Å
820	K	91.4	Very high	87	Confident	68 Å²	68	58.1 Å²	58.1	30%	0.296	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-46.1	179.9	-175.6	161	-175.3	154.1	0	112.7	L419 Y777 R816 Q817 V818 F824	L419-K820 HydrophobicContact CD1-CD 4.17Å; Y777-K820 HydrophobicContact CE2-CG 4.12Å; Y777-K820 WeakPolarHBondContact OH-CE 3.31Å; R816-K820 PolarHBondContact O-N 2.97Å; Q817-K820 PolarHBondContact O-N 2.86Å; V818-K820 VanDerWaalsContact C-N 3.28Å; V818-K820 PolarHBondContact O-N 3.36Å; K820-F824 VanDerWaalsContact O-CB 3.28Å; K820-F824 WeakPolarHBondContact O-CB 3.27Å; K820-F824 PolarHBondContact O-N 3.3Å; K820-F824 VanDerWaalsContact O-N 3.15Å
821	L	92.6	Very high	87.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-49.3	177.5	177.6	61.4	0	0	0	111.3	L773 W798 L802 Q817 V818 L823 F824 I825	L773-L821 HydrophobicContact CB-CD2 4.4Å; L773-L821 HydrophobicContact CD2-CD2 3.82Å; W798-L821 HydrophobicContact CZ3-CD2 3.9Å; L802-L821 HydrophobicContact CD1-CD2 4.04Å; L802-L821 HydrophobicContact CD1-CG 4.07Å; L802-L821 HydrophobicContact CD2-CD2 3.95Å; Q817-L821 PolarHBondContact O-N 3.2Å; V818-L821 PolarHBondContact O-N 3.41Å; L821-L823 PolarHBondContact O-N 2.79Å; L821-F824 PolarHBondContact O-N 2.95Å; L821-I825 HydrophobicContact CD1-CD1 3.69Å; L821-I825 HydrophobicContact CD1-CG1 3.95Å; L821-I825 HydrophobicContact CD2-CD1 4.42Å; L821-I825 HydrophobicContact CG-CD1 3.72Å; L821-I825 HydrophobicContact CG-CG1 4.37Å; L821-I825 WeakPolarHBondContact O-CG1 3.41Å; L821-I825 PolarHBondContact O-N 3.32Å
822	L	92.4	Very high	88.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-46.9	-177.5	-173.4	59.8	0	0	0	111.6	F799 L802 L806 V818 F824 I825 C826 Y832	F799-L822 HydrophobicContact CD1-CD1 3.72Å; F799-L822 HydrophobicContact CE1-CD1 4.44Å; L802-L822 HydrophobicContact CB-CB 4.36Å; L802-L822 HydrophobicContact CB-CD1 3.99Å; L802-L822 HydrophobicContact CB-CD2 4.33Å; L802-L822 HydrophobicContact CB-CG 4.45Å; L802-L822 HydrophobicContact CD1-CB 4.19Å; L802-L822 HydrophobicContact CD1-CD1 3.97Å; L806-L822 HydrophobicContact CD1-CD2 3.9Å; V818-L822 VanDerWaalsContact O-CB 3.3Å; V818-L822 WeakPolarHBondContact O-CB 3.33Å; V818-L822 PolarHBondContact O-N 3.49Å; L822-F824 VanDerWaalsContact C-N 3.32Å; L822-F824 PolarHBondContact O-N 2.83Å; L822-I825 PolarHBondContact O-N 3.27Å; L822-C826 WeakPolarHBondContact O-CB 3.45Å; L822-C826 PolarHBondContact O-N 2.88Å; L822-C826 PolarHBondContact O-SG 3.31Å; L822-Y832 HydrophobicContact CB-CD2 4.24Å; L822-Y832 HydrophobicContact CB-CE2 4.26Å; L822-Y832 HydrophobicContact CD2-CD2 4.1Å; L822-Y832 HydrophobicContact CD2-CE2 3.98Å; L822-Y832 HydrophobicContact CG-CD2 3.92Å; L822-Y832 HydrophobicContact CG-CE2 4.18Å
823	L	91.3	Very high	89.2	Confident	67 Å²	67	61.1 Å²	61.1	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-58.8	-42.8	175.6	178.5	61.5	0	0	0	112	R819 L821 C826 G827 K829 Y832	R819-L823 VanDerWaalsContact O-CB 3.22Å; R819-L823 WeakPolarHBondContact O-CB 3.44Å; R819-L823 PolarHBondContact O-N 3.36Å; L821-L823 PolarHBondContact O-N 2.79Å; L823-C826 PolarHBondContact O-N 3.46Å; L823-G827 PolarHBondContact O-N 3.17Å; L823-G827 VanDerWaalsContact O-N 3.16Å; L823-K829 HydrophobicContact CD1-CG 4.21Å; L823-Y832 HydrophobicContact CB-CD2 3.96Å; L823-Y832 HydrophobicContact CB-CE2 4.44Å; L823-Y832 HydrophobicContact CB-CG 4.26Å; L823-Y832 HydrophobicContact CD1-CD1 4.29Å; L823-Y832 HydrophobicContact CD1-CD2 4.46Å; L823-Y832 HydrophobicContact CD1-CG 3.89Å
824	F	90.8	Very high	89.7	Confident	59 Å²	59	58.8 Å²	58.8	26%	0.259	28%	0.276	S	S	.	.	H	α-helix	trans	-70.4	-36.9	-179.6	-172.6	-121.4	0	0	0	112.9	Y777 K780 K781 D784 K820 L821 L822	Y777-F824 HydrophobicContact CD2-CB 4.21Å; Y777-F824 AromaticContact CD2-CD1 3.55Å; Y777-F824 HydrophobicContact CD2-CD1 3.55Å; Y777-F824 HydrophobicContact CD2-CE1 4.25Å; Y777-F824 HydrophobicContact CD2-CG 4.11Å; Y777-F824 HydrophobicContact CE2-CB 3.91Å; Y777-F824 AromaticContact CE2-CD1 3.46Å; Y777-F824 HydrophobicContact CE2-CD1 3.46Å; Y777-F824 VanDerWaalsContact CE2-CD1 3.46Å; Y777-F824 HydrophobicContact CE2-CD2 4.43Å; Y777-F824 HydrophobicContact CE2-CE1 4.07Å; Y777-F824 AromaticContact CE2-CG 3.68Å; Y777-F824 HydrophobicContact CE2-CG 3.68Å; K780-F824 HydrophobicContact CB-CD1 4.41Å; K780-F824 HydrophobicContact CB-CE1 3.84Å; K780-F824 HydrophobicContact CD-CD1 3.93Å; K780-F824 HydrophobicContact CD-CE1 3.75Å; K780-F824 HydrophobicContact CD-CZ 4.37Å; K780-F824 HydrophobicContact CG-CD1 4.23Å; K780-F824 HydrophobicContact CG-CE1 3.59Å; K780-F824 HydrophobicContact CG-CZ 4.19Å; K780-F824 PolarHBondContact NZ-O 3.41Å; K781-F824 HydrophobicContact CB-CE1 4.23Å; K781-F824 HydrophobicContact CB-CZ 4.33Å; D784-F824 WeakPolarHBondContact OD2-CZ 3.46Å; K820-F824 VanDerWaalsContact O-CB 3.28Å; K820-F824 WeakPolarHBondContact O-CB 3.27Å; K820-F824 PolarHBondContact O-N 3.3Å; K820-F824 VanDerWaalsContact O-N 3.15Å; L821-F824 PolarHBondContact O-N 2.95Å; L822-F824 VanDerWaalsContact C-N 3.32Å; L822-F824 PolarHBondContact O-N 2.83Å
825	I	91.3	Very high	89.8	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-46	171.2	-64.2	166.4	0	0	0	110.2	F794 F799 L802 L821 L822 G827	F794-I825 HydrophobicContact CB-CG2 3.66Å; F794-I825 HydrophobicContact CD1-CD1 3.5Å; F794-I825 VanDerWaalsContact CD1-CD1 3.5Å; F794-I825 HydrophobicContact CD1-CG1 4.08Å; F794-I825 HydrophobicContact CD1-CG2 4.41Å; F794-I825 HydrophobicContact CD2-CD1 4.36Å; F794-I825 HydrophobicContact CD2-CG1 4.02Å; F794-I825 HydrophobicContact CD2-CG2 3.85Å; F794-I825 HydrophobicContact CE1-CD1 3.58Å; F794-I825 HydrophobicContact CE1-CG1 4.06Å; F794-I825 HydrophobicContact CE2-CD1 4.41Å; F794-I825 HydrophobicContact CE2-CG1 3.99Å; F794-I825 HydrophobicContact CG-CD1 3.91Å; F794-I825 HydrophobicContact CG-CG1 4.06Å; F794-I825 HydrophobicContact CG-CG2 3.72Å; F794-I825 HydrophobicContact CZ-CD1 4.05Å; F794-I825 HydrophobicContact CZ-CG1 4.02Å; F799-I825 HydrophobicContact CE1-CB 4.37Å; F799-I825 HydrophobicContact CE1-CG2 3.56Å; F799-I825 HydrophobicContact CZ-CG2 3.53Å; L802-I825 HydrophobicContact CD1-CD1 3.9Å; L821-I825 HydrophobicContact CD1-CD1 3.69Å; L821-I825 HydrophobicContact CD1-CG1 3.95Å; L821-I825 HydrophobicContact CD2-CD1 4.42Å; L821-I825 HydrophobicContact CG-CD1 3.72Å; L821-I825 HydrophobicContact CG-CG1 4.37Å; L821-I825 WeakPolarHBondContact O-CG1 3.41Å; L821-I825 PolarHBondContact O-N 3.32Å; L822-I825 PolarHBondContact O-N 3.27Å; I825-G827 VanDerWaalsContact C-N 3.28Å; I825-G827 PolarHBondContact O-N 3.04Å
826	C	88.5	Confident	89.9	Confident	10 Å²	10	59.7 Å²	59.7	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-30	-177.6	-73.2	0	0	0	0	114.4	L822 L823 S828 K831	L822-C826 WeakPolarHBondContact O-CB 3.45Å; L822-C826 PolarHBondContact O-N 2.88Å; L822-C826 PolarHBondContact O-SG 3.31Å; L823-C826 PolarHBondContact O-N 3.46Å; C826-S828 PolarHBondContact O-N 3.32Å; C826-S828 VanDerWaalsContact O-N 3.12Å; C826-K831 HydrophobicContact CB-CB 4.4Å; C826-K831 HydrophobicContact CB-CG 4.44Å
827	G	85.8	Confident	90	Very high	66 Å²	66	50.5 Å²	50.5	68%	0.68	25%	0.247	S	C	*	.			trans	74.9	-10.9	177.7	0	0	0	0	0	115.6	L823 I825	L823-G827 PolarHBondContact O-N 3.17Å; L823-G827 VanDerWaalsContact O-N 3.16Å; I825-G827 VanDerWaalsContact C-N 3.28Å; I825-G827 PolarHBondContact O-N 3.04Å
828	S	87.8	Confident	90.1	Very high	55 Å²	55	50.6 Å²	50.6	39%	0.385	25%	0.248	S	C	.	.	S	Bend	trans	-144	145.4	170.7	76.1	0	0	0	0	112.2	C826 E830 K831 Y832	C826-S828 PolarHBondContact O-N 3.32Å; C826-S828 VanDerWaalsContact O-N 3.12Å; S828-E830 PolarHBondContact O-N 3.07Å; S828-K831 PolarHBondContact O-N 3.47Å; S828-K831 WeakPolarHBondContact OG-CB 3.35Å; S828-K831 PolarHBondContact OG-N 3.3Å; S828-K831 VanDerWaalsContact OG-N 3.11Å; S828-Y832 PolarHBondContact O-N 2.97Å; S828-Y832 VanDerWaalsContact O-N 3.11Å
829	K	89.1	Confident	90	Very high	136 Å²	136	51.4 Å²	51.4	59%	0.591	25%	0.252	S	S	*	.	H	α-helix	trans	-54.8	-35.7	174.9	-68.1	-177.9	179.5	178.9	0	111.2	L823 R833	L823-K829 HydrophobicContact CD1-CG 4.21Å; K829-R833 VanDerWaalsContact O-CG 3.32Å; K829-R833 WeakPolarHBondContact O-CG 3.25Å; K829-R833 PolarHBondContact O-N 3.01Å
830	E	87.8	Confident	90	Very high	90 Å²	90	47.5 Å²	47.5	42%	0.421	24%	0.239	S	C	.	.	H	α-helix	trans	-76.1	-40.7	-177.8	-165.9	56.1	-155.1	0	0	113.7	S828 Y832 R833 Q834	S828-E830 PolarHBondContact O-N 3.07Å; E830-Y832 VanDerWaalsContact C-N 3.29Å; E830-Y832 PolarHBondContact O-N 3.27Å; E830-R833 PolarHBondContact O-N 2.82Å; E830-R833 VanDerWaalsContact OE2-CD 3.3Å; E830-R833 WeakPolarHBondContact OE2-CD 3.39Å; E830-R833 IonicContact OE2-NH1 3.05Å; E830-R833 PolarHBondContact OE2-NH1 2.85Å; E830-R833 VanDerWaalsContact OE2-NH1 3.12Å; E830-Q834 WeakPolarHBondContact O-CB 3.41Å; E830-Q834 PolarHBondContact O-N 2.87Å
831	K	87.2	Confident	90	Very high	106 Å²	106	44.3 Å²	44.3	46%	0.461	23%	0.225	S	C	.	.	H	α-helix	trans	-66.9	-34.5	174.4	-173.8	174.2	177.4	-176.3	0	111.5	C826 S828 L835	C826-K831 HydrophobicContact CB-CB 4.4Å; C826-K831 HydrophobicContact CB-CG 4.44Å; S828-K831 PolarHBondContact O-N 3.47Å; S828-K831 WeakPolarHBondContact OG-CB 3.35Å; S828-K831 PolarHBondContact OG-N 3.3Å; S828-K831 VanDerWaalsContact OG-N 3.11Å; K831-L835 HydrophobicContact CG-CD1 4.09Å; K831-L835 WeakPolarHBondContact O-CB 3.35Å; K831-L835 WeakPolarHBondContact O-CG 3.43Å; K831-L835 PolarHBondContact O-N 3.17Å
832	Y	91.6	Very high	89.9	Confident	29 Å²	29	45.7 Å²	45.7	11%	0.114	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-51.6	170	164.3	-92	0	0	0	111.8	L806 L822 L823 S828 E830 Q834 L835 R836	L806-Y832 HydrophobicContact CD1-CE2 4.49Å; L822-Y832 HydrophobicContact CB-CD2 4.24Å; L822-Y832 HydrophobicContact CB-CE2 4.26Å; L822-Y832 HydrophobicContact CD2-CD2 4.1Å; L822-Y832 HydrophobicContact CD2-CE2 3.98Å; L822-Y832 HydrophobicContact CG-CD2 3.92Å; L822-Y832 HydrophobicContact CG-CE2 4.18Å; L823-Y832 HydrophobicContact CB-CD2 3.96Å; L823-Y832 HydrophobicContact CB-CE2 4.44Å; L823-Y832 HydrophobicContact CB-CG 4.26Å; L823-Y832 HydrophobicContact CD1-CD1 4.29Å; L823-Y832 HydrophobicContact CD1-CD2 4.46Å; L823-Y832 HydrophobicContact CD1-CG 3.89Å; S828-Y832 PolarHBondContact O-N 2.97Å; S828-Y832 VanDerWaalsContact O-N 3.11Å; E830-Y832 VanDerWaalsContact C-N 3.29Å; E830-Y832 PolarHBondContact O-N 3.27Å; Y832-Q834 PolarHBondContact O-N 2.91Å; Y832-L835 PolarHBondContact O-N 2.92Å; Y832-R836 WeakPolarHBondContact O-CB 3.47Å; Y832-R836 PolarHBondContact O-N 3.13Å
833	R	90.1	Very high	89.8	Confident	92 Å²	92	47.7 Å²	47.7	35%	0.347	25%	0.247	S	C	.	.	H	α-helix	trans	-54.8	-50.7	175.5	-78.1	165.9	171	175.2	-7.5	111.1	K829 E830 L835 R836 D837	K829-R833 VanDerWaalsContact O-CG 3.32Å; K829-R833 WeakPolarHBondContact O-CG 3.25Å; K829-R833 PolarHBondContact O-N 3.01Å; E830-R833 PolarHBondContact O-N 2.82Å; E830-R833 VanDerWaalsContact OE2-CD 3.3Å; E830-R833 WeakPolarHBondContact OE2-CD 3.39Å; E830-R833 IonicContact OE2-NH1 3.05Å; E830-R833 PolarHBondContact OE2-NH1 2.85Å; E830-R833 VanDerWaalsContact OE2-NH1 3.12Å; R833-L835 PolarHBondContact O-N 3.11Å; R833-R836 PolarHBondContact O-N 3.32Å; R833-D837 WeakPolarHBondContact O-CB 3.42Å; R833-D837 PolarHBondContact O-N 2.76Å
834	Q	90	Very high	89.7	Confident	56 Å²	56	46 Å²	46	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-58.2	-46.8	179.5	-179	179.5	-24.7	0	0	112	E830 Y832 D837 L838	E830-Q834 WeakPolarHBondContact O-CB 3.41Å; E830-Q834 PolarHBondContact O-N 2.87Å; Y832-Q834 PolarHBondContact O-N 2.91Å; Q834-D837 PolarHBondContact O-N 3.4Å; Q834-L838 HydrophobicContact CG-CD1 3.74Å; Q834-L838 HydrophobicContact CG-CG 4.16Å; Q834-L838 VanDerWaalsContact O-CB 3.3Å; Q834-L838 WeakPolarHBondContact O-CB 3.2Å; Q834-L838 WeakPolarHBondContact O-CG 3.24Å; Q834-L838 PolarHBondContact O-N 2.9Å
835	L	87.7	Confident	89.7	Confident	35 Å²	35	43.4 Å²	43.4	18%	0.183	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-40.6	-179.1	-74.6	166.5	0	0	0	112.4	F799 K831 Y832 R833 H839	F799-L835 HydrophobicContact CB-CD1 4.46Å; F799-L835 HydrophobicContact CD1-CD1 3.6Å; F799-L835 HydrophobicContact CE1-CD1 4.06Å; F799-L835 HydrophobicContact CG-CD1 4.1Å; K831-L835 HydrophobicContact CG-CD1 4.09Å; K831-L835 WeakPolarHBondContact O-CB 3.35Å; K831-L835 WeakPolarHBondContact O-CG 3.43Å; K831-L835 PolarHBondContact O-N 3.17Å; Y832-L835 PolarHBondContact O-N 2.92Å; R833-L835 PolarHBondContact O-N 3.11Å; L835-H839 WeakPolarHBondContact O-CB 3.42Å; L835-H839 PolarHBondContact O-N 3.29Å
836	R	89.9	Confident	89.6	Confident	48 Å²	48	49.7 Å²	49.7	18%	0.181	25%	0.249	C	C	.	.	H	α-helix	trans	-55.6	-56.4	171.6	179.8	-175.1	76.2	162.4	-2.3	110.6	D452 L806 Y832 R833 H839 T840 R894	D452-R836 IonicContact OD2-CZ 3.46Å; D452-R836 IonicContact OD2-NH1 3.11Å; D452-R836 IonicContact OD2-NH2 2.88Å; D452-R836 PolarHBondContact OD2-NH2 3.22Å; L806-R836 HydrophobicContact CD1-CG 4.43Å; Y832-R836 WeakPolarHBondContact O-CB 3.47Å; Y832-R836 PolarHBondContact O-N 3.13Å; R833-R836 PolarHBondContact O-N 3.32Å; R836-H839 PolarHBondContact O-N 3.3Å; R836-T840 PolarHBondContact O-N 3.11Å; R836-T840 PolarHBondContact O-OG1 3.33Å; R836-R894 VanDerWaalsContact NH2-CZ 3.27Å
837	D	91.9	Very high	89.5	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-48	-174.3	-62.7	-11.6	0	0	0	111.8	R833 Q834 H839 T840 L841 I890 R894 N897	R833-D837 WeakPolarHBondContact O-CB 3.42Å; R833-D837 PolarHBondContact O-N 2.76Å; Q834-D837 PolarHBondContact O-N 3.4Å; D837-H839 PolarHBondContact O-N 2.85Å; D837-T840 PolarHBondContact O-N 2.93Å; D837-L841 VanDerWaalsContact O-CB 3.29Å; D837-L841 WeakPolarHBondContact O-CB 3.39Å; D837-L841 WeakPolarHBondContact O-CG 3.49Å; D837-L841 PolarHBondContact O-N 3.09Å; D837-I890 HydrophobicContact CB-CG2 3.83Å; D837-R894 IonicContact OD1-CZ 3.18Å; D837-R894 IonicContact OD1-NH1 2.79Å; D837-R894 PolarHBondContact OD1-NH1 2.93Å; D837-R894 IonicContact OD1-NH2 3.07Å; D837-R894 PolarHBondContact OD1-NH2 3.49Å; D837-R894 IonicContact OD2-CZ 2.61Å; D837-R894 IonicContact OD2-NE 3.33Å; D837-R894 IonicContact OD2-NH1 2.67Å; D837-R894 PolarHBondContact OD2-NH1 2.92Å; D837-R894 IonicContact OD2-NH2 3.62Å; D837-N897 HydrophobicContact CB-CB 3.97Å; D837-N897 PolarHBondContact OD2-ND2 2.69Å
838	L	90.9	Very high	89.6	Confident	28 Å²	28	46.8 Å²	46.8	15%	0.147	22%	0.221	C	C	.	.	H	α-helix	trans	-58.4	-34	178.8	-71.9	179.1	0	0	0	111.5	Q834 D842 N897 K900 F901	Q834-L838 HydrophobicContact CG-CD1 3.74Å; Q834-L838 HydrophobicContact CG-CG 4.16Å; Q834-L838 VanDerWaalsContact O-CB 3.3Å; Q834-L838 WeakPolarHBondContact O-CB 3.2Å; Q834-L838 WeakPolarHBondContact O-CG 3.24Å; Q834-L838 PolarHBondContact O-N 2.9Å; L838-D842 WeakPolarHBondContact O-CB 3.48Å; L838-D842 PolarHBondContact O-N 2.94Å; L838-D842 VanDerWaalsContact O-N 3.12Å; L838-N897 WeakPolarHBondContact CD2-O 3.35Å; L838-K900 HydrophobicContact CD2-CB 4.35Å; L838-F901 HydrophobicContact CD2-CB 3.66Å; L838-F901 HydrophobicContact CD2-CD2 4.29Å; L838-F901 HydrophobicContact CD2-CG 4.47Å
839	H	91	Very high	89.6	Confident	16 Å²	16	46.2 Å²	46.2	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-77.9	-39.9	177.4	-167.8	-71.6	0	0	0	113.1	Y800 S803 E804 L835 R836 D837 D842 S843	Y800-H839 AromaticContact CD2-CD2 3.69Å; Y800-H839 AromaticContact CD2-NE2 3.23Å; Y800-H839 WeakPolarHBondContact CD2-NE2 3.13Å; Y800-H839 AromaticContact CE2-NE2 3.32Å; Y800-H839 VanDerWaalsContact CE2-NE2 3.32Å; Y800-H839 WeakPolarHBondContact CE2-NE2 3.37Å; Y800-H839 PolarHBondContact O-NE2 3.07Å; S803-H839 WeakPolarHBondContact CB-CD2 3.46Å; E804-H839 IonicContact OE1-CE1 3.85Å; E804-H839 PolarHBondContact OE1-CE1 3.2Å; E804-H839 IonicContact OE1-NE2 2.85Å; L835-H839 WeakPolarHBondContact O-CB 3.42Å; L835-H839 PolarHBondContact O-N 3.29Å; R836-H839 PolarHBondContact O-N 3.3Å; D837-H839 PolarHBondContact O-N 2.85Å; H839-D842 PolarHBondContact O-N 3.26Å; H839-S843 WeakPolarHBondContact O-CB 3.42Å; H839-S843 PolarHBondContact O-N 2.85Å
840	T	90.3	Very high	89.6	Confident	19 Å²	19	45.1 Å²	45.1	12%	0.117	21%	0.206	C	C	.	.	H	α-helix	trans	-67.8	-42	176.8	-62.2	0	0	0	0	111.2	M807 R836 D837 S843 H844 I890	M807-T840 HydrophobicContact CE-CG2 3.84Å; M807-T840 HydrophobicContact SD-CG2 4.02Å; R836-T840 PolarHBondContact O-N 3.11Å; R836-T840 PolarHBondContact O-OG1 3.33Å; D837-T840 PolarHBondContact O-N 2.93Å; T840-S843 PolarHBondContact O-N 3.25Å; T840-H844 PolarHBondContact O-CD2 3.4Å; T840-H844 PolarHBondContact O-N 3.39Å; T840-I890 HydrophobicContact CG2-CD1 3.56Å
841	L	91.7	Very high	89.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-45.4	172	-68.9	169.7	0	0	0	111.8	D837 V845 C887 I890 W898 F901	D837-L841 VanDerWaalsContact O-CB 3.29Å; D837-L841 WeakPolarHBondContact O-CB 3.39Å; D837-L841 WeakPolarHBondContact O-CG 3.49Å; D837-L841 PolarHBondContact O-N 3.09Å; L841-V845 VanDerWaalsContact O-CB 3.3Å; L841-V845 WeakPolarHBondContact O-CB 3.26Å; L841-V845 VanDerWaalsContact O-CG2 3.29Å; L841-V845 WeakPolarHBondContact O-CG2 3.43Å; L841-V845 PolarHBondContact O-N 3.45Å; L841-C887 HydrophobicContact CD2-CB 4.04Å; L841-I890 HydrophobicContact CD1-CG2 3.93Å; L841-I890 HydrophobicContact CD2-CB 4.1Å; L841-I890 HydrophobicContact CD2-CD1 4.29Å; L841-I890 HydrophobicContact CD2-CG2 4.02Å; L841-I890 HydrophobicContact CG-CD1 4.35Å; L841-I890 HydrophobicContact CG-CG2 3.98Å; L841-W898 HydrophobicContact CD1-CE3 3.9Å; L841-W898 HydrophobicContact CD2-CE3 3.65Å; L841-W898 HydrophobicContact CD2-CZ3 3.96Å; L841-W898 HydrophobicContact CG-CE3 4.29Å; L841-F901 HydrophobicContact CB-CD1 4.13Å; L841-F901 HydrophobicContact CB-CD2 4.21Å; L841-F901 HydrophobicContact CB-CE1 4.34Å; L841-F901 HydrophobicContact CB-CE2 4.44Å; L841-F901 HydrophobicContact CB-CG 4.07Å; L841-F901 HydrophobicContact CB-CZ 4.5Å; L841-F901 HydrophobicContact CD1-CB 3.99Å; L841-F901 HydrophobicContact CD1-CG 4.26Å
842	D	90.5	Very high	89.1	Confident	30 Å²	30	37.1 Å²	37.1	16%	0.16	17%	0.171	C	C	.	.	H	α-helix	trans	-57.9	-47.3	175.4	179.8	92.8	0	0	0	112	L838 H839 R846 F901	L838-D842 WeakPolarHBondContact O-CB 3.48Å; L838-D842 PolarHBondContact O-N 2.94Å; L838-D842 VanDerWaalsContact O-N 3.12Å; H839-D842 PolarHBondContact O-N 3.26Å; D842-R846 VanDerWaalsContact O-CG 3.3Å; D842-R846 WeakPolarHBondContact O-CG 3.33Å; D842-R846 PolarHBondContact O-N 2.89Å; D842-R846 IonicContact OD1-CZ 2.68Å; D842-R846 IonicContact OD1-NE 3.89Å; D842-R846 IonicContact OD1-NH2 3.71Å; D842-R846 PolarHBondContact OD1-NH2 3.33Å; D842-R846 IonicContact OD2-CZ 3.55Å; D842-R846 IonicContact OD2-NE 3.88Å; D842-R846 PolarHBondContact OD2-NE 3.05Å; D842-R846 IonicContact OD2-NH2 2.76Å; D842-R846 PolarHBondContact OD2-NH2 2.62Å; D842-F901 HydrophobicContact CB-CE2 3.76Å; D842-F901 HydrophobicContact CB-CZ 4.32Å
843	S	89.6	Confident	88.7	Confident	42 Å²	42	40 Å²	40	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-61.5	-52.8	177.7	-169.2	0	0	0	0	112.4	H839 T840 V845 R846 G847	H839-S843 WeakPolarHBondContact O-CB 3.42Å; H839-S843 PolarHBondContact O-N 2.85Å; T840-S843 PolarHBondContact O-N 3.25Å; S843-V845 PolarHBondContact O-N 3.2Å; S843-R846 WeakPolarHBondContact O-CB 3.2Å; S843-R846 PolarHBondContact O-N 3.42Å; S843-G847 PolarHBondContact O-N 3.18Å
844	H	90.4	Very high	88.3	Confident	30 Å²	30	41.1 Å²	41.1	14%	0.139	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-38.9	179.7	-70.8	-55.5	0	0	0	112.6	T840 R846 G847 I848 H883 A886 C887	T840-H844 PolarHBondContact O-CD2 3.4Å; T840-H844 PolarHBondContact O-N 3.39Å; H844-R846 PolarHBondContact O-N 3.02Å; H844-G847 WeakPolarHBondContact O-CA 3.44Å; H844-G847 PolarHBondContact O-N 2.85Å; H844-G847 VanDerWaalsContact O-N 3.14Å; H844-I848 WeakPolarHBondContact O-CD1 3.18Å; H844-I848 VanDerWaalsContact O-CG1 3.24Å; H844-I848 WeakPolarHBondContact O-CG1 3.36Å; H844-I848 PolarHBondContact O-N 3.07Å; H844-H883 HydrophobicContact CB-CB 4.19Å; H844-H883 AromaticContact ND1-CG 3.71Å; H844-H883 AromaticContact ND1-ND1 3.48Å; H844-H883 PolarHBondContact ND1-ND1 3.01Å; H844-A886 WeakPolarHBondContact NE2-CB 3.17Å; H844-C887 VanDerWaalsContact CB-SG 3.55Å
845	V	90.4	Very high	87.6	Confident	5 Å²	5	41 Å²	41	3%	0.03	19%	0.194	C	C	.	.	H	α-helix	trans	-69.7	-31.2	177.1	172	0	0	0	0	112.1	L841 S843 K849 F901 V908	L841-V845 VanDerWaalsContact O-CB 3.3Å; L841-V845 WeakPolarHBondContact O-CB 3.26Å; L841-V845 VanDerWaalsContact O-CG2 3.29Å; L841-V845 WeakPolarHBondContact O-CG2 3.43Å; L841-V845 PolarHBondContact O-N 3.45Å; S843-V845 PolarHBondContact O-N 3.2Å; V845-K849 HydrophobicContact CG1-CD 4.33Å; V845-K849 WeakPolarHBondContact O-CB 3.43Å; V845-K849 VanDerWaalsContact O-CG 3.29Å; V845-K849 WeakPolarHBondContact O-CG 3.21Å; V845-K849 PolarHBondContact O-N 3.38Å; V845-F901 HydrophobicContact CB-CE1 4.26Å; V845-F901 HydrophobicContact CB-CZ 4.28Å; V845-F901 HydrophobicContact CG1-CE1 4.45Å; V845-F901 HydrophobicContact CG2-CE1 3.98Å; V845-F901 HydrophobicContact CG2-CZ 4.45Å; V845-V908 HydrophobicContact CG1-CG1 4.34Å; V845-V908 HydrophobicContact CG1-CG2 4.1Å
846	R	88.9	Confident	86.7	Confident	149 Å²	149	39.8 Å²	39.8	56%	0.562	19%	0.191	S	C	*	.	H	α-helix	trans	-65	-42.9	166.4	-71.9	-179.6	-146.9	-71.5	5.3	111.7	D842 S843 H844 K849 K850	D842-R846 VanDerWaalsContact O-CG 3.3Å; D842-R846 WeakPolarHBondContact O-CG 3.33Å; D842-R846 PolarHBondContact O-N 2.89Å; D842-R846 IonicContact OD1-CZ 2.68Å; D842-R846 IonicContact OD1-NE 3.89Å; D842-R846 IonicContact OD1-NH2 3.71Å; D842-R846 PolarHBondContact OD1-NH2 3.33Å; D842-R846 IonicContact OD2-CZ 3.55Å; D842-R846 IonicContact OD2-NE 3.88Å; D842-R846 PolarHBondContact OD2-NE 3.05Å; D842-R846 IonicContact OD2-NH2 2.76Å; D842-R846 PolarHBondContact OD2-NH2 2.62Å; S843-R846 WeakPolarHBondContact O-CB 3.2Å; S843-R846 PolarHBondContact O-N 3.42Å; H844-R846 PolarHBondContact O-N 3.02Å; R846-K849 PolarHBondContact O-N 2.92Å; R846-K850 WeakPolarHBondContact O-CB 3.43Å; R846-K850 PolarHBondContact O-N 3Å
847	G	86.9	Confident	85.9	Confident	15 Å²	15	38.2 Å²	38.2	16%	0.155	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-47.6	175.6	0	0	0	0	0	112.4	S843 H844 K849 K850 L851	S843-G847 PolarHBondContact O-N 3.18Å; H844-G847 WeakPolarHBondContact O-CA 3.44Å; H844-G847 PolarHBondContact O-N 2.85Å; H844-G847 VanDerWaalsContact O-N 3.14Å; G847-K849 PolarHBondContact O-N 2.69Å; G847-K850 PolarHBondContact O-N 3.16Å; G847-L851 WeakPolarHBondContact O-CG 3.28Å; G847-L851 PolarHBondContact O-N 3.44Å
848	I	88.9	Confident	84.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-59.7	-46.6	175.7	-66.3	157.9	0	0	0	110.9	H844 K850 L852 L880 H883 L884 F911	H844-I848 WeakPolarHBondContact O-CD1 3.18Å; H844-I848 VanDerWaalsContact O-CG1 3.24Å; H844-I848 WeakPolarHBondContact O-CG1 3.36Å; H844-I848 PolarHBondContact O-N 3.07Å; I848-K850 PolarHBondContact O-N 3.3Å; I848-L852 HydrophobicContact CG2-CD1 3.82Å; I848-L852 WeakPolarHBondContact O-CB 3.46Å; I848-L852 WeakPolarHBondContact O-CG 3.47Å; I848-L852 PolarHBondContact O-N 3.27Å; I848-L880 HydrophobicContact CB-CD1 4.37Å; I848-L880 HydrophobicContact CG1-CD1 4.16Å; I848-L880 HydrophobicContact CG2-CD1 3.75Å; I848-H883 HydrophobicContact CD1-CB 3.9Å; I848-H883 HydrophobicContact CG1-CB 3.59Å; I848-L884 HydrophobicContact CD1-CD2 3.59Å; I848-L884 HydrophobicContact CD1-CG 3.84Å; I848-L884 HydrophobicContact CG1-CD2 4.44Å; I848-L884 HydrophobicContact CG1-CG 4.31Å; I848-F911 HydrophobicContact CG2-CE1 3.86Å; I848-F911 HydrophobicContact CG2-CZ 4.29Å
849	K	87.1	Confident	83.4	Confident	42 Å²	42	43.2 Å²	43.2	18%	0.183	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-48.9	174.9	-75.9	172.8	176	-179.1	0	110.5	V845 R846 G847 L852 E853 D905 S907 F911	V845-K849 HydrophobicContact CG1-CD 4.33Å; V845-K849 WeakPolarHBondContact O-CB 3.43Å; V845-K849 VanDerWaalsContact O-CG 3.29Å; V845-K849 WeakPolarHBondContact O-CG 3.21Å; V845-K849 PolarHBondContact O-N 3.38Å; R846-K849 PolarHBondContact O-N 2.92Å; G847-K849 PolarHBondContact O-N 2.69Å; K849-L852 PolarHBondContact O-N 2.84Å; K849-E853 WeakPolarHBondContact O-CB 3.24Å; K849-E853 VanDerWaalsContact O-CG 3.28Å; K849-E853 WeakPolarHBondContact O-CG 2.97Å; K849-E853 PolarHBondContact O-N 2.94Å; K849-D905 IonicContact NZ-OD2 2.87Å; K849-D905 PolarHBondContact NZ-OD2 2.8Å; K849-D905 VanDerWaalsContact NZ-OD2 3.11Å; K849-S907 PolarHBondContact NZ-OG 2.97Å; K849-F911 HydrophobicContact CB-CE1 4.43Å; K849-F911 HydrophobicContact CB-CZ 4.27Å; K849-F911 HydrophobicContact CD-CE1 4.5Å; K849-F911 HydrophobicContact CG-CD1 3.97Å; K849-F911 HydrophobicContact CG-CE1 3.44Å; K849-F911 VanDerWaalsContact CG-CE1 3.44Å; K849-F911 HydrophobicContact CG-CE2 4.25Å; K849-F911 HydrophobicContact CG-CZ 3.59Å
850	K	88.1	Confident	81.9	Confident	113 Å²	113	52.1 Å²	52.1	49%	0.491	24%	0.241	S	C	.	.	H	α-helix	trans	-61.6	-50	179.5	-178.2	-179.8	175.1	-69	0	113.3	R846 G847 I848 L852 E853 E854	R846-K850 WeakPolarHBondContact O-CB 3.43Å; R846-K850 PolarHBondContact O-N 3Å; G847-K850 PolarHBondContact O-N 3.16Å; I848-K850 PolarHBondContact O-N 3.3Å; K850-L852 VanDerWaalsContact C-N 3.26Å; K850-L852 PolarHBondContact O-N 3.41Å; K850-E853 PolarHBondContact O-N 3.49Å; K850-E854 VanDerWaalsContact CE-OE1 3.31Å; K850-E854 WeakPolarHBondContact CE-OE1 3.41Å; K850-E854 IonicContact NZ-OE1 2.71Å; K850-E854 PolarHBondContact NZ-OE1 2.93Å; K850-E854 IonicContact NZ-OE2 3.84Å; K850-E854 PolarHBondContact NZ-OE2 2.8Å; K850-E854 WeakPolarHBondContact O-CG 3.42Å; K850-E854 PolarHBondContact O-N 3.39Å
851	L	84.6	Confident	80.2	Confident	28 Å²	28	56 Å²	56	15%	0.147	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-37	-179.5	-71.7	171.5	0	0	0	112.1	G847 Q855 T876	G847-L851 WeakPolarHBondContact O-CG 3.28Å; G847-L851 PolarHBondContact O-N 3.44Å; L851-Q855 WeakPolarHBondContact O-CG 3.24Å; L851-Q855 PolarHBondContact O-N 3.39Å; L851-T876 HydrophobicContact CB-CG2 4.4Å; L851-T876 HydrophobicContact CD2-CG2 4.48Å
852	L	81.2	Confident	78.5	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-77.7	-36	178.5	-68.6	169.4	0	0	0	112.2	I848 K849 K850 Q855 G856 I857 L872 L880 F911 V915 V919	I848-L852 HydrophobicContact CG2-CD1 3.82Å; I848-L852 WeakPolarHBondContact O-CB 3.46Å; I848-L852 WeakPolarHBondContact O-CG 3.47Å; I848-L852 PolarHBondContact O-N 3.27Å; K849-L852 PolarHBondContact O-N 2.84Å; K850-L852 VanDerWaalsContact C-N 3.26Å; K850-L852 PolarHBondContact O-N 3.41Å; L852-Q855 CarbonylContact O-C 3.58Å; L852-Q855 PolarHBondContact O-N 3.23Å; L852-G856 PolarHBondContact O-N 3.33Å; L852-I857 CarbonylContact C-O 3.27Å; L852-I857 HydrophobicContact CB-CB 4.26Å; L852-I857 HydrophobicContact CD2-CD1 4.06Å; L852-I857 WeakPolarHBondContact O-CA 3.2Å; L852-I857 WeakPolarHBondContact O-CB 3.17Å; L852-I857 PolarHBondContact O-N 3.39Å; L852-L872 HydrophobicContact CD2-CD1 4.31Å; L852-L872 HydrophobicContact CD2-CD2 4.36Å; L852-L880 HydrophobicContact CD1-CD1 4.28Å; L852-L880 HydrophobicContact CD2-CD2 4.11Å; L852-L880 HydrophobicContact CG-CD1 4.42Å; L852-F911 HydrophobicContact CD1-CZ 3.82Å; L852-V915 HydrophobicContact CD1-CG1 3.74Å; L852-V915 HydrophobicContact CD1-CG2 3.88Å; L852-V919 HydrophobicContact CD2-CG2 4.29Å
853	E	82.7	Confident	77	Confident	88 Å²	88	62.3 Å²	62.3	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-38.9	171.1	-74.5	177.8	176.6	0	0	112.1	K849 K850 Q855 G856 F858	K849-E853 WeakPolarHBondContact O-CB 3.24Å; K849-E853 VanDerWaalsContact O-CG 3.28Å; K849-E853 WeakPolarHBondContact O-CG 2.97Å; K849-E853 PolarHBondContact O-N 2.94Å; K850-E853 PolarHBondContact O-N 3.49Å; E853-Q855 VanDerWaalsContact C-N 3.26Å; E853-Q855 PolarHBondContact O-N 2.78Å; E853-G856 PolarHBondContact O-N 3.17Å; E853-F858 HydrophobicContact CB-CD1 4.09Å; E853-F858 HydrophobicContact CB-CE1 4.08Å; E853-F858 HydrophobicContact CG-CD1 3.93Å; E853-F858 HydrophobicContact CG-CE1 4.42Å; E853-F858 WeakPolarHBondContact O-CE1 3.35Å; E853-F858 WeakPolarHBondContact O-CZ 3.44Å
854	E	81.3	Confident	75.7	Confident	117 Å²	117	61.1 Å²	61.1	55%	0.547	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-28.8	175.5	-74.9	174.1	153.2	0	0	112.7	K850 G856	K850-E854 VanDerWaalsContact CE-OE1 3.31Å; K850-E854 WeakPolarHBondContact CE-OE1 3.41Å; K850-E854 IonicContact NZ-OE1 2.71Å; K850-E854 PolarHBondContact NZ-OE1 2.93Å; K850-E854 IonicContact NZ-OE2 3.84Å; K850-E854 PolarHBondContact NZ-OE2 2.8Å; K850-E854 WeakPolarHBondContact O-CG 3.42Å; K850-E854 PolarHBondContact O-N 3.39Å; E854-G856 VanDerWaalsContact C-N 3.33Å
855	Q	74.7	Confident	74.4	Confident	53 Å²	53	63 Å²	63	25%	0.248	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8	172.2	-60.2	-66	-17.4	0	0	113.3	L851 L852 E853 L872 T876	L851-Q855 WeakPolarHBondContact O-CG 3.24Å; L851-Q855 PolarHBondContact O-N 3.39Å; L852-Q855 CarbonylContact O-C 3.58Å; L852-Q855 PolarHBondContact O-N 3.23Å; E853-Q855 VanDerWaalsContact C-N 3.26Å; E853-Q855 PolarHBondContact O-N 2.78Å; Q855-L872 HydrophobicContact CB-CD2 3.95Å; Q855-L872 HydrophobicContact CG-CD2 3.92Å; Q855-T876 HydrophobicContact CG-CG2 3.95Å; Q855-T876 PolarHBondContact NE2-OG1 3.44Å; Q855-T876 VanDerWaalsContact NE2-OG1 3.17Å
856	G	68.8	Low	73.1	Confident	10 Å²	10	65.3 Å²	65.3	10%	0.103	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	15.4	173.8	0	0	0	0	0	115.9	L852 E853 E854 F858 S867	L852-G856 PolarHBondContact O-N 3.33Å; E853-G856 PolarHBondContact O-N 3.17Å; E854-G856 VanDerWaalsContact C-N 3.33Å; G856-F858 WeakPolarHBondContact O-CD2 3.49Å; G856-S867 VanDerWaalsContact O-CB 3.31Å; G856-S867 WeakPolarHBondContact O-CB 3.4Å; G856-S867 PolarHBondContact O-N 2.86Å; G856-S867 PolarHBondContact O-OG 2.68Å
857	I	73.6	Confident	71.7	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.077	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	92.6	173.4	-60.3	171.7	0	0	0	108.2	L852 V864 A866 L918	L852-I857 CarbonylContact C-O 3.27Å; L852-I857 HydrophobicContact CB-CB 4.26Å; L852-I857 HydrophobicContact CD2-CD1 4.06Å; L852-I857 WeakPolarHBondContact O-CA 3.2Å; L852-I857 WeakPolarHBondContact O-CB 3.17Å; L852-I857 PolarHBondContact O-N 3.39Å; I857-V864 HydrophobicContact CG2-CG1 3.55Å; I857-A866 HydrophobicContact CG1-CB 4.22Å; I857-L918 HydrophobicContact CG2-CD1 4.08Å
858	F	65.9	Low	70.1	Confident	86 Å²	86	64.4 Å²	64.4	38%	0.377	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.7	-174.7	-58.6	-73.9	0	0	0	112.2	E853 G856 V864 T865 S867	E853-F858 HydrophobicContact CB-CD1 4.09Å; E853-F858 HydrophobicContact CB-CE1 4.08Å; E853-F858 HydrophobicContact CG-CD1 3.93Å; E853-F858 HydrophobicContact CG-CE1 4.42Å; E853-F858 WeakPolarHBondContact O-CE1 3.35Å; E853-F858 WeakPolarHBondContact O-CZ 3.44Å; G856-F858 WeakPolarHBondContact O-CD2 3.49Å; F858-V864 WeakPolarHBondContact O-CA 3.36Å; F858-T865 PolarHBondContact N-O 2.92Å; F858-T865 PolarHBondContact O-N 3.44Å; F858-S867 WeakPolarHBondContact CE2-OG 3.26Å
859	L	64.8	Low	68.5	Low	47 Å²	47	69 Å²	69	25%	0.246	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.9	164.5	-177.6	137.4	0	0	0	109.6	V864 Y910 F911	L859-V864 HydrophobicContact CB-CG2 4.2Å; L859-V864 HydrophobicContact CD1-CG2 3.93Å; L859-V864 HydrophobicContact CG-CG2 4.3Å; L859-Y910 HydrophobicContact CD1-CD1 4.24Å; L859-F911 HydrophobicContact CB-CD2 4.24Å; L859-F911 HydrophobicContact CD1-CB 3.71Å; L859-F911 HydrophobicContact CD1-CD2 3.63Å; L859-F911 HydrophobicContact CD1-CG 4.07Å
860	R	60.4	Low	67	Low	204 Å²	204	70.8 Å²	70.8	77%	0.77	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.4	-177	-158.1	172.3	-169.8	160	4.4	110.7	S862 V863	R860-S862 VanDerWaalsContact C-N 3.28Å; R860-S862 PolarHBondContact O-N 3.48Å; R860-V863 PolarHBondContact N-O 2.89Å; R860-V863 PolarHBondContact O-N 2.95Å
861	A	54.1	Low	65.9	Low	99 Å²	99	68.9 Å²	68.9	82%	0.818	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	43.1	-178.9	0	0	0	0	0	114.1	V863	A861-V863 VanDerWaalsContact C-N 3.26Å; A861-V863 PolarHBondContact O-N 3.42Å
862	S	55.9	Low	65.2	Low	84 Å²	84	68.5 Å²	68.5	59%	0.587	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	34.5	-176.6	-56.1	0	0	0	0	114.7	R860 Y910	R860-S862 VanDerWaalsContact C-N 3.28Å; R860-S862 PolarHBondContact O-N 3.48Å; S862-Y910 WeakPolarHBondContact O-CE1 3.14Å; S862-Y910 VanDerWaalsContact O-CZ 3.23Å; S862-Y910 PolarHBondContact O-OH 3.42Å
863	V	58.7	Low	65.1	Low	80 Å²	80	74.3 Å²	74.3	49%	0.485	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.4	161.4	-176.4	0	0	0	0	107.5	R860 A861 T865	R860-V863 PolarHBondContact N-O 2.89Å; R860-V863 PolarHBondContact O-N 2.95Å; A861-V863 VanDerWaalsContact C-N 3.26Å; A861-V863 PolarHBondContact O-N 3.42Å; V863-T865 HydrophobicContact CG1-CG2 4.06Å
864	V	62.3	Low	64.9	Low	17 Å²	17	78.3 Å²	78.3	10%	0.103	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.8	168.7	-179.9	0	0	0	0	108.8	I857 F858 L859 F911 Q914 L918	I857-V864 HydrophobicContact CG2-CG1 3.55Å; F858-V864 WeakPolarHBondContact O-CA 3.36Å; L859-V864 HydrophobicContact CB-CG2 4.2Å; L859-V864 HydrophobicContact CD1-CG2 3.93Å; L859-V864 HydrophobicContact CG-CG2 4.3Å; V864-F911 HydrophobicContact CG2-CD2 4.44Å; V864-Q914 HydrophobicContact CB-CB 3.86Å; V864-Q914 HydrophobicContact CB-CG 4.32Å; V864-Q914 HydrophobicContact CG2-CB 3.54Å; V864-Q914 HydrophobicContact CG2-CG 3.93Å; V864-L918 HydrophobicContact CB-CD1 4.4Å; V864-L918 HydrophobicContact CG1-CD1 3.54Å
865	T	63.2	Low	65	Low	70 Å²	70	78.3 Å²	78.3	43%	0.429	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.3	-179.5	55.4	0	0	0	0	109.6	F858 V863	F858-T865 PolarHBondContact N-O 2.92Å; F858-T865 PolarHBondContact O-N 3.44Å; V863-T865 HydrophobicContact CG1-CG2 4.06Å
866	A	63.5	Low	65.4	Low	52 Å²	52	76.7 Å²	76.7	43%	0.43	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.8	168.1	0	0	0	0	0	109.7	I857 L918	I857-A866 HydrophobicContact CG1-CB 4.22Å; A866-L918 HydrophobicContact CB-CD2 4.47Å
867	S	59.7	Low	66.1	Low	78 Å²	78	78.4 Å²	78.4	55%	0.545	47%	0.469	S	S	.	.	S	Bend	trans	-82.4	-21.5	-179.9	-50.2	0	0	0	0	112.9	G856 F858	G856-S867 VanDerWaalsContact O-CB 3.31Å; G856-S867 WeakPolarHBondContact O-CB 3.4Å; G856-S867 PolarHBondContact O-N 2.86Å; G856-S867 PolarHBondContact O-OG 2.68Å; F858-S867 WeakPolarHBondContact CE2-OG 3.26Å
868	S	53.5	Low	66.7	Low	67 Å²	67	80.8 Å²	80.8	47%	0.469	48%	0.481	S	S	.	.			trans	-134.8	133.7	-173.6	-59.4	0	0	0	0	109.6	S870	S868-S870 WeakPolarHBondContact CB-OG 3.44Å; S868-S870 PolarHBondContact O-N 3.01Å
869	G	53.7	Low	67.7	Low	99 Å²	99	78.4 Å²	78.4	100%	1.021	48%	0.475	S	S	*	.			trans	-86.3	32.9	174.2	0	0	0	0	0	113.6
870	S	55.9	Low	68.8	Low	78 Å²	78	76.2 Å²	76.2	55%	0.545	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-100.9	131.2	-177.3	48.3	0	0	0	0	110.5	S868	S868-S870 WeakPolarHBondContact CB-OG 3.44Å; S868-S870 PolarHBondContact O-N 3.01Å
871	A	64.9	Low	70.1	Confident	73 Å²	73	68.4 Å²	68.4	60%	0.603	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-57.2	152.6	170.7	0	0	0	0	0	111.3
872	L	70.6	Confident	71.8	Confident	20 Å²	20	69 Å²	69	11%	0.105	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-65.1	144.4	-177.1	-63.6	177.5	0	0	0	111	L852 Q855 L877 L880 V919	L852-L872 HydrophobicContact CD2-CD1 4.31Å; L852-L872 HydrophobicContact CD2-CD2 4.36Å; Q855-L872 HydrophobicContact CB-CD2 3.95Å; Q855-L872 HydrophobicContact CG-CD2 3.92Å; L872-L877 HydrophobicContact CB-CB 4.47Å; L872-L877 HydrophobicContact CB-CD1 4.36Å; L872-L877 HydrophobicContact CD1-CD1 3.98Å; L872-L880 HydrophobicContact CD1-CD2 3.48Å; L872-L880 VanDerWaalsContact CD1-CD2 3.48Å; L872-V919 HydrophobicContact CD1-CG1 3.81Å; L872-V919 HydrophobicContact CD1-CG2 4.34Å
873	Q	79.1	Confident	73.4	Confident	124 Å²	124	67 Å²	67	58%	0.579	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-63.3	142.7	170.1	-69.6	-173.6	-32.5	0	0	110.2	D875 T876 L877	Q873-D875 VanDerWaalsContact C-N 3.29Å; Q873-D875 PolarHBondContact O-N 3.26Å; Q873-T876 CarbonylContact O-C 3.57Å; Q873-T876 WeakPolarHBondContact O-CA 3.44Å; Q873-T876 WeakPolarHBondContact O-CB 3.38Å; Q873-T876 PolarHBondContact O-N 3.2Å; Q873-L877 PolarHBondContact O-N 2.81Å
874	Y	79.2	Confident	75	Confident	171 Å²	171	63.2 Å²	63.2	67%	0.671	38%	0.38	S	S	*	.	H	α-helix	trans	-54.7	-42.3	-173	-177.9	-112.4	0	0	0	113.1	T876 L877 I878	Y874-T876 PolarHBondContact O-N 2.81Å; Y874-L877 WeakPolarHBondContact O-CB 3.34Å; Y874-L877 PolarHBondContact O-N 2.61Å; Y874-I878 HydrophobicContact CD1-CD1 3.81Å; Y874-I878 HydrophobicContact CE1-CD1 3.45Å; Y874-I878 VanDerWaalsContact CE1-CD1 3.45Å; Y874-I878 HydrophobicContact CE1-CG1 4.44Å; Y874-I878 HydrophobicContact CE2-CD1 4.39Å; Y874-I878 HydrophobicContact CG-CD1 4.44Å; Y874-I878 WeakPolarHBondContact O-CG1 3.42Å; Y874-I878 PolarHBondContact O-N 3.16Å
875	D	82.4	Confident	76.4	Confident	117 Å²	117	67.4 Å²	67.4	63%	0.626	40%	0.397	S	S	*	.	H	α-helix	trans	-69.5	-35.4	179.8	-43.2	-60.7	0	0	0	111.8	Q873 I878 S879	Q873-D875 VanDerWaalsContact C-N 3.29Å; Q873-D875 PolarHBondContact O-N 3.26Å; D875-I878 PolarHBondContact O-N 2.79Å; D875-S879 PolarHBondContact O-N 3.06Å; D875-S879 VanDerWaalsContact O-N 3.09Å
876	T	83.4	Confident	77.7	Confident	20 Å²	20	65 Å²	65	12%	0.123	39%	0.385	C	S	.	.	H	α-helix	trans	-67.7	-37.4	171.2	-52.1	0	0	0	0	111.4	L851 Q855 Q873 Y874 S879 L880	L851-T876 HydrophobicContact CB-CG2 4.4Å; L851-T876 HydrophobicContact CD2-CG2 4.48Å; Q855-T876 HydrophobicContact CG-CG2 3.95Å; Q855-T876 PolarHBondContact NE2-OG1 3.44Å; Q855-T876 VanDerWaalsContact NE2-OG1 3.17Å; Q873-T876 CarbonylContact O-C 3.57Å; Q873-T876 WeakPolarHBondContact O-CA 3.44Å; Q873-T876 WeakPolarHBondContact O-CB 3.38Å; Q873-T876 PolarHBondContact O-N 3.2Å; Y874-T876 PolarHBondContact O-N 2.81Å; T876-S879 PolarHBondContact O-N 3.28Å; T876-L880 WeakPolarHBondContact O-CB 3.26Å; T876-L880 PolarHBondContact O-N 3.15Å
877	L	84.1	Confident	79.1	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-66.3	-38	177.1	-170.2	72.1	0	0	0	111.6	L872 Q873 Y874 M881 V919 V923	L872-L877 HydrophobicContact CB-CB 4.47Å; L872-L877 HydrophobicContact CB-CD1 4.36Å; L872-L877 HydrophobicContact CD1-CD1 3.98Å; Q873-L877 PolarHBondContact O-N 2.81Å; Y874-L877 WeakPolarHBondContact O-CB 3.34Å; Y874-L877 PolarHBondContact O-N 2.61Å; L877-M881 VanDerWaalsContact O-CB 3.22Å; L877-M881 WeakPolarHBondContact O-CB 3.41Å; L877-M881 PolarHBondContact O-N 3.07Å; L877-V919 HydrophobicContact CD1-CG1 4.39Å; L877-V923 HydrophobicContact CD1-CG2 3.54Å; L877-V923 HydrophobicContact CG-CG2 4.49Å
878	I	86.3	Confident	80.5	Confident	65 Å²	65	59.1 Å²	59.1	33%	0.333	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-55.5	171.8	-70.3	164.8	0	0	0	110.2	Y874 D875 L880 M881 E882	Y874-I878 HydrophobicContact CD1-CD1 3.81Å; Y874-I878 HydrophobicContact CE1-CD1 3.45Å; Y874-I878 VanDerWaalsContact CE1-CD1 3.45Å; Y874-I878 HydrophobicContact CE1-CG1 4.44Å; Y874-I878 HydrophobicContact CE2-CD1 4.39Å; Y874-I878 HydrophobicContact CG-CD1 4.44Å; Y874-I878 WeakPolarHBondContact O-CG1 3.42Å; Y874-I878 PolarHBondContact O-N 3.16Å; D875-I878 PolarHBondContact O-N 2.79Å; I878-L880 VanDerWaalsContact C-N 3.3Å; I878-L880 PolarHBondContact O-N 3.42Å; I878-M881 CarbonylContact O-C 3.41Å; I878-M881 WeakPolarHBondContact O-CA 3.24Å; I878-M881 WeakPolarHBondContact O-CB 3.17Å; I878-M881 PolarHBondContact O-N 3.35Å; I878-E882 HydrophobicContact CG2-CG 4.38Å; I878-E882 WeakPolarHBondContact O-CG 3.37Å; I878-E882 PolarHBondContact O-N 2.61Å
879	S	86.1	Confident	82.4	Confident	35 Å²	35	61.5 Å²	61.5	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-63	-36.7	-176.9	-167.1	0	0	0	0	112.7	D875 T876 E882 H883	D875-S879 PolarHBondContact O-N 3.06Å; D875-S879 VanDerWaalsContact O-N 3.09Å; T876-S879 PolarHBondContact O-N 3.28Å; S879-E882 PolarHBondContact O-N 2.79Å; S879-H883 PolarHBondContact O-N 3.03Å; S879-H883 VanDerWaalsContact O-N 3.13Å
880	L	87.4	Confident	84.1	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-44.7	170.7	176.2	61.4	0	0	0	111.9	I848 L852 L872 T876 I878 L884 V919	I848-L880 HydrophobicContact CB-CD1 4.37Å; I848-L880 HydrophobicContact CG1-CD1 4.16Å; I848-L880 HydrophobicContact CG2-CD1 3.75Å; L852-L880 HydrophobicContact CD1-CD1 4.28Å; L852-L880 HydrophobicContact CD2-CD2 4.11Å; L852-L880 HydrophobicContact CG-CD1 4.42Å; L872-L880 HydrophobicContact CD1-CD2 3.48Å; L872-L880 VanDerWaalsContact CD1-CD2 3.48Å; T876-L880 WeakPolarHBondContact O-CB 3.26Å; T876-L880 PolarHBondContact O-N 3.15Å; I878-L880 VanDerWaalsContact C-N 3.3Å; I878-L880 PolarHBondContact O-N 3.42Å; L880-L884 HydrophobicContact CD1-CD1 3.81Å; L880-L884 HydrophobicContact CD1-CG 4.3Å; L880-L884 HydrophobicContact CG-CD1 3.94Å; L880-L884 WeakPolarHBondContact O-CB 3.41Å; L880-L884 VanDerWaalsContact O-CG 3.31Å; L880-L884 WeakPolarHBondContact O-CG 3.2Å; L880-L884 PolarHBondContact O-N 2.94Å; L880-V919 HydrophobicContact CD2-CG1 4.08Å
881	M	88.8	Confident	85.7	Confident	40 Å²	40	53.9 Å²	53.9	20%	0.197	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-40.5	177.5	178	62.5	72.2	0	0	112	L877 I878 L884 K885 G922 V923 V926	L877-M881 VanDerWaalsContact O-CB 3.22Å; L877-M881 WeakPolarHBondContact O-CB 3.41Å; L877-M881 PolarHBondContact O-N 3.07Å; I878-M881 CarbonylContact O-C 3.41Å; I878-M881 WeakPolarHBondContact O-CA 3.24Å; I878-M881 WeakPolarHBondContact O-CB 3.17Å; I878-M881 PolarHBondContact O-N 3.35Å; M881-L884 PolarHBondContact O-N 3.31Å; M881-K885 HydrophobicContact CG-CD 4.11Å; M881-K885 HydrophobicContact CG-CG 4.43Å; M881-K885 WeakPolarHBondContact O-CB 3.39Å; M881-K885 VanDerWaalsContact O-CG 3.32Å; M881-K885 WeakPolarHBondContact O-CG 3.25Å; M881-K885 PolarHBondContact O-N 3.47Å; M881-K885 HydrophobicContact SD-CD 4.19Å; M881-K885 HydrophobicContact SD-CG 4.04Å; M881-G922 VanDerWaalsContact CE-O 3.27Å; M881-G922 WeakPolarHBondContact CE-O 3.38Å; M881-V923 HydrophobicContact CE-CG2 4.12Å; M881-V926 HydrophobicContact SD-CG2 3.98Å
882	E	90	Very high	86.8	Confident	111 Å²	111	52.7 Å²	52.7	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-50.2	176.4	-71.8	170.5	169.1	0	0	111.7	I878 S879 L884 K885 A886	I878-E882 HydrophobicContact CG2-CG 4.38Å; I878-E882 WeakPolarHBondContact O-CG 3.37Å; I878-E882 PolarHBondContact O-N 2.61Å; S879-E882 PolarHBondContact O-N 2.79Å; E882-L884 VanDerWaalsContact C-N 3.34Å; E882-L884 PolarHBondContact O-N 2.85Å; E882-K885 PolarHBondContact O-N 2.75Å; E882-A886 WeakPolarHBondContact O-CB 3.32Å; E882-A886 PolarHBondContact O-N 2.99Å
883	H	89.6	Confident	87.7	Confident	43 Å²	43	56 Å²	56	20%	0.199	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-39.8	177	-71.6	6.6	0	0	0	112.5	H844 I848 S879 C887	H844-H883 HydrophobicContact CB-CB 4.19Å; H844-H883 AromaticContact ND1-CG 3.71Å; H844-H883 AromaticContact ND1-ND1 3.48Å; H844-H883 PolarHBondContact ND1-ND1 3.01Å; I848-H883 HydrophobicContact CD1-CB 3.9Å; I848-H883 HydrophobicContact CG1-CB 3.59Å; S879-H883 PolarHBondContact O-N 3.03Å; S879-H883 VanDerWaalsContact O-N 3.13Å; H883-C887 PolarHBondContact O-N 2.66Å; H883-C887 VanDerWaalsContact O-N 3.08Å
884	L	91.3	Very high	88.2	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-37.9	178.3	-76.2	170.1	0	0	0	112.6	I848 L880 M881 E882 C887 A888 L912 V923 V926 L927 L930	I848-L884 HydrophobicContact CD1-CD2 3.59Å; I848-L884 HydrophobicContact CD1-CG 3.84Å; I848-L884 HydrophobicContact CG1-CD2 4.44Å; I848-L884 HydrophobicContact CG1-CG 4.31Å; L880-L884 HydrophobicContact CD1-CD1 3.81Å; L880-L884 HydrophobicContact CD1-CG 4.3Å; L880-L884 HydrophobicContact CG-CD1 3.94Å; L880-L884 WeakPolarHBondContact O-CB 3.41Å; L880-L884 VanDerWaalsContact O-CG 3.31Å; L880-L884 WeakPolarHBondContact O-CG 3.2Å; L880-L884 PolarHBondContact O-N 2.94Å; M881-L884 PolarHBondContact O-N 3.31Å; E882-L884 VanDerWaalsContact C-N 3.34Å; E882-L884 PolarHBondContact O-N 2.85Å; L884-C887 PolarHBondContact O-N 3.01Å; L884-A888 WeakPolarHBondContact O-CB 3.29Å; L884-A888 PolarHBondContact O-N 3.03Å; L884-L912 HydrophobicContact CD2-CD2 4.24Å; L884-V923 HydrophobicContact CD1-CG1 3.29Å; L884-V926 HydrophobicContact CB-CG1 3.92Å; L884-V926 WeakPolarHBondContact O-CG1 3.35Å; L884-L927 HydrophobicContact CD1-CD2 4.01Å; L884-L927 HydrophobicContact CD1-CG 4.24Å; L884-L927 HydrophobicContact CD2-CD2 3.58Å; L884-L927 HydrophobicContact CD2-CG 4.48Å; L884-L927 HydrophobicContact CG-CD2 4.49Å; L884-L930 HydrophobicContact CD2-CD1 3.72Å
885	K	91.8	Very high	88.7	Confident	106 Å²	106	44.1 Å²	44.1	46%	0.461	23%	0.229	S	C	.	.	H	α-helix	trans	-63.5	-47.9	172.9	-78.4	176.9	175.6	-179.8	0	111.8	M881 E882 C887 A888 E889	M881-K885 HydrophobicContact CG-CD 4.11Å; M881-K885 HydrophobicContact CG-CG 4.43Å; M881-K885 WeakPolarHBondContact O-CB 3.39Å; M881-K885 VanDerWaalsContact O-CG 3.32Å; M881-K885 WeakPolarHBondContact O-CG 3.25Å; M881-K885 PolarHBondContact O-N 3.47Å; M881-K885 HydrophobicContact SD-CD 4.19Å; M881-K885 HydrophobicContact SD-CG 4.04Å; E882-K885 PolarHBondContact O-N 2.75Å; K885-C887 VanDerWaalsContact C-N 3.27Å; K885-C887 PolarHBondContact O-N 3.27Å; K885-A888 CarbonylContact O-C 3.53Å; K885-A888 WeakPolarHBondContact O-CA 3.23Å; K885-A888 PolarHBondContact O-N 3.33Å; K885-E889 WeakPolarHBondContact O-CG 3.33Å; K885-E889 PolarHBondContact O-N 3.29Å
886	A	90.3	Very high	89	Confident	20 Å²	20	43.7 Å²	43.7	17%	0.165	23%	0.225	C	C	.	.	H	α-helix	trans	-58.8	-38.4	176.9	0	0	0	0	0	112.3	H844 E882 I890	H844-A886 WeakPolarHBondContact NE2-CB 3.17Å; E882-A886 WeakPolarHBondContact O-CB 3.32Å; E882-A886 PolarHBondContact O-N 2.99Å; A886-I890 WeakPolarHBondContact O-CG1 3.45Å; A886-I890 PolarHBondContact O-N 3.07Å
887	C	92.3	Very high	89.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-43.5	169.5	-75.2	0	0	0	0	112.8	L841 H844 H883 L884 K885 I890 A891 L930	L841-C887 HydrophobicContact CD2-CB 4.04Å; H844-C887 VanDerWaalsContact CB-SG 3.55Å; H883-C887 PolarHBondContact O-N 2.66Å; H883-C887 VanDerWaalsContact O-N 3.08Å; L884-C887 PolarHBondContact O-N 3.01Å; K885-C887 VanDerWaalsContact C-N 3.27Å; K885-C887 PolarHBondContact O-N 3.27Å; C887-I890 PolarHBondContact O-N 2.96Å; C887-A891 VanDerWaalsContact O-CB 3.28Å; C887-A891 WeakPolarHBondContact O-CB 3.39Å; C887-A891 PolarHBondContact O-N 3.01Å; C887-L930 HydrophobicContact CB-CD1 4.14Å; C887-L930 HydrophobicContact CB-CD2 3.85Å
888	A	90.5	Very high	89.7	Confident	5 Å²	5	40.6 Å²	40.6	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-68.7	-35.8	-176.2	0	0	0	0	0	112.8	L884 K885 A891 A892 V926 L930	L884-A888 WeakPolarHBondContact O-CB 3.29Å; L884-A888 PolarHBondContact O-N 3.03Å; K885-A888 CarbonylContact O-C 3.53Å; K885-A888 WeakPolarHBondContact O-CA 3.23Å; K885-A888 PolarHBondContact O-N 3.33Å; A888-A891 PolarHBondContact O-N 2.94Å; A888-A892 VanDerWaalsContact O-CB 3.28Å; A888-A892 WeakPolarHBondContact O-CB 3.43Å; A888-A892 PolarHBondContact O-N 3.33Å; A888-V926 HydrophobicContact CB-CG1 3.71Å; A888-L930 HydrophobicContact CB-CD2 4.3Å; A888-L930 HydrophobicContact CB-CG 4.29Å
889	E	91.9	Very high	89.9	Confident	116 Å²	116	40.3 Å²	40.3	54%	0.542	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-51	173.6	-73.3	161.8	-162.3	0	0	111.1	K885 A891 A892 Q893	K885-E889 WeakPolarHBondContact O-CG 3.33Å; K885-E889 PolarHBondContact O-N 3.29Å; E889-A891 VanDerWaalsContact C-N 3.29Å; E889-A891 PolarHBondContact O-N 3.34Å; E889-A892 PolarHBondContact O-N 3.25Å; E889-Q893 WeakPolarHBondContact O-CB 3.5Å; E889-Q893 WeakPolarHBondContact O-CG 3.23Å; E889-Q893 PolarHBondContact O-N 2.89Å
890	I	90.3	Very high	90.1	Very high	18 Å²	18	42.5 Å²	42.5	9%	0.092	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-41.1	175.1	-65	170.9	0	0	0	110.8	D837 T840 L841 A886 C887 R894	D837-I890 HydrophobicContact CB-CG2 3.83Å; T840-I890 HydrophobicContact CG2-CD1 3.56Å; L841-I890 HydrophobicContact CD1-CG2 3.93Å; L841-I890 HydrophobicContact CD2-CB 4.1Å; L841-I890 HydrophobicContact CD2-CD1 4.29Å; L841-I890 HydrophobicContact CD2-CG2 4.02Å; L841-I890 HydrophobicContact CG-CD1 4.35Å; L841-I890 HydrophobicContact CG-CG2 3.98Å; A886-I890 WeakPolarHBondContact O-CG1 3.45Å; A886-I890 PolarHBondContact O-N 3.07Å; C887-I890 PolarHBondContact O-N 2.96Å; I890-R894 CarbonylContact O-C 3.51Å; I890-R894 WeakPolarHBondContact O-CA 3.5Å; I890-R894 PolarHBondContact O-N 3.25Å
891	A	90	Very high	90.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.6	-31.5	178.4	0	0	0	0	0	113.4	C887 A888 E889 T895 W898 L930 C933	C887-A891 VanDerWaalsContact O-CB 3.28Å; C887-A891 WeakPolarHBondContact O-CB 3.39Å; C887-A891 PolarHBondContact O-N 3.01Å; A888-A891 PolarHBondContact O-N 2.94Å; E889-A891 VanDerWaalsContact C-N 3.29Å; E889-A891 PolarHBondContact O-N 3.34Å; A891-T895 WeakPolarHBondContact O-CA 3.41Å; A891-T895 VanDerWaalsContact O-CB 3.24Å; A891-T895 WeakPolarHBondContact O-CB 3.08Å; A891-T895 PolarHBondContact O-N 2.71Å; A891-T895 PolarHBondContact O-OG1 2.96Å; A891-W898 HydrophobicContact CB-CB 3.79Å; A891-W898 HydrophobicContact CB-CD2 4.02Å; A891-W898 HydrophobicContact CB-CG 3.54Å; A891-L930 HydrophobicContact CB-CD2 3.86Å; A891-C933 HydrophobicContact CB-CB 3.96Å
892	A	88.1	Confident	90.3	Very high	48 Å²	48	41.2 Å²	41.2	40%	0.397	20%	0.204	S	C	.	.	H	α-helix	trans	-75	-52.5	175.6	0	0	0	0	0	111.4	A888 E889	A888-A892 VanDerWaalsContact O-CB 3.28Å; A888-A892 WeakPolarHBondContact O-CB 3.43Å; A888-A892 PolarHBondContact O-N 3.33Å; E889-A892 PolarHBondContact O-N 3.25Å
893	Q	89.1	Confident	90.2	Very high	90 Å²	90	42.2 Å²	42.2	42%	0.421	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-52.8	178.5	-69.6	-178.9	-13.7	0	0	112.1	D452 E889	D452-Q893 PolarHBondContact OD1-NE2 3.05Å; E889-Q893 WeakPolarHBondContact O-CB 3.5Å; E889-Q893 WeakPolarHBondContact O-CG 3.23Å; E889-Q893 PolarHBondContact O-N 2.89Å
894	R	89.2	Confident	90.2	Very high	38 Å²	38	47.3 Å²	47.3	14%	0.143	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	56.5	-164.6	-77.5	167.4	-71.1	127.5	16.1	110.7	D452 R836 D837 I890 I896 N897	D452-R894 IonicContact OD2-NH2 2.66Å; D452-R894 PolarHBondContact OD2-NH2 3.47Å; R836-R894 VanDerWaalsContact NH2-CZ 3.27Å; D837-R894 IonicContact OD1-CZ 3.18Å; D837-R894 IonicContact OD1-NH1 2.79Å; D837-R894 PolarHBondContact OD1-NH1 2.93Å; D837-R894 IonicContact OD1-NH2 3.07Å; D837-R894 PolarHBondContact OD1-NH2 3.49Å; D837-R894 IonicContact OD2-CZ 2.61Å; D837-R894 IonicContact OD2-NE 3.33Å; D837-R894 IonicContact OD2-NH1 2.67Å; D837-R894 PolarHBondContact OD2-NH1 2.92Å; D837-R894 IonicContact OD2-NH2 3.62Å; I890-R894 CarbonylContact O-C 3.51Å; I890-R894 WeakPolarHBondContact O-CA 3.5Å; I890-R894 PolarHBondContact O-N 3.25Å; R894-I896 PolarHBondContact O-N 3.07Å; R894-N897 WeakPolarHBondContact O-CB 3.42Å; R894-N897 PolarHBondContact O-N 3Å
895	T	89.9	Confident	89.9	Confident	7 Å²	7	50 Å²	50	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-49.6	-30.1	-176.6	-39.2	0	0	0	0	115	A891 N897 W898 Q899 C933 S938	A891-T895 WeakPolarHBondContact O-CA 3.41Å; A891-T895 VanDerWaalsContact O-CB 3.24Å; A891-T895 WeakPolarHBondContact O-CB 3.08Å; A891-T895 PolarHBondContact O-N 2.71Å; A891-T895 PolarHBondContact O-OG1 2.96Å; T895-N897 VanDerWaalsContact C-N 3.27Å; T895-N897 PolarHBondContact O-N 2.63Å; T895-W898 WeakPolarHBondContact O-CB 3.37Å; T895-W898 PolarHBondContact O-N 2.86Å; T895-Q899 HydrophobicContact CG2-CG 4.45Å; T895-Q899 WeakPolarHBondContact O-CB 3.46Å; T895-Q899 WeakPolarHBondContact O-CG 3.28Å; T895-Q899 PolarHBondContact O-N 3.02Å; T895-C933 HydrophobicContact CG2-CB 3.98Å; T895-C933 WeakPolarHBondContact CG2-O 3.22Å; T895-S938 WeakPolarHBondContact OG1-CB 3.26Å
896	I	89.3	Confident	89.4	Confident	108 Å²	108	51.3 Å²	51.3	55%	0.554	26%	0.26	S	S	*	.	H	α-helix	trans	-62	-35.3	176.2	-63.5	173.2	0	0	0	111.4	R894 K900	R894-I896 PolarHBondContact O-N 3.07Å; I896-K900 HydrophobicContact CG2-CD 4.27Å; I896-K900 WeakPolarHBondContact O-CB 3.29Å; I896-K900 VanDerWaalsContact O-CG 3.26Å; I896-K900 WeakPolarHBondContact O-CG 3.16Å; I896-K900 PolarHBondContact O-N 2.6Å
897	N	90.3	Very high	89.2	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-75.1	-36.6	177.8	-66	-22.6	0	0	0	111.2	D837 L838 R894 T895 K900 F901	D837-N897 HydrophobicContact CB-CB 3.97Å; D837-N897 PolarHBondContact OD2-ND2 2.69Å; L838-N897 WeakPolarHBondContact CD2-O 3.35Å; R894-N897 WeakPolarHBondContact O-CB 3.42Å; R894-N897 PolarHBondContact O-N 3Å; T895-N897 VanDerWaalsContact C-N 3.27Å; T895-N897 PolarHBondContact O-N 2.63Å; N897-K900 PolarHBondContact O-N 2.97Å; N897-F901 WeakPolarHBondContact O-CB 3.47Å; N897-F901 PolarHBondContact O-N 3.22Å
898	W	92.2	Very high	89	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-45.3	169.6	174.8	-118.5	0	0	0	112.5	L841 A891 T895 F901 C902 V908 L912 L930	L841-W898 HydrophobicContact CD1-CE3 3.9Å; L841-W898 HydrophobicContact CD2-CE3 3.65Å; L841-W898 HydrophobicContact CD2-CZ3 3.96Å; L841-W898 HydrophobicContact CG-CE3 4.29Å; A891-W898 HydrophobicContact CB-CB 3.79Å; A891-W898 HydrophobicContact CB-CD2 4.02Å; A891-W898 HydrophobicContact CB-CG 3.54Å; T895-W898 WeakPolarHBondContact O-CB 3.37Å; T895-W898 PolarHBondContact O-N 2.86Å; W898-F901 HydrophobicContact CE3-CD1 4.06Å; W898-F901 AromaticContact CZ3-CD1 3.68Å; W898-F901 HydrophobicContact CZ3-CD1 3.68Å; W898-F901 HydrophobicContact CZ3-CE1 4.15Å; W898-F901 WeakPolarHBondContact O-CB 3.45Å; W898-F901 PolarHBondContact O-N 3.37Å; W898-C902 VanDerWaalsContact CE2-SG 3.54Å; W898-C902 VanDerWaalsContact CZ2-SG 3.54Å; W898-C902 PolarHBondContact O-N 3.27Å; W898-C902 PolarHBondContact O-SG 3.29Å; W898-V908 HydrophobicContact CH2-CG1 3.92Å; W898-L912 HydrophobicContact CH2-CD1 3.71Å; W898-L912 HydrophobicContact CZ2-CD1 3.85Å; W898-L930 HydrophobicContact CD2-CD2 4.29Å; W898-L930 HydrophobicContact CH2-CD2 4.05Å; W898-L930 HydrophobicContact CZ2-CB 3.93Å; W898-L930 HydrophobicContact CZ2-CD2 3.75Å; W898-L930 HydrophobicContact CZ2-CG 4.39Å; W898-L930 HydrophobicContact CZ3-CD2 4.41Å; W898-L930 PolarHBondContact NE1-O 3.13Å
899	Q	90.1	Very high	88.8	Confident	58 Å²	58	54 Å²	54	27%	0.271	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-45.5	175.2	-74.4	177.8	-37.2	0	0	111.8	T895 F901 C902 I903 A934	T895-Q899 HydrophobicContact CG2-CG 4.45Å; T895-Q899 WeakPolarHBondContact O-CB 3.46Å; T895-Q899 WeakPolarHBondContact O-CG 3.28Å; T895-Q899 PolarHBondContact O-N 3.02Å; Q899-F901 VanDerWaalsContact C-N 3.29Å; Q899-F901 PolarHBondContact O-N 3.47Å; Q899-C902 PolarHBondContact O-N 3.43Å; Q899-I903 WeakPolarHBondContact O-CD1 3.36Å; Q899-I903 VanDerWaalsContact O-CG1 3.28Å; Q899-I903 WeakPolarHBondContact O-CG1 3.28Å; Q899-I903 PolarHBondContact O-N 3.09Å; Q899-A934 WeakPolarHBondContact CG-O 3.39Å; Q899-A934 PolarHBondContact NE2-O 3.09Å
900	K	89.6	Confident	88.5	Confident	82 Å²	82	52.2 Å²	52.2	36%	0.357	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-34.4	173.6	-74.9	170.6	179.8	170.2	0	112.9	L838 I896 N897 K904	L838-K900 HydrophobicContact CD2-CB 4.35Å; I896-K900 HydrophobicContact CG2-CD 4.27Å; I896-K900 WeakPolarHBondContact O-CB 3.29Å; I896-K900 VanDerWaalsContact O-CG 3.26Å; I896-K900 WeakPolarHBondContact O-CG 3.16Å; I896-K900 PolarHBondContact O-N 2.6Å; N897-K900 PolarHBondContact O-N 2.97Å; K900-K904 PolarHBondContact O-N 3.42Å
901	F	90.9	Very high	88.2	Confident	9 Å²	9	51.5 Å²	51.5	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-48.9	174.5	-178.8	-107.5	0	0	0	111.2	L838 L841 D842 V845 N897 W898 Q899 I903 K904 D905 V908	L838-F901 HydrophobicContact CD2-CB 3.66Å; L838-F901 HydrophobicContact CD2-CD2 4.29Å; L838-F901 HydrophobicContact CD2-CG 4.47Å; L841-F901 HydrophobicContact CB-CD1 4.13Å; L841-F901 HydrophobicContact CB-CD2 4.21Å; L841-F901 HydrophobicContact CB-CE1 4.34Å; L841-F901 HydrophobicContact CB-CE2 4.44Å; L841-F901 HydrophobicContact CB-CG 4.07Å; L841-F901 HydrophobicContact CB-CZ 4.5Å; L841-F901 HydrophobicContact CD1-CB 3.99Å; L841-F901 HydrophobicContact CD1-CG 4.26Å; D842-F901 HydrophobicContact CB-CE2 3.76Å; D842-F901 HydrophobicContact CB-CZ 4.32Å; V845-F901 HydrophobicContact CB-CE1 4.26Å; V845-F901 HydrophobicContact CB-CZ 4.28Å; V845-F901 HydrophobicContact CG1-CE1 4.45Å; V845-F901 HydrophobicContact CG2-CE1 3.98Å; V845-F901 HydrophobicContact CG2-CZ 4.45Å; N897-F901 WeakPolarHBondContact O-CB 3.47Å; N897-F901 PolarHBondContact O-N 3.22Å; W898-F901 HydrophobicContact CE3-CD1 4.06Å; W898-F901 AromaticContact CZ3-CD1 3.68Å; W898-F901 HydrophobicContact CZ3-CD1 3.68Å; W898-F901 HydrophobicContact CZ3-CE1 4.15Å; W898-F901 WeakPolarHBondContact O-CB 3.45Å; W898-F901 PolarHBondContact O-N 3.37Å; Q899-F901 VanDerWaalsContact C-N 3.29Å; Q899-F901 PolarHBondContact O-N 3.47Å; F901-I903 VanDerWaalsContact C-N 3.27Å; F901-I903 PolarHBondContact O-N 2.94Å; F901-K904 WeakPolarHBondContact O-CA 3.34Å; F901-K904 WeakPolarHBondContact O-CB 3.47Å; F901-K904 PolarHBondContact O-N 2.94Å; F901-D905 PolarHBondContact O-N 2.83Å; F901-V908 HydrophobicContact CE1-CB 4.47Å; F901-V908 HydrophobicContact CE1-CG1 4.06Å; F901-V908 HydrophobicContact CE1-CG2 3.76Å; F901-V908 HydrophobicContact CZ-CG2 4.21Å
902	C	89.7	Confident	88.1	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-29.2	179.4	-64.3	0	0	0	0	113.7	W898 Q899 K904 D905 L909	W898-C902 VanDerWaalsContact CE2-SG 3.54Å; W898-C902 VanDerWaalsContact CZ2-SG 3.54Å; W898-C902 PolarHBondContact O-N 3.27Å; W898-C902 PolarHBondContact O-SG 3.29Å; Q899-C902 PolarHBondContact O-N 3.43Å; C902-K904 VanDerWaalsContact C-N 3.32Å; C902-D905 CarbonylContact O-C 3.5Å; C902-L909 HydrophobicContact CB-CD1 3.89Å; C902-L909 HydrophobicContact CB-CD2 4.06Å; C902-L909 HydrophobicContact CB-CG 3.83Å
903	I	88.8	Confident	88	Confident	133 Å²	133	52.8 Å²	52.8	68%	0.682	26%	0.258	S	S	*	.	H	α-helix	trans	-77.8	-17.9	173.8	-66.8	163.4	0	0	0	111.9	Q899 F901	Q899-I903 WeakPolarHBondContact O-CD1 3.36Å; Q899-I903 VanDerWaalsContact O-CG1 3.28Å; Q899-I903 WeakPolarHBondContact O-CG1 3.28Å; Q899-I903 PolarHBondContact O-N 3.09Å; F901-I903 VanDerWaalsContact C-N 3.27Å; F901-I903 PolarHBondContact O-N 2.94Å
904	K	88.2	Confident	87.6	Confident	149 Å²	149	51.1 Å²	51.1	65%	0.648	25%	0.25	S	C	*	.	H	α-helix	trans	-88.6	-29.8	178.5	-169.3	-170.2	172.6	-162.5	0	112.8	K900 F901 C902	K900-K904 PolarHBondContact O-N 3.42Å; F901-K904 WeakPolarHBondContact O-CA 3.34Å; F901-K904 WeakPolarHBondContact O-CB 3.47Å; F901-K904 PolarHBondContact O-N 2.94Å; C902-K904 VanDerWaalsContact C-N 3.32Å
905	D	84.8	Confident	87.2	Confident	56 Å²	56	49.4 Å²	49.4	30%	0.299	24%	0.243	S	C	.	.			trans	-130.3	91.5	171.8	178.1	9.8	0	0	0	109.7	K849 F901 C902 S907 V908	K849-D905 IonicContact NZ-OD2 2.87Å; K849-D905 PolarHBondContact NZ-OD2 2.8Å; K849-D905 VanDerWaalsContact NZ-OD2 3.11Å; F901-D905 PolarHBondContact O-N 2.83Å; C902-D905 CarbonylContact O-C 3.5Å; D905-S907 PolarHBondContact O-N 3.08Å; D905-S907 WeakPolarHBondContact OD1-CB 3.28Å; D905-S907 PolarHBondContact OD1-N 3.23Å; D905-S907 PolarHBondContact OD1-OG 3.04Å; D905-S907 PolarHBondContact OD2-OG 3.36Å; D905-V908 HydrophobicContact CB-CG2 3.8Å; D905-V908 WeakPolarHBondContact O-CB 3.48Å; D905-V908 WeakPolarHBondContact O-CG2 3.32Å; D905-V908 PolarHBondContact O-N 3.44Å; D905-V908 WeakPolarHBondContact OD2-CG2 3.26Å
906	D	82.9	Confident	86.9	Confident	135 Å²	135	49.9 Å²	49.9	72%	0.722	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-22.8	176.9	-69.3	-34.6	0	0	0	113.1	V908	D906-V908 PolarHBondContact O-N 2.99Å
907	S	85.4	Confident	86.5	Confident	32 Å²	32	51.9 Å²	51.9	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-23.9	178.1	80.5	0	0	0	0	112.9	K849 D905 F911	K849-S907 PolarHBondContact NZ-OG 2.97Å; D905-S907 PolarHBondContact O-N 3.08Å; D905-S907 WeakPolarHBondContact OD1-CB 3.28Å; D905-S907 PolarHBondContact OD1-N 3.23Å; D905-S907 PolarHBondContact OD1-OG 3.04Å; D905-S907 PolarHBondContact OD2-OG 3.36Å; S907-F911 WeakPolarHBondContact O-CB 3.39Å; S907-F911 PolarHBondContact O-N 3.48Å
908	V	87	Confident	85.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-49.1	-172.6	177.8	0	0	0	0	111.8	V845 W898 F901 D905 D906 F911 L912	V845-V908 HydrophobicContact CG1-CG1 4.34Å; V845-V908 HydrophobicContact CG1-CG2 4.1Å; W898-V908 HydrophobicContact CH2-CG1 3.92Å; F901-V908 HydrophobicContact CE1-CB 4.47Å; F901-V908 HydrophobicContact CE1-CG1 4.06Å; F901-V908 HydrophobicContact CE1-CG2 3.76Å; F901-V908 HydrophobicContact CZ-CG2 4.21Å; D905-V908 HydrophobicContact CB-CG2 3.8Å; D905-V908 WeakPolarHBondContact O-CB 3.48Å; D905-V908 WeakPolarHBondContact O-CG2 3.32Å; D905-V908 PolarHBondContact O-N 3.44Å; D905-V908 WeakPolarHBondContact OD2-CG2 3.26Å; D906-V908 PolarHBondContact O-N 2.99Å; V908-F911 PolarHBondContact O-N 3.08Å; V908-L912 HydrophobicContact CG1-CD1 3.9Å; V908-L912 HydrophobicContact CG1-CG 4.36Å; V908-L912 WeakPolarHBondContact O-CG 3.46Å; V908-L912 PolarHBondContact O-N 3.41Å
909	L	87.4	Confident	84.9	Confident	49 Å²	49	56 Å²	56	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-38.8	-178.8	-66.7	179.3	0	0	0	111.9	C902 L913 L931 A934	C902-L909 HydrophobicContact CB-CD1 3.89Å; C902-L909 HydrophobicContact CB-CD2 4.06Å; C902-L909 HydrophobicContact CB-CG 3.83Å; L909-L913 VanDerWaalsContact O-CB 3.29Å; L909-L913 WeakPolarHBondContact O-CB 3.41Å; L909-L913 PolarHBondContact O-N 3.19Å; L909-L913 VanDerWaalsContact O-N 3.14Å; L909-L931 HydrophobicContact CD2-CD2 4.18Å; L909-A934 HydrophobicContact CD1-CB 4.29Å; L909-A934 HydrophobicContact CD2-CB 3.51Å
910	Y	84.6	Confident	84.1	Confident	80 Å²	80	56.7 Å²	56.7	31%	0.314	28%	0.28	S	S	.	.	H	α-helix	trans	-62.7	-46.2	173.5	-179.2	-93.8	0	0	0	111.3	L859 S862 L913 Q914	L859-Y910 HydrophobicContact CD1-CD1 4.24Å; S862-Y910 WeakPolarHBondContact O-CE1 3.14Å; S862-Y910 VanDerWaalsContact O-CZ 3.23Å; S862-Y910 PolarHBondContact O-OH 3.42Å; Y910-L913 PolarHBondContact O-N 3.13Å; Y910-Q914 HydrophobicContact CD1-CG 4.15Å; Y910-Q914 HydrophobicContact CE1-CG 3.58Å; Y910-Q914 HydrophobicContact CE2-CG 4.09Å; Y910-Q914 WeakPolarHBondContact O-CG 3.49Å; Y910-Q914 PolarHBondContact O-N 3.21Å; Y910-Q914 PolarHBondContact OH-NE2 3.47Å
911	F	84.9	Confident	83.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.009	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-54.3	178.5	176.4	-118.4	0	0	0	112.3	I848 K849 L852 L859 V864 S907 V908 L913 Q914 V915	I848-F911 HydrophobicContact CG2-CE1 3.86Å; I848-F911 HydrophobicContact CG2-CZ 4.29Å; K849-F911 HydrophobicContact CB-CE1 4.43Å; K849-F911 HydrophobicContact CB-CZ 4.27Å; K849-F911 HydrophobicContact CD-CE1 4.5Å; K849-F911 HydrophobicContact CG-CD1 3.97Å; K849-F911 HydrophobicContact CG-CE1 3.44Å; K849-F911 VanDerWaalsContact CG-CE1 3.44Å; K849-F911 HydrophobicContact CG-CE2 4.25Å; K849-F911 HydrophobicContact CG-CZ 3.59Å; L852-F911 HydrophobicContact CD1-CZ 3.82Å; L859-F911 HydrophobicContact CB-CD2 4.24Å; L859-F911 HydrophobicContact CD1-CB 3.71Å; L859-F911 HydrophobicContact CD1-CD2 3.63Å; L859-F911 HydrophobicContact CD1-CG 4.07Å; V864-F911 HydrophobicContact CG2-CD2 4.44Å; S907-F911 WeakPolarHBondContact O-CB 3.39Å; S907-F911 PolarHBondContact O-N 3.48Å; V908-F911 PolarHBondContact O-N 3.08Å; F911-L913 VanDerWaalsContact C-N 3.27Å; F911-L913 PolarHBondContact O-N 3.38Å; F911-Q914 PolarHBondContact O-N 3.09Å; F911-Q914 VanDerWaalsContact O-N 3.14Å; F911-V915 HydrophobicContact CD2-CG2 3.79Å; F911-V915 HydrophobicContact CE1-CG2 4.29Å; F911-V915 HydrophobicContact CE2-CG2 3.51Å; F911-V915 HydrophobicContact CG-CG2 4.3Å; F911-V915 HydrophobicContact CZ-CG2 3.79Å; F911-V915 WeakPolarHBondContact O-CB 3.23Å; F911-V915 VanDerWaalsContact O-CG2 3.27Å; F911-V915 WeakPolarHBondContact O-CG2 3.41Å; F911-V915 PolarHBondContact O-N 2.83Å
912	L	87.2	Confident	82.9	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-36.2	-178.8	-66.2	175.3	0	0	0	112.1	L884 W898 V908 S916 L927 L930 L931	L884-L912 HydrophobicContact CD2-CD2 4.24Å; W898-L912 HydrophobicContact CH2-CD1 3.71Å; W898-L912 HydrophobicContact CZ2-CD1 3.85Å; V908-L912 HydrophobicContact CG1-CD1 3.9Å; V908-L912 HydrophobicContact CG1-CG 4.36Å; V908-L912 WeakPolarHBondContact O-CG 3.46Å; V908-L912 PolarHBondContact O-N 3.41Å; L912-S916 WeakPolarHBondContact O-CB 3.47Å; L912-S916 PolarHBondContact O-N 2.56Å; L912-L927 HydrophobicContact CB-CD2 4.36Å; L912-L927 HydrophobicContact CD2-CD2 3.65Å; L912-L930 HydrophobicContact CD1-CB 4.4Å; L912-L930 HydrophobicContact CD1-CD1 4.5Å; L912-L931 HydrophobicContact CB-CD2 4.24Å
913	L	85.6	Confident	82.6	Confident	75 Å²	75	63.3 Å²	63.3	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-46.5	173.9	180	61.3	0	0	0	111.9	L909 Y910 F911 S916 F917 L931	L909-L913 VanDerWaalsContact O-CB 3.29Å; L909-L913 WeakPolarHBondContact O-CB 3.41Å; L909-L913 PolarHBondContact O-N 3.19Å; L909-L913 VanDerWaalsContact O-N 3.14Å; Y910-L913 PolarHBondContact O-N 3.13Å; F911-L913 VanDerWaalsContact C-N 3.27Å; F911-L913 PolarHBondContact O-N 3.38Å; L913-S916 PolarHBondContact O-N 3.44Å; L913-S916 PolarHBondContact O-OG 2.99Å; L913-F917 HydrophobicContact CD1-CE2 3.92Å; L913-F917 HydrophobicContact CD1-CZ 4.23Å; L913-F917 HydrophobicContact CG-CE2 4.15Å; L913-F917 WeakPolarHBondContact O-CD2 3.36Å; L913-F917 WeakPolarHBondContact O-CE2 3.39Å; L913-L931 HydrophobicContact CB-CD1 4.35Å; L913-L931 HydrophobicContact CB-CD2 4.34Å; L913-L931 HydrophobicContact CD1-CD1 4.2Å
914	Q	81.2	Confident	82.3	Confident	54 Å²	54	58.1 Å²	58.1	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-42.3	177	-67.3	-57.8	-44.3	0	0	112.3	V864 Y910 F911 S916 F917	V864-Q914 HydrophobicContact CB-CB 3.86Å; V864-Q914 HydrophobicContact CB-CG 4.32Å; V864-Q914 HydrophobicContact CG2-CB 3.54Å; V864-Q914 HydrophobicContact CG2-CG 3.93Å; Y910-Q914 HydrophobicContact CD1-CG 4.15Å; Y910-Q914 HydrophobicContact CE1-CG 3.58Å; Y910-Q914 HydrophobicContact CE2-CG 4.09Å; Y910-Q914 WeakPolarHBondContact O-CG 3.49Å; Y910-Q914 PolarHBondContact O-N 3.21Å; Y910-Q914 PolarHBondContact OH-NE2 3.47Å; F911-Q914 PolarHBondContact O-N 3.09Å; F911-Q914 VanDerWaalsContact O-N 3.14Å; Q914-S916 VanDerWaalsContact C-N 3.27Å; Q914-S916 PolarHBondContact O-N 3.23Å; Q914-F917 PolarHBondContact O-N 2.93Å
915	V	81.6	Confident	82.3	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-34	177.5	171.4	0	0	0	0	111.6	L852 F911 F917 L918 V919 L927	L852-V915 HydrophobicContact CD1-CG1 3.74Å; L852-V915 HydrophobicContact CD1-CG2 3.88Å; F911-V915 HydrophobicContact CD2-CG2 3.79Å; F911-V915 HydrophobicContact CE1-CG2 4.29Å; F911-V915 HydrophobicContact CE2-CG2 3.51Å; F911-V915 HydrophobicContact CG-CG2 4.3Å; F911-V915 HydrophobicContact CZ-CG2 3.79Å; F911-V915 WeakPolarHBondContact O-CB 3.23Å; F911-V915 VanDerWaalsContact O-CG2 3.27Å; F911-V915 WeakPolarHBondContact O-CG2 3.41Å; F911-V915 PolarHBondContact O-N 2.83Å; V915-F917 PolarHBondContact O-N 3.46Å; V915-F917 VanDerWaalsContact O-N 3.1Å; V915-L918 PolarHBondContact O-N 3.32Å; V915-V919 HydrophobicContact CG1-CG2 3.63Å; V915-V919 PolarHBondContact O-N 3.08Å; V915-L927 HydrophobicContact CG1-CD1 4.06Å
916	S	83.4	Confident	82.5	Confident	18 Å²	18	53 Å²	53	13%	0.126	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-12.8	177.1	76.6	0	0	0	0	115.2	L912 L913 Q914	L912-S916 WeakPolarHBondContact O-CB 3.47Å; L912-S916 PolarHBondContact O-N 2.56Å; L913-S916 PolarHBondContact O-N 3.44Å; L913-S916 PolarHBondContact O-OG 2.99Å; Q914-S916 VanDerWaalsContact C-N 3.27Å; Q914-S916 PolarHBondContact O-N 3.23Å
917	F	79.6	Confident	82.7	Confident	150 Å²	150	46.5 Å²	46.5	66%	0.658	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-2.9	172.6	-59.5	-66.9	0	0	0	113.7	L913 Q914 V915	L913-F917 HydrophobicContact CD1-CE2 3.92Å; L913-F917 HydrophobicContact CD1-CZ 4.23Å; L913-F917 HydrophobicContact CG-CE2 4.15Å; L913-F917 WeakPolarHBondContact O-CD2 3.36Å; L913-F917 WeakPolarHBondContact O-CE2 3.39Å; Q914-F917 PolarHBondContact O-N 2.93Å; V915-F917 PolarHBondContact O-N 3.46Å; V915-F917 VanDerWaalsContact O-N 3.1Å
918	L	74.4	Confident	82.8	Confident	75 Å²	75	49.8 Å²	49.8	39%	0.393	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-8.7	-170.2	-64.5	175.3	0	0	0	114.3	I857 V864 A866 V915	I857-L918 HydrophobicContact CG2-CD1 4.08Å; V864-L918 HydrophobicContact CB-CD1 4.4Å; V864-L918 HydrophobicContact CG1-CD1 3.54Å; A866-L918 HydrophobicContact CB-CD2 4.47Å; V915-L918 PolarHBondContact O-N 3.32Å
919	V	75.4	Confident	82.9	Confident	13 Å²	13	53.7 Å²	53.7	8%	0.079	29%	0.285	C	S	.	.	S	Bend	trans	-115.9	150.3	-176.6	-177.2	0	0	0	0	110.3	L852 L872 L877 L880 V915 V923	L852-V919 HydrophobicContact CD2-CG2 4.29Å; L872-V919 HydrophobicContact CD1-CG1 3.81Å; L872-V919 HydrophobicContact CD1-CG2 4.34Å; L877-V919 HydrophobicContact CD1-CG1 4.39Å; L880-V919 HydrophobicContact CD2-CG1 4.08Å; V915-V919 HydrophobicContact CG1-CG2 3.63Å; V915-V919 PolarHBondContact O-N 3.08Å; V919-V923 HydrophobicContact CG1-CB 3.65Å; V919-V923 HydrophobicContact CG1-CG1 4.06Å; V919-V923 HydrophobicContact CG1-CG2 3.56Å
920	D	72.7	Confident	83	Confident	71 Å²	71	51.4 Å²	51.4	38%	0.38	27%	0.273	S	S	.	.			trans	-53.8	150.3	-178.1	-60.7	-80.8	0	0	0	114.4	G922 V923	D920-G922 PolarHBondContact O-N 3.35Å; D920-V923 PolarHBondContact O-N 3.37Å
921	E	76	Confident	83.2	Confident	179 Å²	179	48.4 Å²	48.4	84%	0.836	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.4	-171.6	-64.5	-170.2	144.1	0	0	114.9	V923 P925	E921-V923 VanDerWaalsContact C-N 3.28Å; E921-V923 PolarHBondContact O-N 2.83Å; E921-P925 WeakPolarHBondContact O-CD 3.23Å
922	G	79.6	Confident	83.3	Confident	55 Å²	55	49.7 Å²	49.7	57%	0.567	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-24.2	177.4	0	0	0	0	0	114.5	M881 D920	M881-G922 VanDerWaalsContact CE-O 3.27Å; M881-G922 WeakPolarHBondContact CE-O 3.38Å; D920-G922 PolarHBondContact O-N 3.35Å
923	V	83.3	Confident	83.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-31.5	-176.2	-172.7	0	0	0	0	112.1	L877 M881 L884 V919 D920 E921 P925 V926 L927	L877-V923 HydrophobicContact CD1-CG2 3.54Å; L877-V923 HydrophobicContact CG-CG2 4.49Å; M881-V923 HydrophobicContact CE-CG2 4.12Å; L884-V923 HydrophobicContact CD1-CG1 3.29Å; V919-V923 HydrophobicContact CG1-CB 3.65Å; V919-V923 HydrophobicContact CG1-CG1 4.06Å; V919-V923 HydrophobicContact CG1-CG2 3.56Å; D920-V923 PolarHBondContact O-N 3.37Å; E921-V923 VanDerWaalsContact C-N 3.28Å; E921-V923 PolarHBondContact O-N 2.83Å; V923-P925 VanDerWaalsContact C-N 3.34Å; V923-V926 PolarHBondContact O-N 3.01Å; V923-V926 VanDerWaalsContact O-N 3.08Å; V923-L927 HydrophobicContact CG1-CD1 4.01Å; V923-L927 HydrophobicContact CG1-CG 4.26Å; V923-L927 PolarHBondContact O-N 3.24Å
924	S	83.8	Confident	83.3	Confident	24 Å²	24	46.8 Å²	46.8	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-52.2	-37.6	-177.7	-51.5	0	0	0	0	115.1	V926 L927 L928	S924-V926 PolarHBondContact O-N 3.18Å; S924-L927 PolarHBondContact O-N 3.36Å; S924-L928 WeakPolarHBondContact O-CB 3.34Å; S924-L928 VanDerWaalsContact O-CG 3.28Å; S924-L928 WeakPolarHBondContact O-CG 3.12Å; S924-L928 PolarHBondContact O-N 3.46Å
925	P	87.4	Confident	83.4	Confident	79 Å²	79	50.6 Å²	50.6	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-41.1	175.7	-26.9	35.8	0	0	0	113.8	E921 V923 L928 Q929	E921-P925 WeakPolarHBondContact O-CD 3.23Å; V923-P925 VanDerWaalsContact C-N 3.34Å; P925-L928 PolarHBondContact O-N 3.27Å; P925-Q929 WeakPolarHBondContact O-CB 3.42Å; P925-Q929 PolarHBondContact O-N 3.28Å
926	V	88.5	Confident	83.3	Confident	17 Å²	17	53.2 Å²	53.2	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-73.1	-36.9	-178.5	-170.6	0	0	0	0	110.6	M881 L884 A888 V923 S924 Q929 L930	M881-V926 HydrophobicContact SD-CG2 3.98Å; L884-V926 HydrophobicContact CB-CG1 3.92Å; L884-V926 WeakPolarHBondContact O-CG1 3.35Å; A888-V926 HydrophobicContact CB-CG1 3.71Å; V923-V926 PolarHBondContact O-N 3.01Å; V923-V926 VanDerWaalsContact O-N 3.08Å; S924-V926 PolarHBondContact O-N 3.18Å; V926-Q929 PolarHBondContact O-N 3.44Å; V926-L930 WeakPolarHBondContact O-CG 3.34Å; V926-L930 PolarHBondContact O-N 3.29Å
927	L	88.1	Confident	82.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-43.2	172.3	-67.9	169.1	0	0	0	111.8	L884 L912 V915 V923 S924 L930 L931	L884-L927 HydrophobicContact CD1-CD2 4.01Å; L884-L927 HydrophobicContact CD1-CG 4.24Å; L884-L927 HydrophobicContact CD2-CD2 3.58Å; L884-L927 HydrophobicContact CD2-CG 4.48Å; L884-L927 HydrophobicContact CG-CD2 4.49Å; L912-L927 HydrophobicContact CB-CD2 4.36Å; L912-L927 HydrophobicContact CD2-CD2 3.65Å; V915-L927 HydrophobicContact CG1-CD1 4.06Å; V923-L927 HydrophobicContact CG1-CD1 4.01Å; V923-L927 HydrophobicContact CG1-CG 4.26Å; V923-L927 PolarHBondContact O-N 3.24Å; S924-L927 PolarHBondContact O-N 3.36Å; L927-L930 PolarHBondContact O-N 3.47Å; L927-L931 VanDerWaalsContact O-CG 3.29Å; L927-L931 WeakPolarHBondContact O-CG 3.36Å; L927-L931 PolarHBondContact O-N 3.26Å
928	L	86.8	Confident	81.7	Confident	101 Å²	101	48.5 Å²	48.5	53%	0.529	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-35.2	175.8	-69.7	170.5	0	0	0	112.5	S924 P925 L931 S932	S924-L928 WeakPolarHBondContact O-CB 3.34Å; S924-L928 VanDerWaalsContact O-CG 3.28Å; S924-L928 WeakPolarHBondContact O-CG 3.12Å; S924-L928 PolarHBondContact O-N 3.46Å; P925-L928 PolarHBondContact O-N 3.27Å; L928-L931 PolarHBondContact O-N 3.36Å; L928-S932 WeakPolarHBondContact O-CB 3.26Å; L928-S932 PolarHBondContact O-N 3Å; L928-S932 PolarHBondContact O-OG 3.33Å
929	Q	88.7	Confident	81	Confident	81 Å²	81	54.1 Å²	54.1	38%	0.379	31%	0.306	S	S	.	.	H	α-helix	trans	-61.8	-47	170.9	-174.6	-179.9	-3.1	0	0	111.1	P925 V926 L931 S932 C933	P925-Q929 WeakPolarHBondContact O-CB 3.42Å; P925-Q929 PolarHBondContact O-N 3.28Å; V926-Q929 PolarHBondContact O-N 3.44Å; Q929-L931 PolarHBondContact O-N 3.15Å; Q929-S932 WeakPolarHBondContact CA-OG 3.15Å; Q929-S932 PolarHBondContact O-N 3.34Å; Q929-S932 PolarHBondContact O-OG 2.75Å; Q929-C933 VanDerWaalsContact O-CB 3.32Å; Q929-C933 WeakPolarHBondContact O-CB 3.41Å; Q929-C933 PolarHBondContact O-N 2.94Å; Q929-C933 PolarHBondContact O-SG 2.78Å
930	L	89.9	Confident	80.2	Confident	1 Å²	1	57 Å²	57	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-45.3	176.1	-76	166.7	0	0	0	112.6	L884 C887 A888 A891 W898 L912 V926 L927 C933 A934	L884-L930 HydrophobicContact CD2-CD1 3.72Å; C887-L930 HydrophobicContact CB-CD1 4.14Å; C887-L930 HydrophobicContact CB-CD2 3.85Å; A888-L930 HydrophobicContact CB-CD2 4.3Å; A888-L930 HydrophobicContact CB-CG 4.29Å; A891-L930 HydrophobicContact CB-CD2 3.86Å; W898-L930 HydrophobicContact CD2-CD2 4.29Å; W898-L930 HydrophobicContact CH2-CD2 4.05Å; W898-L930 HydrophobicContact CZ2-CB 3.93Å; W898-L930 HydrophobicContact CZ2-CD2 3.75Å; W898-L930 HydrophobicContact CZ2-CG 4.39Å; W898-L930 HydrophobicContact CZ3-CD2 4.41Å; W898-L930 PolarHBondContact NE1-O 3.13Å; L912-L930 HydrophobicContact CD1-CB 4.4Å; L912-L930 HydrophobicContact CD1-CD1 4.5Å; V926-L930 WeakPolarHBondContact O-CG 3.34Å; V926-L930 PolarHBondContact O-N 3.29Å; L927-L930 PolarHBondContact O-N 3.47Å; L930-C933 PolarHBondContact O-N 3.1Å; L930-A934 PolarHBondContact O-N 3.42Å
931	L	88.2	Confident	79.5	Confident	17 Å²	17	55.9 Å²	55.9	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-41.8	178.5	-70.6	166.6	0	0	0	112.3	L909 L912 L913 L927 L928 Q929 A934 L935	L909-L931 HydrophobicContact CD2-CD2 4.18Å; L912-L931 HydrophobicContact CB-CD2 4.24Å; L913-L931 HydrophobicContact CB-CD1 4.35Å; L913-L931 HydrophobicContact CB-CD2 4.34Å; L913-L931 HydrophobicContact CD1-CD1 4.2Å; L927-L931 VanDerWaalsContact O-CG 3.29Å; L927-L931 WeakPolarHBondContact O-CG 3.36Å; L927-L931 PolarHBondContact O-N 3.26Å; L928-L931 PolarHBondContact O-N 3.36Å; Q929-L931 PolarHBondContact O-N 3.15Å; L931-A934 PolarHBondContact O-N 3.39Å; L931-L935 WeakPolarHBondContact O-CB 3.34Å; L931-L935 WeakPolarHBondContact O-CG 3.36Å; L931-L935 PolarHBondContact O-N 3.31Å
932	S	87.5	Confident	78.8	Confident	30 Å²	30	50.2 Å²	50.2	21%	0.21	30%	0.301	C	S	.	.	H	α-helix	trans	-71.2	-35.6	176.5	54.8	0	0	0	0	112.9	L928 Q929 A934 L935 C936 G937	L928-S932 WeakPolarHBondContact O-CB 3.26Å; L928-S932 PolarHBondContact O-N 3Å; L928-S932 PolarHBondContact O-OG 3.33Å; Q929-S932 WeakPolarHBondContact CA-OG 3.15Å; Q929-S932 PolarHBondContact O-N 3.34Å; Q929-S932 PolarHBondContact O-OG 2.75Å; S932-A934 VanDerWaalsContact C-N 3.28Å; S932-A934 PolarHBondContact O-N 2.96Å; S932-L935 PolarHBondContact O-N 3.29Å; S932-C936 WeakPolarHBondContact O-CA 3.39Å; S932-C936 VanDerWaalsContact O-CB 3.31Å; S932-C936 WeakPolarHBondContact O-CB 3.44Å; S932-C936 PolarHBondContact O-N 3.21Å; S932-G937 PolarHBondContact O-N 3.06Å
933	C	87.9	Confident	77.7	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-57.9	-41.3	169.5	-80.2	0	0	0	0	111.4	A891 T895 Q929 L930 G937 L941	A891-C933 HydrophobicContact CB-CB 3.96Å; T895-C933 HydrophobicContact CG2-CB 3.98Å; T895-C933 WeakPolarHBondContact CG2-O 3.22Å; Q929-C933 VanDerWaalsContact O-CB 3.32Å; Q929-C933 WeakPolarHBondContact O-CB 3.41Å; Q929-C933 PolarHBondContact O-N 2.94Å; Q929-C933 PolarHBondContact O-SG 2.78Å; L930-C933 PolarHBondContact O-N 3.1Å; C933-G937 WeakPolarHBondContact O-CA 3.45Å; C933-G937 PolarHBondContact O-N 3.05Å; C933-L941 HydrophobicContact CB-CD1 4.28Å; C933-L941 WeakPolarHBondContact SG-CD1 3.19Å
934	A	86.4	Confident	76.3	Confident	12 Å²	12	54.8 Å²	54.8	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-52.9	176.3	0	0	0	0	0	112.5	Q899 L909 L930 L931 S932	Q899-A934 WeakPolarHBondContact CG-O 3.39Å; Q899-A934 PolarHBondContact NE2-O 3.09Å; L909-A934 HydrophobicContact CD1-CB 4.29Å; L909-A934 HydrophobicContact CD2-CB 3.51Å; L930-A934 PolarHBondContact O-N 3.42Å; L931-A934 PolarHBondContact O-N 3.39Å; S932-A934 VanDerWaalsContact C-N 3.28Å; S932-A934 PolarHBondContact O-N 2.96Å
935	L	83.2	Confident	75.2	Confident	134 Å²	134	56.6 Å²	56.6	70%	0.702	34%	0.336	S	S	*	.	H	α-helix	trans	-79.3	-37.3	-169	-66.1	171.4	0	0	0	114.1	L931 S932	L931-L935 WeakPolarHBondContact O-CB 3.34Å; L931-L935 WeakPolarHBondContact O-CG 3.36Å; L931-L935 PolarHBondContact O-N 3.31Å; S932-L935 PolarHBondContact O-N 3.29Å
936	C	79.1	Confident	73.6	Confident	57 Å²	57	56.2 Å²	56.2	39%	0.385	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-32.3	-172.1	-56.1	0	0	0	0	112.4	S932 V940	S932-C936 WeakPolarHBondContact O-CA 3.39Å; S932-C936 VanDerWaalsContact O-CB 3.31Å; S932-C936 WeakPolarHBondContact O-CB 3.44Å; S932-C936 PolarHBondContact O-N 3.21Å; C936-V940 HydrophobicContact CB-CB 3.9Å; C936-V940 HydrophobicContact CB-CG1 3.88Å; C936-V940 WeakPolarHBondContact O-CB 3.43Å; C936-V940 VanDerWaalsContact O-CG2 3.27Å; C936-V940 WeakPolarHBondContact O-CG2 3.39Å
937	G	67.1	Low	71.8	Confident	9 Å²	9	58.8 Å²	58.8	9%	0.093	36%	0.359	C	S	.	.			trans	74.1	157.1	-176	0	0	0	0	0	113.7	S932 C933 K939 V940 L941	S932-G937 PolarHBondContact O-N 3.06Å; C933-G937 WeakPolarHBondContact O-CA 3.45Å; C933-G937 PolarHBondContact O-N 3.05Å; G937-K939 VanDerWaalsContact C-N 3.3Å; G937-K939 PolarHBondContact O-N 2.72Å; G937-K939 VanDerWaalsContact O-N 3.11Å; G937-V940 PolarHBondContact O-N 3.35Å; G937-L941 PolarHBondContact O-N 3.16Å; G937-L941 VanDerWaalsContact O-N 3.15Å
938	S	62.8	Low	69.8	Low	60 Å²	60	62.4 Å²	62.4	42%	0.42	38%	0.384	S	S	.	.	H	α-helix	trans	-46.3	-45.8	-173.7	165.1	0	0	0	0	114.2	T895 V940 L941 A942	T895-S938 WeakPolarHBondContact OG1-CB 3.26Å; S938-V940 VanDerWaalsContact C-N 3.3Å; S938-V940 PolarHBondContact O-N 3.22Å; S938-L941 PolarHBondContact O-N 3.25Å; S938-A942 WeakPolarHBondContact O-CB 3.43Å; S938-A942 PolarHBondContact O-N 3.28Å
939	K	57.9	Low	67.6	Low	192 Å²	192	60.5 Å²	60.5	84%	0.835	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-27.4	-176.8	-66.2	-171.9	176.6	-174.5	0	114.4	G937 A943	G937-K939 VanDerWaalsContact C-N 3.3Å; G937-K939 PolarHBondContact O-N 2.72Å; G937-K939 VanDerWaalsContact O-N 3.11Å; K939-A943 WeakPolarHBondContact O-CB 3.18Å; K939-A943 PolarHBondContact O-N 3.33Å
940	V	58.8	Low	65.2	Low	73 Å²	73	61.3 Å²	61.3	44%	0.442	40%	0.404	S	S	.	.	H	α-helix	trans	-85	-36.9	175.4	179.8	0	0	0	0	110.4	C936 G937 S938 A943 L944	C936-V940 HydrophobicContact CB-CB 3.9Å; C936-V940 HydrophobicContact CB-CG1 3.88Å; C936-V940 WeakPolarHBondContact O-CB 3.43Å; C936-V940 VanDerWaalsContact O-CG2 3.27Å; C936-V940 WeakPolarHBondContact O-CG2 3.39Å; G937-V940 PolarHBondContact O-N 3.35Å; S938-V940 VanDerWaalsContact C-N 3.3Å; S938-V940 PolarHBondContact O-N 3.22Å; V940-A943 PolarHBondContact O-N 2.78Å; V940-L944 HydrophobicContact CG1-CD1 4.09Å; V940-L944 HydrophobicContact CG1-CG 4.48Å; V940-L944 WeakPolarHBondContact O-CB 3.36Å; V940-L944 WeakPolarHBondContact O-CG 2.89Å; V940-L944 PolarHBondContact O-N 3.23Å
941	L	59.3	Low	62.7	Low	48 Å²	48	66.2 Å²	66.2	25%	0.251	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-45.8	172.5	-93	166.3	0	0	0	112.5	C933 G937 S938 A943 L944 A945	C933-L941 HydrophobicContact CB-CD1 4.28Å; C933-L941 WeakPolarHBondContact SG-CD1 3.19Å; G937-L941 PolarHBondContact O-N 3.16Å; G937-L941 VanDerWaalsContact O-N 3.15Å; S938-L941 PolarHBondContact O-N 3.25Å; L941-A943 VanDerWaalsContact C-N 3.32Å; L941-A943 PolarHBondContact O-N 2.8Å; L941-L944 PolarHBondContact O-N 3.21Å; L941-A945 WeakPolarHBondContact O-CB 3.47Å; L941-A945 PolarHBondContact O-N 2.9Å
942	A	60.1	Low	60.3	Low	61 Å²	61	70.6 Å²	70.6	50%	0.504	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-40	175.2	0	0	0	0	0	112	S938 A945 A946	S938-A942 WeakPolarHBondContact O-CB 3.43Å; S938-A942 PolarHBondContact O-N 3.28Å; A942-A945 PolarHBondContact O-N 2.93Å; A942-A946 VanDerWaalsContact O-CB 3.3Å; A942-A946 WeakPolarHBondContact O-CB 3.28Å; A942-A946 PolarHBondContact O-N 3.12Å
943	A	56.4	Low	57.6	Low	59 Å²	59	74.2 Å²	74.2	49%	0.488	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-38.1	175	0	0	0	0	0	112.6	K939 V940 L941 S947	K939-A943 WeakPolarHBondContact O-CB 3.18Å; K939-A943 PolarHBondContact O-N 3.33Å; V940-A943 PolarHBondContact O-N 2.78Å; L941-A943 VanDerWaalsContact C-N 3.32Å; L941-A943 PolarHBondContact O-N 2.8Å; A943-S947 WeakPolarHBondContact O-CB 2.97Å; A943-S947 PolarHBondContact O-N 3.08Å
944	L	55.1	Low	54.8	Low	92 Å²	92	79.3 Å²	79.3	48%	0.482	54%	0.538	S	S	.	.	H	α-helix	trans	-66.1	-46.8	174.7	-74.6	166.5	0	0	0	111.2	V940 L941 A946 S947 S948	V940-L944 HydrophobicContact CG1-CD1 4.09Å; V940-L944 HydrophobicContact CG1-CG 4.48Å; V940-L944 WeakPolarHBondContact O-CB 3.36Å; V940-L944 WeakPolarHBondContact O-CG 2.89Å; V940-L944 PolarHBondContact O-N 3.23Å; L941-L944 PolarHBondContact O-N 3.21Å; L944-A946 PolarHBondContact O-N 3.3Å; L944-S947 PolarHBondContact O-N 3.47Å; L944-S947 VanDerWaalsContact O-N 3.12Å; L944-S947 PolarHBondContact O-OG 3.16Å; L944-S948 PolarHBondContact O-N 3.08Å; L944-S948 PolarHBondContact O-OG 3.36Å; L944-S948 VanDerWaalsContact O-OG 3.06Å
945	A	59.7	Low	52.1	Low	62 Å²	62	84.7 Å²	84.7	51%	0.512	57%	0.574	S	S	.	*	H	α-helix	trans	-58.1	-48.2	175.7	0	0	0	0	0	112	L941 A942 S947 S948 G949	L941-A945 WeakPolarHBondContact O-CB 3.47Å; L941-A945 PolarHBondContact O-N 2.9Å; A942-A945 PolarHBondContact O-N 2.93Å; A945-S947 VanDerWaalsContact C-N 3.29Å; A945-S947 PolarHBondContact O-N 2.86Å; A945-S948 WeakPolarHBondContact CA-OG 3.45Å; A945-S948 PolarHBondContact O-N 2.73Å; A945-S948 PolarHBondContact O-OG 2.89Å; A945-G949 PolarHBondContact O-N 2.86Å
946	A	53.4	Low	49.5	Very low	72 Å²	72	83.1 Å²	83.1	60%	0.595	57%	0.574	S	S	*	*	H	α-helix	trans	-61.1	-35.9	175.1	0	0	0	0	0	112.5	A942 L944	A942-A946 VanDerWaalsContact O-CB 3.3Å; A942-A946 WeakPolarHBondContact O-CB 3.28Å; A942-A946 PolarHBondContact O-N 3.12Å; L944-A946 PolarHBondContact O-N 3.3Å
947	S	50.8	Low	47.1	Very low	70 Å²	70	85.8 Å²	85.8	49%	0.49	59%	0.594	S	S	.	*	H	α-helix	trans	-68.2	-41.4	175.8	78	0	0	0	0	112.5	A943 L944 A945 S950	A943-S947 WeakPolarHBondContact O-CB 2.97Å; A943-S947 PolarHBondContact O-N 3.08Å; L944-S947 PolarHBondContact O-N 3.47Å; L944-S947 VanDerWaalsContact O-N 3.12Å; L944-S947 PolarHBondContact O-OG 3.16Å; A945-S947 VanDerWaalsContact C-N 3.29Å; A945-S947 PolarHBondContact O-N 2.86Å; S947-S950 PolarHBondContact O-N 2.83Å; S947-S950 PolarHBondContact O-OG 3.06Å
948	S	47.1	Very low	45.2	Very low	76 Å²	76	89.9 Å²	89.9	53%	0.531	63%	0.627	S	S	.	*	H	α-helix	trans	-68.4	-37.5	177.7	39.8	0	0	0	0	113.1	L944 A945 S950 S951	L944-S948 PolarHBondContact O-N 3.08Å; L944-S948 PolarHBondContact O-OG 3.36Å; L944-S948 VanDerWaalsContact O-OG 3.06Å; A945-S948 WeakPolarHBondContact CA-OG 3.45Å; A945-S948 PolarHBondContact O-N 2.73Å; A945-S948 PolarHBondContact O-OG 2.89Å; S948-S950 PolarHBondContact O-N 3.23Å; S948-S951 PolarHBondContact O-OG 3.36Å
949	G	40.2	Very low	44.4	Very low	62 Å²	62	92.7 Å²	92.7	64%	0.639	64%	0.643	S	S	*	*	H	α-helix	trans	-67.1	-13.4	176.4	0	0	0	0	0	114.8	A945 S951	A945-G949 PolarHBondContact O-N 2.86Å; G949-S951 PolarHBondContact O-N 2.7Å
950	S	38.5	Very low	42.9	Very low	98 Å²	98	90.1 Å²	90.1	69%	0.685	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	4.1	-177.1	73.8	0	0	0	0	115.4	S947 S948	S947-S950 PolarHBondContact O-N 2.83Å; S947-S950 PolarHBondContact O-OG 3.06Å; S948-S950 PolarHBondContact O-N 3.23Å
951	S	37.9	Very low	41.4	Very low	104 Å²	104	91.3 Å²	91.3	73%	0.727	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	11.6	-163	58.1	0	0	0	0	116.7	S948 G949	S948-S951 PolarHBondContact O-OG 3.36Å; G949-S951 PolarHBondContact O-N 2.7Å
952	S	37.4	Very low	39.9	Very low	109 Å²	109	93.5 Å²	93.5	76%	0.762	69%	0.686	S	S	*	*	S	Bend	trans	-149.9	71	179	66.2	0	0	0	0	116.8
953	A	30.3	Very low	38.4	Very low	106 Å²	106	95.8 Å²	95.8	88%	0.876	70%	0.699	S	S	*	*			trans	-168.3	137.1	149.1	0	0	0	0	0	110.9
954	S	30.1	Very low	37	Very low	110 Å²	110	98.8 Å²	98.8	77%	0.769	72%	0.716	S	S	*	*			trans	-141.6	142.1	174.8	62.5	0	0	0	0	112.6
955	S	29.1	Very low	35.8	Very low	124 Å²	124	97.5 Å²	97.5	87%	0.867	73%	0.725	S	S	*	*			trans	64.7	147.6	-175.9	73.4	0	0	0	0	115.2
956	S	29.2	Very low	34.3	Very low	101 Å²	101	104.2 Å²	104.2	71%	0.706	75%	0.746	S	S	*	*			cis	-153.5	151.7	27.5	54.9	0	0	0	0	115.7
957	S	28.9	Very low	33.1	Very low	114 Å²	114	104.4 Å²	104.4	80%	0.797	75%	0.747	S	S	*	*			trans	51.4	117.2	149.9	55.8	0	0	0	0	122.5
958	A	26.8	Very low	31.8	Very low	94 Å²	94	106.9 Å²	106.9	78%	0.777	76%	0.759	S	S	*	*			trans	-70.2	-169.3	160.6	0	0	0	0	0	112.5
959	P	45.8	Very low	30.8	Very low	119 Å²	119	109 Å²	109	77%	0.773	77%	0.769	S	S	*	*			cis	-127.2	-163.9	3.3	33.8	-8.3	0	0	0	112.7
960	V	26.6	Very low	30.1	Very low	139 Å²	139	114.6 Å²	114.6	84%	0.842	78%	0.779	S	S	*	*				-161	157.8	59.8	172.4	0	0	0	0	109.9
961	A	27.6	Very low	29.6	Very low	97 Å²	97	113.9 Å²	113.9	80%	0.802	77%	0.774	S	S	*	*			trans	-112.6	158.5	-176.5	0	0	0	0	0	114.5
962	A	27.2	Very low	29.1	Very low	95 Å²	95	118.3 Å²	118.3	79%	0.785	78%	0.78	S	S	*	*			trans	-149.8	138.8	157.1	0	0	0	0	0	112.8
963	S	27.7	Very low	28.7	Very low	109 Å²	109	117.6 Å²	117.6	76%	0.762	78%	0.775	S	S	*	*			trans	-25.5	157.3	157.3	46.7	0	0	0	0	117.8
964	S	28.7	Very low	28.6	Very low	121 Å²	121	117.7 Å²	117.7	85%	0.846	77%	0.769	S	S	*	*			cis	-174	166.7	8.8	35.2	0	0	0	0	109.1
965	G	28.2	Very low	28.6	Very low	66 Å²	66	117.5 Å²	117.5	68%	0.68	76%	0.764	S	S	*	*			cis	152.8	149.6	-2.1	0	0	0	0	0	111.6
966	Q	29.8	Very low	28.6	Very low	203 Å²	203	120.7 Å²	120.7	95%	0.949	76%	0.762	S	S	*	*			trans	65.6	150.2	178.8	-70.1	176	-25.7	0	0	116
967	A	26.4	Very low	28.5	Very low	75 Å²	75	125.1 Å²	125.1	62%	0.62	77%	0.768	S	S	*	*			cis	-154	133.9	-7.1	0	0	0	0	0	107.9
968	T	24.3	Very low	28.5	Very low	122 Å²	122	124.7 Å²	124.7	75%	0.748	77%	0.766	S	S	*	*				43.3	128.3	82.5	62.1	0	0	0	0	114.4
969	T	26.2	Very low	28.7	Very low	120 Å²	120	130 Å²	130	74%	0.736	77%	0.771	S	S	*	*			cis	-171.8	179.9	11.2	11.4	0	0	0	0	110.7
970	Q	26.3	Very low	27.9	Very low	181 Å²	181	133.1 Å²	133.1	85%	0.846	77%	0.773	S	S	*	*			trans	86.8	154.2	161.6	-52.3	-169.8	14.6	0	0	118.4
971	S	27	Very low	28.1	Very low	83 Å²	83	133 Å²	133	58%	0.58	76%	0.763	S	S	*	*				-176.8	150.2	-55.8	53.1	0	0	0	0	111.6
972	K	28	Very low	28.2	Very low	197 Å²	197	137 Å²	137	86%	0.857	77%	0.765	S	S	*	*			trans	67.8	155.2	161.6	-69.3	170.4	-177.8	174.3	0	116.1
973	S	27.9	Very low	28.4	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	77%	0.768	S	S	*	*			cis	-171.8	146.8	-16	47.6	0	0	0	0	113
974	S	29.4	Very low	28.5	Very low	109 Å²	109	149 Å²	149	76%	0.762	79%	0.789	S	S	*	*			trans	65.7	154.1	153.4	66.9	0	0	0	0	117.8
975	T	29	Very low	28.5	Very low	106 Å²	106	150.4 Å²	150.4	65%	0.65	79%	0.787	S	S	*	*			cis	-158	154.6	35.7	-56.6	0	0	0	0	112.9
976	K	29.2	Very low	28.5	Very low	191 Å²	191	154.8 Å²	154.8	83%	0.83	79%	0.792	S	S	*	*			trans	5	152.2	156.1	-51	160.7	-174.2	168	0	118.7
977	K	28.1	Very low	28.5	Very low	193 Å²	193	152.1 Å²	152.1	84%	0.839	78%	0.783	S	S	*	*			cis	-168.8	164.5	31.8	-141.2	-175.7	175.5	-171.6	0	105.9
978	S	28.2	Very low	28.6	Very low	106 Å²	106	156.6 Å²	156.6	74%	0.741	79%	0.793	S	S	*	*			cis	-150.7	164.7	21	-57.4	0	0	0	0	111.6
979	K	30.8	Very low	28.8	Very low	206 Å²	206	158.8 Å²	158.8	90%	0.896	80%	0.796	S	S	*	*			trans	-110.5	138	171.8	176.5	-175.2	178.4	-178	0	109
980	K	28.3	Very low	29	Very low	184 Å²	184	161.4 Å²	161.4	80%	0.8	80%	0.8	S	S	*	*			trans	-141.3	163.6	162.1	-162.4	171.2	177.5	-169.7	0	109.6
981	E	31.4	Very low	29.2	Very low	136 Å²	136	160 Å²	160	64%	0.636	80%	0.797	S	S	*	*			trans	-41.9	163.3	178.5	-74.9	101.4	172.9	0	0	116.2
982	E	29.6	Very low	29.4	Very low	182 Å²	182	165.9 Å²	165.9	85%	0.85	81%	0.813	S	S	*	*			cis	-144.1	173.5	24.3	-148.3	125.4	-156	0	0	114.2
983	K	31.5	Very low	29.5	Very low	193 Å²	193	163.3 Å²	163.3	84%	0.839	81%	0.81	S	S	*	*			trans	-144	94.1	177.4	-175.9	-142.2	170.6	-166.1	0	110.8
984	E	30.6	Very low	29.6	Very low	261 Å²	261	169.7 Å²	169.7	100%	1.22	82%	0.824	S	S	*	*			trans	-122.2	0	151.6	-70.2	-168.2	131.7	0	0	108

Retrieved 984 of 984 residues in 273.8 ms (Link to these results)

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